ASSAY_ID ASSAY PROJECT PLATE WELL WELL_TYPE RAW_VALUE_A BSUB_VALUE_A Z_SCORE_A RAW_VALUE_B BSUB_VALUE_B Z_SCORE_B COMPOSITE_Z REPRODUCIBILITY CHEMBANK_ID VIRTUAL_ID SMILES 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A01 compound treatment 542662.5514 -1630.0 -0.01 502456.4315 -88500.0 -0.47 -0.3372 -0.7183 PhilEx2_000001 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A02 compound treatment 594626.2626 50300.0 0.23 416985.2217 -174000.0 -0.92 -0.4883 -0.5132 PhilEx2_000002 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A03 compound treatment 645159.3625 101000.0 0.47 565313.0841 -25600.0 -0.14 0.2328 0.4804 PhilEx2_000003 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A04 compound treatment 521702.8302 -22600.0 -0.1 512788.3598 -78100.0 -0.41 -0.3668 -0.8581 PhilEx2_000004 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A05 compound treatment 659422.1106 115000.0 0.53 601054.3933 10100.0 0.05 0.4134 0.7746 PhilEx2_000005 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A06 compound treatment 460670.2128 -83600.0 -0.39 410808.642 -180000.0 -0.96 -0.9483 -0.9204 PhilEx2_000006 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A07 compound treatment 590391.129 46100.0 0.21 622139.8305 31200.0 0.17 0.2674 0.9923 PhilEx2_000007 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A08 compound treatment 490668.1223 -53600.0 -0.25 542598.1735 -48300.0 -0.26 -0.3562 -0.9998 PhilEx2_000008 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A09 compound treatment 722384.2975 178000.0 0.82 736718.0617 146000.0 0.77 1.1275 0.9995 PhilEx2_000009 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A10 compound treatment 751334.9057 207000.0 0.95 622642.2414 31700.0 0.17 0.7941 0.819 PhilEx2_000010 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A11 compound treatment 552278.5388 7990.0 0.04 487910.5691 -103000.0 -0.55 -0.3604 -0.6579 PhilEx2_000011 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A12 compound treatment 786698.5646 242000.0 1.12 668521.5517 77600.0 0.41 1.0814 0.9078 PhilEx2_000012 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A13 compound treatment 390672.0 -154000.0 -0.71 480508.0645 -110000.0 -0.59 -0.9151 -0.9955 PhilEx2_000013 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A14 compound treatment 660543.9331 116000.0 0.54 601709.5436 10800.0 0.06 0.4195 0.7781 PhilEx2_000014 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A15 compound treatment 633302.3256 89000.0 0.41 493495.5357 -97400.0 -0.52 -0.0752 -0.1139 PhilEx2_000015 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A16 compound treatment 693119.1336 149000.0 0.69 755242.915 164000.0 0.87 1.1015 0.993 PhilEx2_000016 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A17 compound treatment 315012.1951 -229000.0 -1.06 260807.947 -330000.0 -1.75 -1.9858 -0.9708 PhilEx2_000017 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A18 compound treatment 399653.3865 -145000.0 -0.67 536922.0779 -54000.0 -0.29 -0.6742 -0.9288 PhilEx2_000018 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A19 compound treatment 491155.3398 -53100.0 -0.25 490087.3786 -101000.0 -0.53 -0.5515 -0.9374 PhilEx2_000019 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A20 compound treatment 530392.2261 -13900.0 -0.06 523450.0 -67500.0 -0.36 -0.2984 -0.8207 PhilEx2_000020 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A21 compound treatment 625823.0453 81500.0 0.38 524504.386 -66400.0 -0.35 0.0167 0.0324 PhilEx2_000021 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A22 compound treatment 487387.8327 -56900.0 -0.26 504981.4815 -86000.0 -0.46 -0.5079 -0.9656 PhilEx2_000022 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A23 mock treatment 572047.3934 27800.0 0.13 519156.7797 -71800.0 -0.38 -0.1787 -0.4449 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 A24 mock treatment 953447.9769 409000.0 1.89 741468.254 151000.0 0.8 1.8988 0.9268 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B01 compound treatment 705333.3333 161000.0 0.74 641282.9268 50300.0 0.27 0.714 0.9046 PhilEx2_000023 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B02 compound treatment 589730.0 45400.0 0.21 584480.198 -6460.0 -0.03 0.124 0.5838 PhilEx2_000024 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B03 compound treatment 739561.2648 195000.0 0.9 669497.8723 78600.0 0.42 0.9314 0.9387 PhilEx2_000025 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B04 compound treatment 542324.5614 -1970.0 -0.01 498963.3028 -92000.0 -0.49 -0.3514 -0.7201 PhilEx2_000026 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B05 compound treatment 592342.1927 48100.0 0.22 502009.772 -88900.0 -0.47 -0.1768 -0.3393 PhilEx2_000027 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B06 compound treatment 402409.9099 -142000.0 -0.65 435277.7778 -156000.0 -0.83 -1.0465 -0.9934 PhilEx2_000028 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B07 compound treatment 670667.9842 126000.0 0.58 665891.6667 75000.0 0.4 0.6932 0.9826 PhilEx2_000029 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B08 compound treatment 631812.7854 87500.0 0.4 456304.9327 -135000.0 -0.71 -0.2195 -0.2676 PhilEx2_000030 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B09 compound treatment 762759.3361 218000.0 1.01 642331.9502 51400.0 0.27 0.9052 0.8672 PhilEx2_000031 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B10 compound treatment 562919.4313 18600.0 0.09 50586.2069 -540000.0 -2.87 -1.9658 -0.6856 PhilEx2_000032 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B11 compound treatment 644560.7843 100000.0 0.46 663245.4545 72300.0 0.38 0.5982 0.9957 PhilEx2_000033 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B12 compound treatment 631124.424 86800.0 0.4 599889.3617 8950.0 0.05 0.3167 0.7854 PhilEx2_000034 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B13 compound treatment 666276.7857 122000.0 0.56 622572.5806 31600.0 0.17 0.5164 0.8797 PhilEx2_000035 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B14 compound treatment 635132.3529 90800.0 0.42 483452.8302 -107000.0 -0.57 -0.1069 -0.1511 PhilEx2_000036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B15 compound treatment 690101.2146 146000.0 0.67 673312.5 82400.0 0.44 0.7844 0.9782 PhilEx2_000037 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B16 compound treatment 559745.4545 15500.0 0.07 557441.7476 -33500.0 -0.18 -0.0752 -0.393 PhilEx2_000038 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B17 compound treatment 577746.8354 33500.0 0.15 514600.0 -76300.0 -0.4 -0.1772 -0.409 PhilEx2_000039 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B18 compound treatment 703336.1345 159000.0 0.73 779300.0 188000.0 1.0 1.2251 0.9885 PhilEx2_000040 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B19 compound treatment 413362.2642 -131000.0 -0.6 530340.0 -60600.0 -0.32 -0.6542 -0.9564 PhilEx2_000041 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B20 compound treatment 645912.8631 102000.0 0.47 568908.4507 -22000.0 -0.12 0.2488 0.515 PhilEx2_000042 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B21 compound treatment 454720.4724 -89600.0 -0.41 490515.5039 -100000.0 -0.53 -0.6687 -0.9921 PhilEx2_000043 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B22 compound treatment 654377.5934 110000.0 0.51 451321.7993 -140000.0 -0.74 -0.1646 -0.1834 PhilEx2_000044 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B23 mock treatment 528816.1435 -15500.0 -0.07 477182.5095 -114000.0 -0.6 -0.4771 -0.7853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 B24 mock treatment 555430.3279 11100.0 0.05 574014.3885 -16900.0 -0.09 -0.0271 -0.2625 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C01 compound treatment 466640.0 -77700.0 -0.36 389931.8182 -201000.0 -1.07 -1.0071 -0.8955 PhilEx2_000045 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C02 compound treatment 583273.224 39000.0 0.18 519969.0722 -71000.0 -0.38 -0.1391 -0.3333 PhilEx2_000046 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C03 compound treatment 749123.9316 205000.0 0.94 663577.5862 72600.0 0.39 0.9404 0.9218 PhilEx2_000047 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C04 compound treatment 452009.9502 -92300.0 -0.43 395988.9503 -195000.0 -1.03 -1.0321 -0.923 PhilEx2_000048 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C05 compound treatment 663272.0307 119000.0 0.55 517738.4615 -73200.0 -0.39 0.1135 0.1688 PhilEx2_000049 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C06 compound treatment 428717.5141 -116000.0 -0.53 437686.8132 -153000.0 -0.81 -0.9516 -0.9791 PhilEx2_000050 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C07 compound treatment 611281.746 67000.0 0.31 690446.0967 99500.0 0.53 0.5917 0.9675 PhilEx2_000051 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C08 compound treatment 483813.5593 -60500.0 -0.28 278092.1986 -313000.0 -1.66 -1.3705 -0.8145 PhilEx2_000052 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C09 compound treatment 602095.8904 57800.0 0.27 529431.8182 -61500.0 -0.33 -0.0422 -0.1001 PhilEx2_000053 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C10 compound treatment 606253.2189 62000.0 0.29 619333.3333 28400.0 0.15 0.3085 0.9552 PhilEx2_000054 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C11 compound treatment 319901.7857 -224000.0 -1.03 180833.3333 -410000.0 -2.18 -2.2698 -0.9423 PhilEx2_000055 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C12 compound treatment 659572.549 115000.0 0.53 674432.2034 83500.0 0.44 0.6891 0.9959 PhilEx2_000056 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C13 compound treatment 595578.5124 51300.0 0.24 610798.4791 19900.0 0.11 0.2417 0.9336 PhilEx2_000057 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C14 compound treatment 686124.424 142000.0 0.65 506996.0 -83900.0 -0.45 0.1477 0.1866 PhilEx2_000058 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C15 compound treatment 612886.3636 68600.0 0.32 579703.1802 -11200.0 -0.06 0.1815 0.564 PhilEx2_000059 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C16 compound treatment 688766.3551 144000.0 0.67 618907.0796 28000.0 0.15 0.576 0.8439 PhilEx2_000060 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C17 compound treatment 505000.0 -39300.0 -0.18 402199.115 -189000.0 -1.0 -0.836 -0.8217 PhilEx2_000061 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C18 compound treatment 640398.19 96100.0 0.44 623635.1931 32700.0 0.17 0.436 0.9162 PhilEx2_000062 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C19 compound treatment 594550.9434 50300.0 0.23 507272.3577 -83700.0 -0.44 -0.1499 -0.2994 PhilEx2_000063 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C20 compound treatment 681894.958 138000.0 0.63 536360.5442 -54600.0 -0.29 0.244 0.3499 PhilEx2_000064 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C21 compound treatment 329503.2258 -215000.0 -0.99 251122.807 -340000.0 -1.8 -1.9749 -0.9603 PhilEx2_000065 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C22 compound treatment 571461.8321 27200.0 0.13 491433.3333 -99500.0 -0.53 -0.2846 -0.5246 PhilEx2_000066 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C23 mock treatment 484420.0 -59900.0 -0.28 544775.4237 -46200.0 -0.24 -0.3684 -0.9982 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 C24 mock treatment 509273.913 -35000.0 -0.16 523303.0303 -67600.0 -0.36 -0.3679 -0.935 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D01 compound treatment 673376.1905 129000.0 0.6 618045.2675 27100.0 0.14 0.5226 0.8534 PhilEx2_000067 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D02 compound treatment 603605.0 59300.0 0.27 586010.0 -4930.0 -0.03 0.1749 0.6366 PhilEx2_000068 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D03 compound treatment 687022.3048 143000.0 0.66 457293.8931 -134000.0 -0.71 -0.0358 -0.037 PhilEx2_000069 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D04 compound treatment 402541.958 -142000.0 -0.65 464217.5926 -127000.0 -0.67 -0.9375 -0.9999 PhilEx2_000070 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D05 compound treatment 573764.7059 29500.0 0.14 622716.4751 31800.0 0.17 0.2153 0.9943 PhilEx2_000071 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D06 compound treatment 348362.3853 -196000.0 -0.9 310581.9209 -280000.0 -1.49 -1.6904 -0.9715 PhilEx2_000072 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D07 compound treatment 661342.5197 117000.0 0.54 673312.0 82400.0 0.44 0.6906 0.9945 PhilEx2_000073 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D08 compound treatment 443815.534 -100000.0 -0.46 503128.3186 -87800.0 -0.47 -0.657 -1.0 PhilEx2_000074 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D09 compound treatment 614867.8414 70600.0 0.33 608546.2185 17600.0 0.09 0.2962 0.8747 PhilEx2_000075 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D10 compound treatment 454068.3761 -90200.0 -0.42 430732.1429 -160000.0 -0.85 -0.8951 -0.946 PhilEx2_000076 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D11 compound treatment 792130.1775 248000.0 1.14 613038.4615 22100.0 0.12 0.8911 0.7756 PhilEx2_000077 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D12 compound treatment 508892.1569 -35400.0 -0.16 488900.0 -102000.0 -0.54 -0.4981 -0.8812 PhilEx2_000078 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D13 compound treatment 705306.9767 161000.0 0.74 628387.234 37400.0 0.2 0.6655 0.8658 PhilEx2_000079 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D14 compound treatment 437724.8908 -107000.0 -0.49 495462.1849 -95500.0 -0.51 -0.7056 -0.9999 PhilEx2_000080 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D15 compound treatment 468930.4029 -75400.0 -0.35 624845.5598 33900.0 0.18 -0.1186 -0.303 PhilEx2_000081 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D16 compound treatment 601041.6667 56800.0 0.26 393508.4746 -197000.0 -1.05 -0.5554 -0.5146 PhilEx2_000082 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D17 compound treatment 504942.5287 -39300.0 -0.18 627956.5217 37000.0 0.2 0.0105 0.0394 PhilEx2_000083 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D18 compound treatment 552004.9261 7710.0 0.04 517584.0 -73400.0 -0.39 -0.25 -0.6398 PhilEx2_000084 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D19 compound treatment 457053.9568 -87200.0 -0.4 456924.6032 -134000.0 -0.71 -0.7871 -0.9637 PhilEx2_000085 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D20 compound treatment 691024.5902 147000.0 0.68 498613.3829 -92300.0 -0.49 0.1322 0.1583 PhilEx2_000086 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D21 compound treatment 629792.6829 85500.0 0.39 416545.4545 -174000.0 -0.92 -0.3752 -0.3732 PhilEx2_000087 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D22 compound treatment 600286.2903 56000.0 0.26 441214.2857 -150000.0 -0.79 -0.3789 -0.4538 PhilEx2_000088 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D23 mock treatment 535786.6109 -8500.0 -0.04 501490.3475 -89400.0 -0.47 -0.3632 -0.763 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 D24 mock treatment 755840.9639 212000.0 0.98 518552.8169 -72400.0 -0.38 0.4184 0.399 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E01 compound treatment 502380.2817 -41900.0 -0.19 493601.81 -97300.0 -0.52 -0.5017 -0.9101 PhilEx2_000089 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E02 compound treatment 349107.1429 -195000.0 -0.9 378538.9222 -212000.0 -1.13 -1.4331 -0.9938 PhilEx2_000090 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E03 compound treatment 612058.296 67800.0 0.31 575232.8767 -15700.0 -0.08 0.1621 0.5011 PhilEx2_000091 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E04 compound treatment 382381.2155 -162000.0 -0.75 416692.3077 -174000.0 -0.92 -1.1815 -0.9944 PhilEx2_000092 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E05 compound treatment 662786.4078 118000.0 0.55 527275.4237 -63700.0 -0.34 0.1476 0.2298 PhilEx2_000093 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E06 compound treatment 530279.0698 -14000.0 -0.06 430296.1165 -161000.0 -0.85 -0.6482 -0.7586 PhilEx2_000094 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E07 compound treatment 605137.3239 60800.0 0.28 588003.8023 -2930.0 -0.02 0.1874 0.6669 PhilEx2_000095 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E08 compound treatment 598837.2093 54500.0 0.25 400195.0207 -191000.0 -1.01 -0.5375 -0.5156 PhilEx2_000096 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E09 compound treatment 710179.8246 166000.0 0.77 596424.9084 5490.0 0.03 0.5615 0.7335 PhilEx2_000097 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E10 compound treatment 658263.1579 114000.0 0.53 586494.6237 -4440.0 -0.02 0.355 0.6747 PhilEx2_000098 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E11 compound treatment 463815.3153 -80500.0 -0.37 444871.2121 -146000.0 -0.77 -0.8102 -0.9432 PhilEx2_000099 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E12 compound treatment 520060.4982 -24200.0 -0.11 539231.0757 -51700.0 -0.27 -0.2729 -0.9216 PhilEx2_000100 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E13 compound treatment 455145.2991 -89100.0 -0.41 537027.5591 -53900.0 -0.29 -0.4929 -0.9843 PhilEx2_000101 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E14 compound treatment 594135.6784 49800.0 0.23 525720.3065 -65200.0 -0.35 -0.0821 -0.1976 PhilEx2_000102 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E15 compound treatment 440235.2941 -104000.0 -0.48 565012.0482 -25900.0 -0.14 -0.4366 -0.8745 PhilEx2_000103 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E16 compound treatment 507920.4545 -36400.0 -0.17 534578.4753 -56400.0 -0.3 -0.33 -0.9627 PhilEx2_000104 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E17 compound treatment 500543.3071 -43700.0 -0.2 503842.6573 -87100.0 -0.46 -0.4693 -0.931 PhilEx2_000105 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E18 compound treatment 600009.3023 55700.0 0.26 651092.5926 60200.0 0.32 0.4073 0.9942 PhilEx2_000106 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E19 compound treatment 544619.3772 329.0 0.0 522900.0 -68000.0 -0.36 -0.2541 -0.7041 PhilEx2_000107 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E20 compound treatment 554948.6405 10700.0 0.05 518098.4848 -72800.0 -0.39 -0.2384 -0.6122 PhilEx2_000108 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E21 compound treatment 470032.2581 -74300.0 -0.34 412400.0 -179000.0 -0.95 -0.9118 -0.9054 PhilEx2_000109 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E22 compound treatment 472096.7742 -72200.0 -0.33 593576.5125 2640.0 0.01 -0.2255 -0.6768 PhilEx2_000110 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E23 mock treatment 529455.8824 -14800.0 -0.07 484235.2941 -107000.0 -0.57 -0.4486 -0.7869 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 E24 mock treatment 502571.4286 -41700.0 -0.19 846917.2932 256000.0 1.36 0.824 0.6009 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F01 compound treatment 804389.3805 260000.0 1.2 702947.3684 112000.0 0.59 1.2682 0.9475 PhilEx2_000111 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F02 compound treatment 699005.2356 155000.0 0.71 742973.0942 152000.0 0.81 1.0747 0.9981 PhilEx2_000112 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F03 compound treatment 531451.8519 -12800.0 -0.06 684218.107 93300.0 0.49 0.308 0.6181 PhilEx2_000113 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F04 compound treatment 688476.8519 144000.0 0.66 580943.299 -9990.0 -0.05 0.4327 0.6487 PhilEx2_000114 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F05 compound treatment 648281.9383 104000.0 0.48 595658.2278 4720.0 0.03 0.3568 0.743 PhilEx2_000115 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F06 compound treatment 531895.7346 -12400.0 -0.06 517579.8319 -73400.0 -0.39 -0.3155 -0.8024 PhilEx2_000116 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F07 compound treatment 592780.9917 48500.0 0.22 619183.5938 28200.0 0.15 0.2641 0.981 PhilEx2_000117 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F08 compound treatment 428707.4236 -116000.0 -0.53 468497.8541 -122000.0 -0.65 -0.8361 -0.9952 PhilEx2_000118 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F09 compound treatment 575154.8673 30900.0 0.14 498743.6975 -92200.0 -0.49 -0.2451 -0.4813 PhilEx2_000119 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F10 compound treatment 42350.6494 -502000.0 -2.31 40376.8116 -551000.0 -2.92 -3.7017 -0.9934 PhilEx2_000120 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F11 compound treatment 519305.9361 -25000.0 -0.12 551475.2852 -39500.0 -0.21 -0.2295 -0.9604 PhilEx2_000121 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F12 compound treatment 390282.7869 -154000.0 -0.71 514144.5313 -76800.0 -0.41 -0.7902 -0.9652 PhilEx2_000122 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F13 compound treatment 744232.6531 200000.0 0.92 628475.1773 37500.0 0.2 0.7928 0.8404 PhilEx2_000123 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F14 compound treatment 345990.099 -198000.0 -0.91 426380.0 -165000.0 -0.87 -1.2638 -0.9997 PhilEx2_000124 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F15 compound treatment 530033.7553 -14300.0 -0.07 643000.0 52100.0 0.28 0.1488 0.5241 PhilEx2_000125 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F16 compound treatment 586699.2481 42400.0 0.2 586985.2941 -3950.0 -0.02 0.1235 0.6277 PhilEx2_000126 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F17 compound treatment 546650.0 2360.0 0.01 502914.1791 -88000.0 -0.47 -0.3224 -0.6904 PhilEx2_000127 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F18 compound treatment 520443.5798 -23800.0 -0.11 540116.041 -50800.0 -0.27 -0.2684 -0.9218 PhilEx2_000128 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F19 compound treatment 413085.0202 -131000.0 -0.61 460729.9578 -130000.0 -0.69 -0.9162 -0.9978 PhilEx2_000129 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F20 compound treatment 547537.5494 3250.0 0.01 674693.617 83800.0 0.44 0.3247 0.7305 PhilEx2_000130 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F21 compound treatment 424000.0 -120000.0 -0.55 57660.7143 -533000.0 -2.83 -2.3923 -0.83 PhilEx2_000131 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F22 compound treatment 576744.3609 32500.0 0.15 469750.0 -121000.0 -0.64 -0.3487 -0.5283 PhilEx2_000132 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F23 mock treatment 559500.0 15200.0 0.07 526310.757 -64600.0 -0.34 -0.1928 -0.551 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 F24 mock treatment 456619.0476 -87700.0 -0.4 502296.875 -88600.0 -0.47 -0.6183 -0.9972 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G01 compound treatment 546047.619 1760.0 0.01 518069.869 -72900.0 -0.39 -0.2676 -0.6921 PhilEx2_000133 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G02 compound treatment 262570.3704 -282000.0 -1.3 333738.5621 -257000.0 -1.36 -1.8833 -0.9997 PhilEx2_000134 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G03 compound treatment 692980.7692 149000.0 0.69 638171.6738 47200.0 0.25 0.662 0.9068 PhilEx2_000135 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G04 compound treatment 408729.8851 -136000.0 -0.63 498371.134 -92600.0 -0.49 -0.7892 -0.9929 PhilEx2_000136 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G05 compound treatment 679439.4619 135000.0 0.62 590773.3333 -165.0 0.0 0.4401 0.7061 PhilEx2_000137 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G06 compound treatment 425046.0526 -119000.0 -0.55 465429.2929 -126000.0 -0.67 -0.8596 -0.9955 PhilEx2_000138 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G07 compound treatment 577664.4068 33400.0 0.15 431897.5265 -159000.0 -0.84 -0.4877 -0.5687 PhilEx2_000139 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G08 compound treatment 438137.6147 -106000.0 -0.49 553569.8113 -37400.0 -0.2 -0.4863 -0.9208 PhilEx2_000140 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G09 compound treatment 497684.2105 -46600.0 -0.21 490292.0 -101000.0 -0.53 -0.5295 -0.92 PhilEx2_000141 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G10 compound treatment 553287.5817 9000.0 0.04 441458.4718 -149000.0 -0.79 -0.5313 -0.6692 PhilEx2_000142 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G11 compound treatment 401709.5238 -143000.0 -0.66 446728.8889 -144000.0 -0.76 -1.0058 -0.9972 PhilEx2_000143 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G12 compound treatment 535166.6667 -9120.0 -0.04 534974.4898 -56000.0 -0.3 -0.2396 -0.7994 PhilEx2_000144 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G13 compound treatment 89240.0 -455000.0 -2.1 71276.5957 -520000.0 -2.76 -3.4329 -0.9909 PhilEx2_000145 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G14 compound treatment 504146.1039 -40100.0 -0.19 535399.2933 -55500.0 -0.29 -0.3392 -0.9749 PhilEx2_000146 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G15 compound treatment 499323.6515 -45000.0 -0.21 455661.3546 -135000.0 -0.72 -0.654 -0.8756 PhilEx2_000147 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G16 compound treatment 461996.5986 -82300.0 -0.38 489918.1034 -101000.0 -0.54 -0.6472 -0.9857 PhilEx2_000148 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G17 compound treatment 358147.3214 -186000.0 -0.86 500389.0785 -90500.0 -0.48 -0.9466 -0.9623 PhilEx2_000149 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G18 compound treatment 533798.2456 -10500.0 -0.05 453288.8889 -138000.0 -0.73 -0.5505 -0.7523 PhilEx2_000150 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G19 compound treatment 491174.7967 -53100.0 -0.24 487183.7607 -104000.0 -0.55 -0.5623 -0.9335 PhilEx2_000151 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G20 compound treatment 455555.5556 -88700.0 -0.41 444515.3584 -146000.0 -0.78 -0.8385 -0.9552 PhilEx2_000152 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G21 compound treatment 385333.3333 -159000.0 -0.73 361356.5217 -230000.0 -1.22 -1.3794 -0.9705 PhilEx2_000153 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G22 compound treatment 445836.6534 -98500.0 -0.45 427082.5243 -164000.0 -0.87 -0.9356 -0.9542 PhilEx2_000154 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G23 mock treatment 485791.3386 -58500.0 -0.27 502854.7718 -88100.0 -0.47 -0.5211 -0.9659 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 G24 mock treatment 494618.3575 -49700.0 -0.23 769942.4658 179000.0 0.95 0.5094 0.5215 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H01 compound treatment 659128.5714 115000.0 0.53 721116.4021 130000.0 0.69 0.8627 0.9914 PhilEx2_000155 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H02 compound treatment 394892.0455 -149000.0 -0.69 352356.3218 -239000.0 -1.27 -1.382 -0.9591 PhilEx2_000156 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H03 compound treatment 724308.4112 180000.0 0.83 677223.3503 86300.0 0.46 0.9106 0.9606 PhilEx2_000157 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H04 compound treatment 641520.7373 97200.0 0.45 546796.9543 -44100.0 -0.23 0.1515 0.2995 PhilEx2_000158 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H05 compound treatment 614790.3226 70500.0 0.33 654866.426 63900.0 0.34 0.4697 0.9998 PhilEx2_000159 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H06 compound treatment 318658.1633 -226000.0 -1.04 419382.6087 -172000.0 -0.91 -1.3792 -0.9978 PhilEx2_000160 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H07 compound treatment 569570.3125 25300.0 0.12 605160.7143 14200.0 0.08 0.1358 0.9778 PhilEx2_000161 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H08 compound treatment 430800.0 -113000.0 -0.52 545161.1722 -45800.0 -0.24 -0.5418 -0.939 PhilEx2_000162 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H09 compound treatment 562514.8515 18200.0 0.08 558363.9847 -32600.0 -0.17 -0.0627 -0.3266 PhilEx2_000163 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H10 compound treatment 328419.3548 -216000.0 -1.0 445878.2609 -145000.0 -0.77 -1.248 -0.9919 PhilEx2_000164 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H11 compound treatment 523459.1837 -20800.0 -0.1 555565.445 -35400.0 -0.19 -0.2006 -0.9517 PhilEx2_000165 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H12 compound treatment 351736.8421 -193000.0 -0.89 513305.1643 -77600.0 -0.41 -0.9191 -0.939 PhilEx2_000166 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H13 compound treatment 571019.6078 26700.0 0.12 551337.0787 -39600.0 -0.21 -0.0614 -0.252 PhilEx2_000167 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H14 compound treatment 412638.7665 -132000.0 -0.61 480500.0 -110000.0 -0.59 -0.8435 -0.9998 PhilEx2_000168 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H15 compound treatment 456078.5124 -88200.0 -0.41 560817.0213 -30100.0 -0.16 -0.4006 -0.9167 PhilEx2_000169 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H16 compound treatment 382006.0976 -162000.0 -0.75 461543.7262 -129000.0 -0.69 -1.0145 -0.9991 PhilEx2_000170 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H17 compound treatment 475358.3333 -68900.0 -0.32 539583.691 -51400.0 -0.27 -0.4174 -0.997 PhilEx2_000171 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H18 compound treatment 440267.1756 -104000.0 -0.48 531179.5775 -59800.0 -0.32 -0.5633 -0.9798 PhilEx2_000172 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H19 compound treatment 370542.9553 -174000.0 -0.8 597660.3053 6720.0 0.04 -0.5414 -0.675 PhilEx2_000173 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H20 compound treatment 468120.7547 -76200.0 -0.35 509434.1637 -81500.0 -0.43 -0.5541 -0.9947 PhilEx2_000174 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H21 compound treatment 421657.1429 -123000.0 -0.57 397448.8189 -193000.0 -1.03 -1.1256 -0.9606 PhilEx2_000175 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H22 compound treatment 473068.0272 -71200.0 -0.33 580116.8831 -10800.0 -0.06 -0.2728 -0.8183 PhilEx2_000176 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H23 mock treatment 481613.4021 -62700.0 -0.29 483085.9729 -108000.0 -0.57 -0.6089 -0.95 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 H24 mock treatment 463284.4828 -81000.0 -0.37 899495.9786 309000.0 1.64 0.8931 0.532 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I01 compound treatment 528632.7684 -15700.0 -0.07 549902.2989 -41000.0 -0.22 -0.205 -0.8938 PhilEx2_000177 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I02 compound treatment 407166.6667 -137000.0 -0.63 435844.4444 -155000.0 -0.82 -1.0288 -0.9916 PhilEx2_000178 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I03 compound treatment 645551.5464 101000.0 0.47 563906.8627 -27000.0 -0.14 0.2288 0.4684 PhilEx2_000179 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I04 compound treatment 593424.0838 49100.0 0.23 518026.178 -72900.0 -0.39 -0.1132 -0.2526 PhilEx2_000180 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I05 compound treatment 720953.125 177000.0 0.81 650837.6068 59900.0 0.32 0.8007 0.9157 PhilEx2_000181 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I06 compound treatment 308355.7047 -236000.0 -1.09 530317.6471 -60600.0 -0.32 -0.9967 -0.8785 PhilEx2_000182 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I07 compound treatment 605245.0593 61000.0 0.28 612529.8507 21600.0 0.11 0.2797 0.9216 PhilEx2_000183 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I08 compound treatment 381838.7097 -162000.0 -0.75 488666.6667 -102000.0 -0.54 -0.9133 -0.9874 PhilEx2_000184 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I09 compound treatment 732458.5635 188000.0 0.87 688409.6386 97500.0 0.52 0.9792 0.9694 PhilEx2_000185 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I10 compound treatment 558586.2069 14300.0 0.07 612336.0324 21400.0 0.11 0.1269 0.9666 PhilEx2_000186 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I11 compound treatment 451113.3005 -93200.0 -0.43 494331.8386 -96600.0 -0.51 -0.6662 -0.9962 PhilEx2_000187 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I12 compound treatment 617715.9091 73400.0 0.34 594347.4576 3410.0 0.02 0.2522 0.7438 PhilEx2_000188 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I13 compound treatment 489105.8824 -55200.0 -0.25 390500.0 -200000.0 -1.06 -0.9317 -0.8523 PhilEx2_000189 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I14 compound treatment 502039.3258 -42300.0 -0.19 688776.8595 97800.0 0.52 0.2292 0.4134 PhilEx2_000190 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I15 compound treatment 798640.625 254000.0 1.17 881042.0168 290000.0 1.54 1.9174 0.991 PhilEx2_000191 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I16 compound treatment 487992.7798 -56300.0 -0.26 672258.4746 81300.0 0.43 0.1214 0.2412 PhilEx2_000192 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I17 compound treatment 524638.0597 -19700.0 -0.09 495574.3802 -95400.0 -0.51 -0.4217 -0.8207 PhilEx2_000193 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I18 compound treatment 453207.1713 -91100.0 -0.42 512129.4964 -78800.0 -0.42 -0.5926 -1.0 PhilEx2_000194 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I19 compound treatment 494411.2903 -49900.0 -0.23 630963.5036 40000.0 0.21 -0.0125 -0.0401 PhilEx2_000195 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I20 compound treatment 531622.7106 -12700.0 -0.06 524646.4646 -66300.0 -0.35 -0.2899 -0.8134 PhilEx2_000196 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I21 compound treatment 521869.5652 -22400.0 -0.1 424078.2609 -167000.0 -0.89 -0.6989 -0.7844 PhilEx2_000197 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I22 compound treatment 545905.5118 1610.0 0.01 340256.4103 -251000.0 -1.33 -0.9349 -0.7031 PhilEx2_000198 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I23 mock treatment 510870.1923 -33400.0 -0.15 607556.0345 16600.0 0.09 -0.0467 -0.2628 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 I24 mock treatment 478872.2467 -65400.0 -0.3 773160.105 182000.0 0.97 0.4701 0.4643 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J01 compound treatment 752766.9173 208000.0 0.96 978690.2655 388000.0 2.06 2.1341 0.94 PhilEx2_000199 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J02 compound treatment 620826.3158 76500.0 0.35 584644.2308 -6290.0 -0.03 0.226 0.6374 PhilEx2_000200 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J03 compound treatment 559742.616 15500.0 0.07 347953.4884 -243000.0 -1.29 -0.8609 -0.667 PhilEx2_000201 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J04 compound treatment 842510.0 298000.0 1.38 840531.5315 250000.0 1.32 1.9086 0.9998 PhilEx2_000202 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J05 compound treatment 759557.6037 215000.0 0.99 739035.0877 148000.0 0.79 1.2574 0.9933 PhilEx2_000203 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J06 compound treatment 575969.8492 31700.0 0.15 519759.2593 -71200.0 -0.38 -0.1637 -0.4043 PhilEx2_000204 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J07 compound treatment 414024.3902 -130000.0 -0.6 526212.8514 -64700.0 -0.34 -0.6675 -0.9648 PhilEx2_000205 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J08 compound treatment 503051.1364 -41200.0 -0.19 514740.3315 -76200.0 -0.4 -0.4203 -0.9409 PhilEx2_000206 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J09 compound treatment 530627.6596 -13700.0 -0.06 600157.3604 9220.0 0.05 -0.01 -0.1251 PhilEx2_000207 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J10 compound treatment 588344.0367 44100.0 0.2 593654.7085 2720.0 0.01 0.1538 0.7554 PhilEx2_000208 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J11 compound treatment 607583.9695 63300.0 0.29 556904.0 -34000.0 -0.18 0.0787 0.2295 PhilEx2_000209 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J12 compound treatment 339883.9779 -204000.0 -0.94 417814.5695 -173000.0 -0.92 -1.3159 -0.9999 PhilEx2_000210 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J13 compound treatment 730287.8788 186000.0 0.86 601043.956 10100.0 0.05 0.6444 0.7498 PhilEx2_000211 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J14 compound treatment 404706.383 -140000.0 -0.64 404814.6341 -186000.0 -0.99 -1.1532 -0.9785 PhilEx2_000212 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J15 compound treatment 506991.2281 -37300.0 -0.17 528132.8125 -62800.0 -0.33 -0.3572 -0.9527 PhilEx2_000213 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J16 compound treatment 577570.8812 33300.0 0.15 507802.0305 -83100.0 -0.44 -0.2033 -0.4354 PhilEx2_000214 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J17 compound treatment 491628.6765 -52700.0 -0.24 651775.8621 60800.0 0.32 0.0564 0.1398 PhilEx2_000215 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J18 compound treatment 460265.625 -84000.0 -0.39 523870.0361 -67100.0 -0.36 -0.5255 -0.9991 PhilEx2_000216 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J19 compound treatment 309569.6203 -235000.0 -1.08 201481.0127 -389000.0 -2.07 -2.2261 -0.9545 PhilEx2_000217 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J20 compound treatment 511038.4615 -33300.0 -0.15 434935.4839 -156000.0 -0.83 -0.6935 -0.8241 PhilEx2_000218 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J21 compound treatment 445742.5743 -98500.0 -0.45 460642.1569 -130000.0 -0.69 -0.81 -0.9793 PhilEx2_000219 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J22 compound treatment 615022.9008 70700.0 0.33 630107.6233 39200.0 0.21 0.3776 0.9763 PhilEx2_000220 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J23 mock treatment 586244.7917 42000.0 0.19 500732.0574 -90200.0 -0.48 -0.2015 -0.3905 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 J24 mock treatment 503484.8485 -40800.0 -0.19 743484.7645 153000.0 0.81 0.4391 0.5285 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K01 compound treatment 580615.3846 36300.0 0.17 594637.1681 3700.0 0.02 0.1323 0.7846 PhilEx2_000221 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K02 compound treatment 534702.8571 -9590.0 -0.04 441725.1462 -149000.0 -0.79 -0.5909 -0.7454 PhilEx2_000222 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K03 compound treatment 802945.6067 259000.0 1.19 763009.3458 172000.0 0.91 1.4888 0.9913 PhilEx2_000223 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K04 compound treatment 607982.659 63700.0 0.29 501900.0 -89000.0 -0.47 -0.1262 -0.227 PhilEx2_000224 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K05 compound treatment 757574.0741 213000.0 0.98 796163.4241 205000.0 1.09 1.4652 0.9987 PhilEx2_000225 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K06 compound treatment 579395.8333 35100.0 0.16 534810.8108 -56100.0 -0.3 -0.096 -0.2834 PhilEx2_000226 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K07 compound treatment 810581.9672 266000.0 1.23 654890.3509 64000.0 0.34 1.1082 0.8698 PhilEx2_000227 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K08 compound treatment 583100.9615 38800.0 0.18 705573.8397 115000.0 0.61 0.5565 0.878 PhilEx2_000228 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K09 compound treatment 646007.8125 102000.0 0.47 683081.7844 92100.0 0.49 0.6773 0.9998 PhilEx2_000229 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K10 compound treatment 551910.0 7620.0 0.04 668874.0458 77900.0 0.41 0.3171 0.7645 PhilEx2_000230 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K11 compound treatment 639901.6393 95600.0 0.44 712032.2581 121000.0 0.64 0.7659 0.9832 PhilEx2_000231 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K12 compound treatment 708608.6957 164000.0 0.76 567873.3766 -23100.0 -0.12 0.4493 0.5854 PhilEx2_000232 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K13 compound treatment 489512.8205 -54800.0 -0.25 654769.6078 63800.0 0.34 0.0608 0.1439 PhilEx2_000233 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K14 compound treatment 597876.4479 53600.0 0.25 562880.0 -28100.0 -0.15 0.0695 0.2409 PhilEx2_000234 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K15 compound treatment 654004.3478 110000.0 0.51 631188.8412 40300.0 0.21 0.5087 0.9264 PhilEx2_000235 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K16 compound treatment 524524.1379 -19800.0 -0.09 569764.4628 -21200.0 -0.11 -0.1439 -0.9946 PhilEx2_000236 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K17 compound treatment 683788.4615 139000.0 0.64 534410.628 -56500.0 -0.3 0.2429 0.3422 PhilEx2_000237 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K18 compound treatment 533291.5129 -11000.0 -0.05 609503.4483 18600.0 0.1 0.0338 0.3048 PhilEx2_000238 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K19 compound treatment 607948.9362 63700.0 0.29 668711.6105 77800.0 0.41 0.4993 0.9861 PhilEx2_000239 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K20 compound treatment 521380.4348 -22900.0 -0.11 499225.8065 -91700.0 -0.49 -0.4187 -0.8411 PhilEx2_000240 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K21 compound treatment 552507.4074 8220.0 0.04 710715.3558 120000.0 0.64 0.476 0.748 PhilEx2_000241 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K22 compound treatment 506811.8812 -37500.0 -0.17 519233.677 -71700.0 -0.38 -0.3911 -0.9363 PhilEx2_000242 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K23 mock treatment 536698.7952 -7590.0 -0.04 629115.0794 38200.0 0.2 0.1184 0.5763 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 K24 mock treatment 823633.2518 279000.0 1.29 1047615.385 457000.0 2.42 2.6237 0.9563 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L01 compound treatment 743880.597 200000.0 0.92 743589.372 153000.0 0.81 1.2234 0.998 PhilEx2_000243 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L02 compound treatment 487438.4236 -56900.0 -0.26 494110.6195 -96800.0 -0.51 -0.5485 -0.9513 PhilEx2_000244 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L03 compound treatment 630026.2009 85700.0 0.4 589081.3008 -1860.0 -0.01 0.2726 0.6893 PhilEx2_000245 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L04 compound treatment 600604.5455 56300.0 0.26 783398.01 192000.0 1.02 0.9055 0.8596 PhilEx2_000246 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L05 compound treatment 793921.2598 250000.0 1.15 675748.0315 84800.0 0.45 1.1321 0.916 PhilEx2_000247 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L06 compound treatment 439402.5157 -105000.0 -0.48 495026.1438 -95900.0 -0.51 -0.7017 -0.9997 PhilEx2_000248 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L07 compound treatment 648957.9832 105000.0 0.48 805839.5062 215000.0 1.14 1.1473 0.9269 PhilEx2_000249 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L08 compound treatment 548201.9231 3910.0 0.02 558790.4762 -32100.0 -0.17 -0.1078 -0.6288 PhilEx2_000250 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L09 compound treatment 627846.473 83600.0 0.39 805082.1256 214000.0 1.14 1.0756 0.8968 PhilEx2_000251 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L10 compound treatment 527891.7749 -16400.0 -0.08 603095.8904 12200.0 0.06 -0.0079 -0.0793 PhilEx2_000252 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L11 compound treatment 764995.7627 221000.0 1.02 730323.7705 139000.0 0.74 1.2425 0.9877 PhilEx2_000253 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L12 compound treatment 543983.7838 -307.0 0.0 647136.612 56200.0 0.3 0.2098 0.7037 PhilEx2_000254 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L13 compound treatment 619295.5466 75000.0 0.35 623673.913 32700.0 0.17 0.3674 0.9492 PhilEx2_000255 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L14 compound treatment 377389.5349 -167000.0 -0.77 483038.8889 -108000.0 -0.57 -0.9489 -0.9894 PhilEx2_000256 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L15 compound treatment 758951.2195 215000.0 0.99 549275.0 -41700.0 -0.22 0.5437 0.5361 PhilEx2_000257 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L16 compound treatment 605640.5694 61300.0 0.28 596948.5294 6010.0 0.03 0.2226 0.7818 PhilEx2_000258 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L17 compound treatment 547912.8631 3620.0 0.02 647284.7458 56300.0 0.3 0.2231 0.7455 PhilEx2_000259 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L18 compound treatment 631470.0855 87200.0 0.4 613816.2544 22900.0 0.12 0.3701 0.8813 PhilEx2_000260 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L19 compound treatment 478743.1193 -65500.0 -0.3 430165.0485 -161000.0 -0.85 -0.8167 -0.9027 PhilEx2_000261 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L20 compound treatment 513147.7273 -31100.0 -0.14 535349.4424 -55600.0 -0.29 -0.31 -0.9454 PhilEx2_000262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L21 compound treatment 442153.1915 -102000.0 -0.47 440349.1379 -151000.0 -0.8 -0.8978 -0.9683 PhilEx2_000263 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L22 compound treatment 537287.3134 -7000.0 -0.03 512213.5922 -78700.0 -0.42 -0.3181 -0.7595 PhilEx2_000264 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L23 mock treatment 548601.6949 4310.0 0.02 541501.9455 -49400.0 -0.26 -0.1714 -0.6516 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 L24 mock treatment 788768.8312 244000.0 1.13 798582.3096 208000.0 1.1 1.576 0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M01 compound treatment 569137.6518 24800.0 0.11 482225.9414 -109000.0 -0.58 -0.3267 -0.5557 PhilEx2_000265 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M02 compound treatment 463362.2449 -80900.0 -0.37 469924.7312 -121000.0 -0.64 -0.7178 -0.9667 PhilEx2_000266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M03 compound treatment 571434.5992 27100.0 0.13 591165.8986 228.0 0.0 0.0894 0.7139 PhilEx2_000267 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M04 compound treatment 581925.7426 37600.0 0.17 581345.7447 -9590.0 -0.05 0.0867 0.4796 PhilEx2_000268 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M05 compound treatment 725451.3274 181000.0 0.84 724585.9031 134000.0 0.71 1.092 0.9967 PhilEx2_000269 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M06 compound treatment 540825.1748 -3470.0 -0.02 397364.486 -194000.0 -1.03 -0.7373 -0.718 PhilEx2_000270 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M07 compound treatment 669857.7406 126000.0 0.58 850011.236 259000.0 1.37 1.3811 0.9262 PhilEx2_000271 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M08 compound treatment 329467.3913 -215000.0 -0.99 251579.7101 -339000.0 -1.8 -1.9733 -0.9604 PhilEx2_000272 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M09 compound treatment 684745.7045 140000.0 0.65 732437.2624 141000.0 0.75 0.9887 0.9973 PhilEx2_000273 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M10 compound treatment 720340.4255 176000.0 0.81 620661.4786 29700.0 0.16 0.6856 0.8289 PhilEx2_000274 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M11 compound treatment 589734.4398 45400.0 0.21 657046.2185 66100.0 0.35 0.3961 0.9697 PhilEx2_000275 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M12 compound treatment 611962.1849 67700.0 0.31 550843.8662 -40100.0 -0.21 0.0703 0.1861 PhilEx2_000276 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M13 compound treatment 542299.5951 -1990.0 -0.01 587180.6723 -3760.0 -0.02 -0.0206 -0.9381 PhilEx2_000277 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M14 compound treatment 523147.7273 -21100.0 -0.1 502641.0256 -88300.0 -0.47 -0.4001 -0.8364 PhilEx2_000278 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M15 compound treatment 585280.3347 41000.0 0.19 451109.2437 -140000.0 -0.74 -0.3908 -0.5106 PhilEx2_000279 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M16 compound treatment 531564.1892 -12700.0 -0.06 681788.2353 90800.0 0.48 0.2992 0.6164 PhilEx2_000280 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M17 compound treatment 557126.2626 12800.0 0.06 506414.7727 -84500.0 -0.45 -0.2751 -0.6085 PhilEx2_000281 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M18 compound treatment 522218.1818 -22100.0 -0.1 548066.1765 -42900.0 -0.23 -0.2328 -0.9343 PhilEx2_000282 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M19 compound treatment 461313.253 -83000.0 -0.38 567927.3504 -23000.0 -0.12 -0.3569 -0.8885 PhilEx2_000283 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M20 compound treatment 510817.2757 -33500.0 -0.15 423556.338 -167000.0 -0.89 -0.7369 -0.8178 PhilEx2_000284 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M21 compound treatment 396686.7925 -148000.0 -0.68 483926.4069 -107000.0 -0.57 -0.8827 -0.9959 PhilEx2_000285 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M22 compound treatment 552445.9459 8160.0 0.04 528570.4225 -62400.0 -0.33 -0.2073 -0.6227 PhilEx2_000286 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M23 mock treatment 482835.249 -61500.0 -0.28 608735.8491 17800.0 0.09 -0.1337 -0.4474 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 M24 mock treatment 504412.3223 -39900.0 -0.18 519692.3077 -71200.0 -0.38 -0.3972 -0.9452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N01 compound treatment 561874.5098 17600.0 0.08 636456.4315 45500.0 0.24 0.2281 0.8954 PhilEx2_000287 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N02 compound treatment 582521.5054 38200.0 0.18 627931.0345 37000.0 0.2 0.2634 0.9986 PhilEx2_000288 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N03 compound treatment 530241.3793 -14000.0 -0.06 626959.8394 36000.0 0.19 0.0893 0.4426 PhilEx2_000289 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N04 compound treatment 518250.0 -26000.0 -0.12 635924.5283 45000.0 0.24 0.0838 0.3137 PhilEx2_000290 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N05 compound treatment 639401.6393 95100.0 0.44 626161.157 35200.0 0.19 0.4423 0.9276 PhilEx2_000291 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N06 compound treatment 475717.0732 -68600.0 -0.32 500895.3488 -90000.0 -0.48 -0.5613 -0.98 PhilEx2_000292 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N07 compound treatment 679484.4961 135000.0 0.62 624686.5672 33700.0 0.18 0.5674 0.8748 PhilEx2_000293 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N08 compound treatment 450295.9184 -94000.0 -0.43 491138.1215 -99800.0 -0.53 -0.6808 -0.9951 PhilEx2_000294 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N09 compound treatment 659279.1667 115000.0 0.53 736004.0161 145000.0 0.77 0.919 0.9835 PhilEx2_000295 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N10 compound treatment 391761.9048 -153000.0 -0.7 403306.8783 -188000.0 -1.0 -1.2011 -0.9856 PhilEx2_000296 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N11 compound treatment 706284.1727 162000.0 0.75 724557.0776 134000.0 0.71 1.0294 0.9997 PhilEx2_000297 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N12 compound treatment 420788.5714 -124000.0 -0.57 400207.1006 -191000.0 -1.01 -1.1181 -0.9631 PhilEx2_000298 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N13 compound treatment 589899.1935 45600.0 0.21 727932.6923 137000.0 0.73 0.6625 0.8758 PhilEx2_000299 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N14 compound treatment 429426.5403 -115000.0 -0.53 366384.106 -225000.0 -1.19 -1.2168 -0.9334 PhilEx2_000300 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N15 compound treatment 567653.8462 23400.0 0.11 554222.2222 -36700.0 -0.19 -0.0615 -0.2764 PhilEx2_000301 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N16 compound treatment 530444.4444 -13800.0 -0.06 573128.4722 -17800.0 -0.09 -0.1119 -0.9818 PhilEx2_000302 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N17 compound treatment 464709.5238 -79600.0 -0.37 325759.2593 -265000.0 -1.41 -1.2541 -0.8627 PhilEx2_000303 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N18 compound treatment 551675.1825 7380.0 0.03 618293.5484 27400.0 0.15 0.1267 0.85 PhilEx2_000304 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N19 compound treatment 694328.8288 150000.0 0.69 491611.8721 -99300.0 -0.53 0.1167 0.1342 PhilEx2_000305 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N20 compound treatment 514594.2029 -29700.0 -0.14 451902.7237 -139000.0 -0.74 -0.6183 -0.8243 PhilEx2_000306 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N21 compound treatment 497537.594 -46800.0 -0.22 563147.2868 -27800.0 -0.15 -0.2567 -0.9828 PhilEx2_000307 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N22 compound treatment 528514.658 -15800.0 -0.07 653125.4237 62200.0 0.33 0.1818 0.5382 PhilEx2_000308 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N23 mock treatment 512058.8235 -32200.0 -0.15 477537.1179 -113000.0 -0.6 -0.5304 -0.8561 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 N24 mock treatment 469396.3636 -74900.0 -0.35 553268.1992 -37700.0 -0.2 -0.3855 -0.9661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O01 compound treatment 563080.8511 18800.0 0.09 528869.7479 -62100.0 -0.33 -0.1715 -0.5038 PhilEx2_000309 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O02 compound treatment 566053.2544 21800.0 0.1 372791.6667 -218000.0 -1.16 -0.7472 -0.6434 PhilEx2_000310 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O03 compound treatment 656645.283 112000.0 0.52 605965.812 15000.0 0.08 0.4227 0.8064 PhilEx2_000311 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O04 compound treatment 457535.8852 -86800.0 -0.4 489019.802 -102000.0 -0.54 -0.6651 -0.989 PhilEx2_000312 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O05 compound treatment 602142.8571 57900.0 0.27 650793.2489 59900.0 0.32 0.4131 0.9963 PhilEx2_000313 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O06 compound treatment 569655.5024 25400.0 0.12 568970.297 -22000.0 -0.12 3.0E-4 0.0019 PhilEx2_000314 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O07 compound treatment 526243.1193 -18000.0 -0.08 645407.4074 54500.0 0.29 0.1454 0.4837 PhilEx2_000315 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O08 compound treatment 610987.013 66700.0 0.31 633882.6087 42900.0 0.23 0.3786 0.9891 PhilEx2_000316 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O09 compound treatment 556430.2326 12100.0 0.06 655787.6106 64800.0 0.34 0.2828 0.8115 PhilEx2_000317 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O10 compound treatment 579833.8983 35500.0 0.16 570076.087 -20900.0 -0.11 0.0377 0.1904 PhilEx2_000318 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O11 compound treatment 472308.4577 -72000.0 -0.33 288774.8344 -302000.0 -1.6 -1.368 -0.8358 PhilEx2_000319 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O12 compound treatment 544028.0 -263.0 0.0 621000.0 30100.0 0.16 0.1119 0.7017 PhilEx2_000320 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O13 compound treatment 605273.4694 61000.0 0.28 677506.6079 86600.0 0.46 0.5235 0.9723 PhilEx2_000321 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O14 compound treatment 544575.6458 285.0 0.0 528740.3509 -62200.0 -0.33 -0.2323 -0.7043 PhilEx2_000322 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O15 compound treatment 435296.9432 -109000.0 -0.5 403826.9231 -187000.0 -0.99 -1.0572 -0.9503 PhilEx2_000323 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O16 compound treatment 635640.7407 91300.0 0.42 657994.152 67100.0 0.36 0.5494 0.9965 PhilEx2_000324 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O17 compound treatment 515877.551 -28400.0 -0.13 494702.3256 -96200.0 -0.51 -0.4536 -0.8607 PhilEx2_000325 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O18 compound treatment 526861.1111 -17400.0 -0.08 529651.9824 -61300.0 -0.33 -0.2867 -0.8562 PhilEx2_000326 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O19 compound treatment 487610.1083 -56700.0 -0.26 500222.6415 -90700.0 -0.48 -0.5251 -0.9589 PhilEx2_000327 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O20 compound treatment 427808.8235 -116000.0 -0.54 486963.37 -104000.0 -0.55 -0.7698 -0.9999 PhilEx2_000328 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O21 compound treatment 591376.1062 47100.0 0.22 465223.8095 -126000.0 -0.67 -0.3179 -0.4534 PhilEx2_000329 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O22 compound treatment 472721.8543 -71600.0 -0.33 459969.112 -131000.0 -0.69 -0.7246 -0.9421 PhilEx2_000330 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O23 mock treatment 479833.3333 -64500.0 -0.3 449145.3744 -142000.0 -0.75 -0.742 -0.9175 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 O24 mock treatment 836391.4081 292000.0 1.35 783890.9091 193000.0 1.02 1.6762 0.9908 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P01 compound treatment 502320.6751 -42000.0 -0.19 473704.1667 -117000.0 -0.62 -0.5765 -0.8853 PhilEx2_000331 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P02 compound treatment 646803.4188 103000.0 0.47 527154.1502 -63800.0 -0.34 0.0951 0.1635 PhilEx2_000332 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P03 compound treatment 536490.0398 -7800.0 -0.04 502238.2671 -88700.0 -0.47 -0.3581 -0.759 PhilEx2_000333 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P04 compound treatment 451840.5797 -92500.0 -0.43 483808.8235 -107000.0 -0.57 -0.7033 -0.99 PhilEx2_000334 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P05 compound treatment 462937.2549 -81400.0 -0.38 496451.049 -94500.0 -0.5 -0.6197 -0.9898 PhilEx2_000335 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P06 compound treatment 40238.0952 -504000.0 -2.32 33211.2676 -558000.0 -2.96 -3.7354 -0.9929 PhilEx2_000336 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P07 compound treatment 599084.3373 54800.0 0.25 589971.6599 -967.0 -0.01 0.1751 0.6926 PhilEx2_000337 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P08 compound treatment 175216.4948 -369000.0 -1.7 183603.7736 -407000.0 -2.16 -2.7312 -0.993 PhilEx2_000338 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P09 compound treatment 514505.8824 -29800.0 -0.14 574860.262 -16100.0 -0.09 -0.1574 -0.9737 PhilEx2_000339 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P10 compound treatment 354926.2673 -189000.0 -0.87 384734.2342 -206000.0 -1.09 -1.3909 -0.9938 PhilEx2_000340 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P11 compound treatment 484690.1408 -59600.0 -0.27 389428.5714 -202000.0 -1.07 -0.9501 -0.8609 PhilEx2_000341 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P12 compound treatment 270006.5359 -274000.0 -1.26 271769.7368 -319000.0 -1.69 -2.0915 -0.9897 PhilEx2_000342 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P13 compound treatment 629233.8129 84900.0 0.39 598157.3034 7220.0 0.04 0.3041 0.7725 PhilEx2_000343 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P14 compound treatment 356734.5972 -188000.0 -0.86 298081.8713 -293000.0 -1.55 -1.71 -0.9618 PhilEx2_000344 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P15 compound treatment 598421.2963 54100.0 0.25 507019.9203 -83900.0 -0.45 -0.1382 -0.2708 PhilEx2_000345 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P16 compound treatment 453210.728 -91100.0 -0.42 466412.3711 -125000.0 -0.66 -0.764 -0.9761 PhilEx2_000346 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P17 compound treatment 375169.8113 -169000.0 -0.78 301252.8736 -290000.0 -1.54 -1.638 -0.9506 PhilEx2_000347 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P18 compound treatment 504664.0 -39600.0 -0.18 500899.2806 -90000.0 -0.48 -0.4669 -0.9131 PhilEx2_000348 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P19 compound treatment 463469.2982 -80800.0 -0.37 462888.8889 -128000.0 -0.68 -0.7438 -0.9601 PhilEx2_000349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P20 compound treatment 389910.3448 -154000.0 -0.71 421055.9701 -170000.0 -0.9 -1.1406 -0.9932 PhilEx2_000350 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P21 compound treatment 374822.335 -169000.0 -0.78 192333.3333 -399000.0 -2.11 -2.0476 -0.9084 PhilEx2_000351 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P22 compound treatment 464910.7807 -79400.0 -0.37 487094.9153 -104000.0 -0.55 -0.6483 -0.9803 PhilEx2_000352 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P23 mock treatment 445752.1368 -98500.0 -0.45 431731.8008 -159000.0 -0.84 -0.9184 -0.9578 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1341 P24 mock treatment 450092.2509 -94200.0 -0.43 794426.8585 203000.0 1.08 0.456 0.3919 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A01 compound treatment 563627.8027 -30500.0 -0.14 526770.5628 -64200.0 -0.34 -0.3401 -0.9236 PhilEx2_000353 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A02 compound treatment 510772.5118 -83400.0 -0.38 545246.8085 -45700.0 -0.24 -0.4431 -0.9752 PhilEx2_000354 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A03 compound treatment 444689.8148 -149000.0 -0.69 593932.1267 3010.0 0.02 -0.476 -0.6906 PhilEx2_000355 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A04 compound treatment 583489.4515 -10600.0 -0.05 579548.3871 -11400.0 -0.06 -0.0774 -0.9947 PhilEx2_000356 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A05 compound treatment 646514.8936 52400.0 0.24 649912.5 59000.0 0.31 0.3921 0.9918 PhilEx2_000357 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A06 compound treatment 576415.5844 -17700.0 -0.08 497634.5178 -93300.0 -0.49 -0.4076 -0.8128 PhilEx2_000358 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A07 compound treatment 668440.3292 74300.0 0.34 559400.0 -31500.0 -0.17 0.1241 0.3254 PhilEx2_000359 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A08 compound treatment 501539.1705 -92600.0 -0.43 570219.8276 -20700.0 -0.11 -0.3796 -0.861 PhilEx2_000360 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A09 compound treatment 553960.1594 -40200.0 -0.19 733464.9123 143000.0 0.76 0.4036 0.5185 PhilEx2_000361 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A10 compound treatment 504820.9607 -89300.0 -0.41 530847.8261 -60100.0 -0.32 -0.5165 -0.992 PhilEx2_000362 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A11 compound treatment 541712.7273 -52400.0 -0.24 544974.8954 -46000.0 -0.24 -0.3433 -1.0 PhilEx2_000363 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A12 compound treatment 515411.7647 -78700.0 -0.36 470072.2222 -121000.0 -0.64 -0.7099 -0.9637 PhilEx2_000364 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A13 compound treatment 672527.897 78400.0 0.36 565954.023 -25000.0 -0.13 0.162 0.4207 PhilEx2_000365 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A14 compound treatment 663706.1404 69600.0 0.32 623219.7802 32300.0 0.17 0.348 0.9568 PhilEx2_000366 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A15 compound treatment 639581.6733 45500.0 0.21 546486.0558 -44400.0 -0.24 -0.0184 -0.0585 PhilEx2_000367 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A16 compound treatment 508639.0041 -85500.0 -0.39 599472.4409 8550.0 0.05 -0.2467 -0.6217 PhilEx2_000368 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A17 compound treatment 637991.0714 43900.0 0.2 668631.1475 77700.0 0.41 0.4345 0.9463 PhilEx2_000369 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A18 compound treatment 458454.1284 -136000.0 -0.63 433267.6056 -158000.0 -0.84 -1.0337 -0.9898 PhilEx2_000370 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A19 compound treatment 531030.5344 -63100.0 -0.29 525300.7519 -65600.0 -0.35 -0.4519 -0.996 PhilEx2_000371 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A20 mock treatment 539616.0714 -54500.0 -0.25 575521.7391 -15400.0 -0.08 -0.2355 -0.8911 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A21 mock treatment 971986.413 378000.0 1.74 1112864.499 522000.0 2.77 3.1897 0.9751 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A22 mock treatment 1163851.648 570000.0 2.63 1152820.313 562000.0 2.98 3.9652 0.998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A23 mock treatment 535156.0 -59000.0 -0.27 893968.5535 303000.0 1.61 0.9443 0.5792 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 A24 mock treatment 882972.4518 289000.0 1.33 990411.6022 399000.0 2.12 2.4402 0.975 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B01 compound treatment 451169.697 -143000.0 -0.66 344016.3934 -247000.0 -1.31 -1.3922 -0.9495 PhilEx2_000372 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B02 compound treatment 676070.5882 81900.0 0.38 810750.9881 220000.0 1.17 1.0917 0.8907 PhilEx2_000373 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B03 compound treatment 40985.0746 -553000.0 -2.55 53754.717 -537000.0 -2.85 -3.8184 -0.9985 PhilEx2_000374 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B04 compound treatment 613137.037 19000.0 0.09 593007.2993 2080.0 0.01 0.0698 0.7899 PhilEx2_000375 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B05 compound treatment 161752.0661 -432000.0 -1.99 159540.3226 -431000.0 -2.29 -3.0278 -0.9976 PhilEx2_000376 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B06 compound treatment 460596.2264 -134000.0 -0.62 696625.0 106000.0 0.56 -0.039 -0.0468 PhilEx2_000377 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B07 compound treatment 606113.8211 12000.0 0.06 702073.93 111000.0 0.59 0.4559 0.77 PhilEx2_000378 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B08 compound treatment 606096.1538 12000.0 0.06 662391.3043 71500.0 0.38 0.3071 0.8016 PhilEx2_000379 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B09 compound treatment 756046.0251 162000.0 0.75 589825.7261 -1100.0 -0.01 0.5239 0.7016 PhilEx2_000380 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B10 compound treatment 659425.6198 65300.0 0.3 754141.2214 163000.0 0.87 0.8251 0.9002 PhilEx2_000381 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B11 compound treatment 632916.6667 38800.0 0.18 594705.3942 3780.0 0.02 0.1407 0.7814 PhilEx2_000382 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B12 compound treatment 438269.3878 -156000.0 -0.72 444461.1872 -146000.0 -0.78 -1.0576 -0.9992 PhilEx2_000383 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B13 compound treatment 658422.6415 64300.0 0.3 510753.6232 -80200.0 -0.43 -0.091 -0.1756 PhilEx2_000384 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B14 compound treatment 75079.5455 -519000.0 -2.39 231291.0448 -360000.0 -1.91 -3.0414 -0.9937 PhilEx2_000385 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B15 compound treatment 522742.7386 -71400.0 -0.33 626278.481 35400.0 0.19 -0.1002 -0.2645 PhilEx2_000386 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B16 compound treatment 579105.4688 -15000.0 -0.07 591198.3806 272.0 0.0 -0.048 -0.6922 PhilEx2_000387 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B17 compound treatment 579516.3934 -14600.0 -0.07 540494.4238 -50400.0 -0.27 -0.2368 -0.8584 PhilEx2_000388 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B18 compound treatment 581842.2939 -12300.0 -0.06 632144.2953 41200.0 0.22 0.1145 0.5071 PhilEx2_000389 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B19 compound treatment 498069.7674 -96100.0 -0.44 656635.6275 65700.0 0.35 -0.0668 -0.1185 PhilEx2_000390 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B20 mock treatment 659628.3186 65500.0 0.3 493422.7642 -97500.0 -0.52 -0.1521 -0.2539 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B21 mock treatment 591724.7387 -2400.0 -0.01 623435.2941 32500.0 0.17 0.1141 0.6603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B22 mock treatment 564782.2878 -29300.0 -0.14 697606.4257 107000.0 0.57 0.3044 0.5232 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B23 mock treatment 552184.5638 -41900.0 -0.19 423597.4576 -167000.0 -0.89 -0.7643 -0.8415 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 B24 mock treatment 553593.75 -40500.0 -0.19 618195.4023 27300.0 0.14 -0.0299 -0.1265 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C01 compound treatment 464222.2222 -130000.0 -0.6 565495.4128 -25400.0 -0.13 -0.519 -0.8452 PhilEx2_000391 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C02 compound treatment 740686.9565 147000.0 0.68 763378.0488 172000.0 0.91 1.1247 0.9889 PhilEx2_000392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C03 compound treatment 561772.5632 -32400.0 -0.15 645852.7132 54900.0 0.29 0.1005 0.307 PhilEx2_000393 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C04 compound treatment 736211.7117 142000.0 0.66 662473.6842 71500.0 0.38 0.7317 0.9663 PhilEx2_000394 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C05 compound treatment 484811.7647 -109000.0 -0.5 550130.1115 -40800.0 -0.22 -0.5095 -0.9287 PhilEx2_000395 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C06 compound treatment 505238.0952 -88900.0 -0.41 543640.625 -47300.0 -0.25 -0.4672 -0.9722 PhilEx2_000396 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C07 compound treatment 567920.1389 -26200.0 -0.12 587200.0 -3730.0 -0.02 -0.0994 -0.812 PhilEx2_000397 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C08 compound treatment 608662.963 14500.0 0.07 633188.2353 42300.0 0.22 0.2059 0.8801 PhilEx2_000398 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C09 compound treatment 735782.4427 142000.0 0.65 768851.145 178000.0 0.94 1.1292 0.9839 PhilEx2_000399 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C10 compound treatment 533833.3333 -60300.0 -0.28 472535.0877 -118000.0 -0.63 -0.6406 -0.9328 PhilEx2_000400 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C11 compound treatment 673623.8532 79500.0 0.37 648654.902 57700.0 0.31 0.4757 0.996 PhilEx2_000401 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C12 compound treatment 531978.836 -62100.0 -0.29 592193.3702 1270.0 0.01 -0.1979 -0.6903 PhilEx2_000402 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C13 compound treatment 611783.27 17700.0 0.08 616929.8893 26000.0 0.14 0.1551 0.9684 PhilEx2_000403 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C14 compound treatment 590815.8845 -3310.0 -0.02 656198.5019 65300.0 0.35 0.234 0.6753 PhilEx2_000404 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C15 compound treatment 567915.7509 -26200.0 -0.12 610603.1746 19700.0 0.1 -0.0117 -0.0731 PhilEx2_000405 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C16 compound treatment 458995.4128 -135000.0 -0.62 494363.2287 -96600.0 -0.51 -0.8028 -0.9953 PhilEx2_000406 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C17 compound treatment 350546.4684 -244000.0 -1.12 568241.6357 -22700.0 -0.12 -0.8794 -0.7784 PhilEx2_000407 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C18 compound treatment 470982.7586 -123000.0 -0.57 492133.8912 -98800.0 -0.52 -0.7721 -0.9992 PhilEx2_000408 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C19 compound treatment 393420.1389 -201000.0 -0.93 610918.6047 20000.0 0.11 -0.5795 -0.622 PhilEx2_000409 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C20 mock treatment 599506.0729 5380.0 0.02 528133.8583 -62800.0 -0.33 -0.218 -0.6526 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C21 mock treatment 699698.6755 106000.0 0.49 639863.0137 48900.0 0.26 0.5278 0.9566 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C22 mock treatment 612949.5268 18800.0 0.09 586993.808 -3930.0 -0.02 0.0466 0.5223 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C23 mock treatment 556741.6974 -37400.0 -0.17 612364.0351 21400.0 0.11 -0.0415 -0.201 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 C24 mock treatment 517264.0845 -76900.0 -0.35 637312.7413 46400.0 0.25 -0.0767 -0.1777 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D01 compound treatment 565781.0945 -28300.0 -0.13 444995.9839 -146000.0 -0.77 -0.6397 -0.815 PhilEx2_000410 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D02 compound treatment 587995.6522 -6130.0 -0.03 698173.3333 107000.0 0.57 0.3822 0.6711 PhilEx2_000411 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D03 compound treatment 537358.1395 -56800.0 -0.26 460270.7424 -131000.0 -0.69 -0.6751 -0.9114 PhilEx2_000412 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D04 compound treatment 577754.5126 -16400.0 -0.08 632573.2218 41600.0 0.22 0.1028 0.4404 PhilEx2_000413 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D05 compound treatment 280075.5814 -314000.0 -1.45 297739.645 -293000.0 -1.56 -2.1237 -0.9994 PhilEx2_000414 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D06 compound treatment 548219.6078 -45900.0 -0.21 760982.5328 170000.0 0.9 0.4881 0.5268 PhilEx2_000415 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D07 compound treatment 610781.1321 16700.0 0.08 677847.2727 86900.0 0.46 0.3803 0.8137 PhilEx2_000416 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D08 compound treatment 560401.5152 -33700.0 -0.16 681960.0 91000.0 0.48 0.2314 0.4563 PhilEx2_000417 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D09 compound treatment 559831.6498 -34300.0 -0.16 722008.1967 131000.0 0.7 0.3798 0.5327 PhilEx2_000418 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D10 compound treatment 659379.9127 65300.0 0.3 532512.2951 -58400.0 -0.31 -0.0063 -0.0146 PhilEx2_000419 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D11 compound treatment 644134.4538 50000.0 0.23 666020.8333 75100.0 0.4 0.4447 0.9662 PhilEx2_000420 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D12 compound treatment 256487.395 -338000.0 -1.56 458633.7209 -132000.0 -0.7 -1.5972 -0.9352 PhilEx2_000421 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D13 compound treatment 578281.746 -15800.0 -0.07 617600.0 26700.0 0.14 0.0484 0.3038 PhilEx2_000422 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D14 compound treatment 486512.9151 -108000.0 -0.5 513146.9534 -77800.0 -0.41 -0.6426 -0.9958 PhilEx2_000423 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D15 compound treatment 574880.8511 -19200.0 -0.09 625546.2185 34600.0 0.18 0.0671 0.3289 PhilEx2_000424 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D16 compound treatment 605075.6014 11000.0 0.05 647505.4945 56600.0 0.3 0.2479 0.8146 PhilEx2_000425 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D17 compound treatment 554579.5053 -39500.0 -0.18 470433.0357 -120000.0 -0.64 -0.5809 -0.874 PhilEx2_000426 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D18 compound treatment 501705.8824 -92400.0 -0.43 633316.2055 42400.0 0.22 -0.1424 -0.2955 PhilEx2_000427 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D19 compound treatment 566619.7183 -27500.0 -0.13 615744.0 24800.0 0.13 0.0034 0.0185 PhilEx2_000428 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D20 mock treatment 590712.5984 -3410.0 -0.02 672513.308 81600.0 0.43 0.2949 0.6809 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D21 mock treatment 592048.7805 -2080.0 -0.01 631166.1442 40200.0 0.21 0.1441 0.6747 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D22 mock treatment 473054.6624 -121000.0 -0.56 584666.6667 -6260.0 -0.03 -0.4183 -0.7478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D23 mock treatment 586185.1852 -7940.0 -0.04 549974.1935 -41000.0 -0.22 -0.1795 -0.8148 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 D24 mock treatment 575791.1392 -18300.0 -0.08 512020.4778 -78900.0 -0.42 -0.3557 -0.8331 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E01 compound treatment 533600.8969 -60500.0 -0.28 563828.3262 -27100.0 -0.14 -0.299 -0.9524 PhilEx2_000429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E02 compound treatment 595691.9431 1570.0 0.01 699743.5897 109000.0 0.58 0.4132 0.7159 PhilEx2_000430 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E03 compound treatment 606470.339 12300.0 0.06 634768.595 43800.0 0.23 0.2047 0.855 PhilEx2_000431 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E04 compound treatment 616772.2772 22600.0 0.1 593987.1245 3060.0 0.02 0.0853 0.8073 PhilEx2_000432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E05 compound treatment 573029.6296 -21100.0 -0.1 616753.9683 25800.0 0.14 0.0281 0.1671 PhilEx2_000433 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E06 compound treatment 582527.2727 -11600.0 -0.05 579085.4093 -11800.0 -0.06 -0.0822 -0.9968 PhilEx2_000434 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E07 compound treatment 496919.2982 -97200.0 -0.45 588590.0 -2340.0 -0.01 -0.3257 -0.7264 PhilEx2_000435 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E08 compound treatment 578795.8333 -15300.0 -0.07 569464.0288 -21500.0 -0.11 -0.1305 -0.9737 PhilEx2_000436 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E09 compound treatment 437939.1892 -156000.0 -0.72 593429.7189 2500.0 0.01 -0.4999 -0.694 PhilEx2_000437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E10 compound treatment 528824.0343 -65300.0 -0.3 446235.9551 -145000.0 -0.77 -0.7556 -0.9165 PhilEx2_000438 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E11 compound treatment 607585.4922 13500.0 0.06 591610.0386 683.0 0.0 0.0465 0.7471 PhilEx2_000439 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E12 compound treatment 423394.0887 -171000.0 -0.79 447212.1212 -144000.0 -0.76 -1.0957 -0.9999 PhilEx2_000440 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E13 compound treatment 580526.8293 -13600.0 -0.06 493635.3383 -97300.0 -0.52 -0.4092 -0.7872 PhilEx2_000441 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E14 compound treatment 630463.1148 36300.0 0.17 660283.5249 69400.0 0.37 0.3786 0.9366 PhilEx2_000442 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E15 compound treatment 573059.0406 -21100.0 -0.1 542406.639 -48500.0 -0.26 -0.2507 -0.9113 PhilEx2_000443 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E16 compound treatment 491090.4762 -103000.0 -0.48 527853.8813 -63100.0 -0.33 -0.5725 -0.9853 PhilEx2_000444 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E17 compound treatment 455427.451 -139000.0 -0.64 520719.0635 -70200.0 -0.37 -0.7156 -0.9669 PhilEx2_000445 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E18 compound treatment 494269.4301 -99900.0 -0.46 448307.6923 -143000.0 -0.76 -0.8605 -0.9717 PhilEx2_000446 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E19 compound treatment 724492.3077 130000.0 0.6 679391.6667 88500.0 0.47 0.7569 0.9925 PhilEx2_000447 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E20 mock treatment 501201.581 -92900.0 -0.43 604712.0 13800.0 0.07 -0.2513 -0.5781 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E21 mock treatment 575600.7067 -18500.0 -0.09 716993.2886 126000.0 0.67 0.4124 0.6118 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E22 mock treatment 555594.9821 -38500.0 -0.18 618824.5033 27900.0 0.15 -0.021 -0.0909 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E23 mock treatment 463761.4035 -130000.0 -0.6 647250.8591 56300.0 0.3 -0.2139 -0.3186 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 E24 mock treatment 572849.4208 -21300.0 -0.1 621299.2126 30400.0 0.16 0.0445 0.2361 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F01 compound treatment 617447.6987 23300.0 0.11 471410.9589 -120000.0 -0.63 -0.3722 -0.5789 PhilEx2_000448 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F02 compound treatment 618860.4651 24700.0 0.11 708980.6202 118000.0 0.63 0.5234 0.8224 PhilEx2_000449 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F03 compound treatment 451849.162 -142000.0 -0.66 549797.1698 -41100.0 -0.22 -0.6182 -0.8941 PhilEx2_000450 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F04 compound treatment 592577.0609 -1550.0 -0.01 540518.797 -50400.0 -0.27 -0.1941 -0.7257 PhilEx2_000451 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F05 compound treatment 407800.905 -186000.0 -0.86 429918.6047 -161000.0 -0.85 -1.2114 -1.0 PhilEx2_000452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F06 compound treatment 634803.9216 40700.0 0.19 783948.5981 193000.0 1.02 0.8566 0.823 PhilEx2_000453 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F07 compound treatment 608164.8352 14000.0 0.06 573614.5455 -17300.0 -0.09 -0.0191 -0.1704 PhilEx2_000454 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F08 compound treatment 666031.3589 71900.0 0.33 579353.1353 -11600.0 -0.06 0.1911 0.5666 PhilEx2_000455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F09 compound treatment 639588.0282 45500.0 0.21 643909.0909 53000.0 0.28 0.347 0.9896 PhilEx2_000456 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F10 compound treatment 455641.8605 -138000.0 -0.64 351331.6832 -240000.0 -1.27 -1.3502 -0.9493 PhilEx2_000457 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F11 compound treatment 527750.0 -66400.0 -0.31 738995.3271 148000.0 0.79 0.3389 0.402 PhilEx2_000458 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F12 compound treatment 544183.4532 -49900.0 -0.23 557629.4964 -33300.0 -0.18 -0.2877 -0.9914 PhilEx2_000459 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F13 compound treatment 612626.9841 18500.0 0.09 564429.6029 -26500.0 -0.14 -0.039 -0.2375 PhilEx2_000460 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F14 compound treatment 407078.6517 -187000.0 -0.86 553836.8421 -37100.0 -0.2 -0.749 -0.8466 PhilEx2_000461 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F15 compound treatment 450857.6389 -143000.0 -0.66 743341.1215 152000.0 0.81 0.1044 0.1 PhilEx2_000462 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F16 compound treatment 579131.3869 -15000.0 -0.07 536604.7619 -54300.0 -0.29 -0.2526 -0.8526 PhilEx2_000463 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F17 compound treatment 642137.8092 48000.0 0.22 624540.4531 33600.0 0.18 0.2826 0.9942 PhilEx2_000464 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F18 compound treatment 497151.3158 -97000.0 -0.45 572674.8252 -18300.0 -0.1 -0.3847 -0.8407 PhilEx2_000465 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F19 compound treatment 471503.0864 -123000.0 -0.57 593520.9003 2590.0 0.01 -0.3901 -0.6897 PhilEx2_000466 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F20 mock treatment 443805.5556 -150000.0 -0.69 582442.3077 -8480.0 -0.05 -0.522 -0.7514 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F21 mock treatment 584396.6667 -9730.0 -0.04 626719.6262 35800.0 0.19 0.1025 0.5255 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F22 mock treatment 481713.2867 -112000.0 -0.52 577117.4242 -13800.0 -0.07 -0.4184 -0.7991 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F23 mock treatment 501301.0381 -92800.0 -0.43 599691.7563 8770.0 0.05 -0.2698 -0.6266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 F24 mock treatment 529866.1972 -64300.0 -0.3 722476.378 132000.0 0.7 0.2838 0.3744 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G01 compound treatment 485528.0374 -109000.0 -0.5 656636.3636 65700.0 0.35 -0.1077 -0.1765 PhilEx2_000467 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G02 compound treatment 678724.4444 84600.0 0.39 738683.3333 148000.0 0.78 0.83 0.9481 PhilEx2_000468 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G03 compound treatment 647828.3262 53700.0 0.25 641320.1581 50400.0 0.27 0.3641 0.9993 PhilEx2_000469 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G04 compound treatment 535482.2134 -58600.0 -0.27 536677.551 -54200.0 -0.29 -0.3947 -0.9995 PhilEx2_000470 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G05 compound treatment 524147.0588 -70000.0 -0.32 625197.6285 34300.0 0.18 -0.0997 -0.2691 PhilEx2_000471 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G06 compound treatment 555550.6608 -38600.0 -0.18 414663.8298 -176000.0 -0.93 -0.7869 -0.8268 PhilEx2_000472 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G07 compound treatment 473080.0 -121000.0 -0.56 452868.8525 -138000.0 -0.73 -0.9125 -0.991 PhilEx2_000473 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G08 compound treatment 485328.9474 -109000.0 -0.5 422546.7128 -168000.0 -0.89 -0.9863 -0.9628 PhilEx2_000474 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G09 compound treatment 548954.386 -45200.0 -0.21 482461.8182 -108000.0 -0.58 -0.5541 -0.9056 PhilEx2_000475 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G10 compound treatment 412936.7089 -181000.0 -0.84 362275.3036 -229000.0 -1.21 -1.4484 -0.9835 PhilEx2_000476 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G11 compound treatment 537035.5872 -57100.0 -0.26 528255.6634 -62700.0 -0.33 -0.4212 -0.9933 PhilEx2_000477 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G12 compound treatment 476433.79 -118000.0 -0.54 463304.5113 -128000.0 -0.68 -0.8624 -0.994 PhilEx2_000478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G13 compound treatment 467266.055 -127000.0 -0.59 552670.6349 -38300.0 -0.2 -0.5572 -0.8998 PhilEx2_000479 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G14 compound treatment 440666.6667 -153000.0 -0.71 559085.0202 -31800.0 -0.17 -0.6198 -0.8519 PhilEx2_000480 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G15 compound treatment 452764.9573 -141000.0 -0.65 576816.4063 -14100.0 -0.07 -0.5139 -0.7831 PhilEx2_000481 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G16 compound treatment 377275.0 -217000.0 -1.0 584574.6269 -6350.0 -0.03 -0.731 -0.7305 PhilEx2_000482 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G17 compound treatment 527533.8078 -66600.0 -0.31 610769.5167 19800.0 0.11 -0.1427 -0.4397 PhilEx2_000483 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G18 compound treatment 49212.766 -545000.0 -2.51 66000.0 -525000.0 -2.78 -3.7456 -0.9987 PhilEx2_000484 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G19 compound treatment 501742.0495 -92400.0 -0.43 583755.3957 -7170.0 -0.04 -0.3282 -0.7672 PhilEx2_000485 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G20 mock treatment 455878.1362 -138000.0 -0.64 607350.4274 16400.0 0.09 -0.3892 -0.6049 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G21 mock treatment 599430.83 5310.0 0.02 546612.9032 -44300.0 -0.24 -0.1489 -0.6301 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G22 mock treatment 543996.139 -50100.0 -0.23 529347.2669 -61600.0 -0.33 -0.3944 -0.9857 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G23 mock treatment 530072.1649 -64100.0 -0.3 566387.3239 -24500.0 -0.13 -0.3009 -0.9322 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 G24 mock treatment 478700.3745 -115000.0 -0.53 550587.156 -40300.0 -0.21 -0.5277 -0.9198 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H01 compound treatment 319503.8168 -275000.0 -1.27 306191.3043 -285000.0 -1.51 -1.9634 -0.9962 PhilEx2_000486 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H02 compound treatment 488032.6531 -106000.0 -0.49 575178.2609 -15700.0 -0.08 -0.405 -0.816 PhilEx2_000487 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H03 compound treatment 487956.9378 -106000.0 -0.49 623253.886 32300.0 0.17 -0.225 -0.4337 PhilEx2_000488 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H04 compound treatment 687680.1802 93600.0 0.43 608000.0 17100.0 0.09 0.3691 0.8373 PhilEx2_000489 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H05 compound treatment 409076.5957 -185000.0 -0.85 395740.9326 -195000.0 -1.04 -1.3355 -0.9954 PhilEx2_000490 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H06 compound treatment 471503.4722 -123000.0 -0.57 502453.6082 -88500.0 -0.47 -0.7317 -0.9957 PhilEx2_000491 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H07 compound treatment 537635.1931 -56500.0 -0.26 608712.0 17800.0 0.09 -0.1175 -0.4241 PhilEx2_000492 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H08 compound treatment 579514.1509 -14600.0 -0.07 485256.4103 -106000.0 -0.56 -0.444 -0.7865 PhilEx2_000493 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H09 compound treatment 535024.0964 -59100.0 -0.27 508552.1739 -82400.0 -0.44 -0.5017 -0.9742 PhilEx2_000494 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H10 compound treatment 448201.8779 -146000.0 -0.67 470603.1746 -120000.0 -0.64 -0.9271 -0.9996 PhilEx2_000495 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H11 compound treatment 649245.2107 55100.0 0.25 583539.7924 -7390.0 -0.04 0.152 0.5911 PhilEx2_000496 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H12 compound treatment 499533.5968 -94600.0 -0.44 518746.8354 -72200.0 -0.38 -0.5792 -0.9979 PhilEx2_000497 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H13 compound treatment 536008.3333 -58100.0 -0.27 552215.4472 -38700.0 -0.21 -0.3347 -0.9913 PhilEx2_000498 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H14 compound treatment 366536.5854 -228000.0 -1.05 487786.6109 -103000.0 -0.55 -1.129 -0.9539 PhilEx2_000499 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H15 compound treatment 513367.4912 -80800.0 -0.37 551421.2766 -39500.0 -0.21 -0.4115 -0.963 PhilEx2_000500 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H16 compound treatment 475891.3043 -118000.0 -0.55 604343.75 13400.0 0.07 -0.3352 -0.6096 PhilEx2_000501 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H17 compound treatment 482907.5908 -111000.0 -0.51 445550.8772 -145000.0 -0.77 -0.9079 -0.9804 PhilEx2_000502 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H18 compound treatment 491012.3967 -103000.0 -0.48 518320.8333 -72600.0 -0.39 -0.6085 -0.9945 PhilEx2_000503 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H19 compound treatment 423344.3709 -171000.0 -0.79 454472.3247 -136000.0 -0.72 -1.0687 -0.9991 PhilEx2_000504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H20 mock treatment 447117.0213 -147000.0 -0.68 472639.0244 -118000.0 -0.63 -0.923 -0.9993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H21 mock treatment 534210.5263 -59900.0 -0.28 544903.125 -46000.0 -0.24 -0.368 -0.9981 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H22 mock treatment 531184.953 -62900.0 -0.29 613553.6913 22600.0 0.12 -0.1204 -0.3833 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H23 mock treatment 525688.9632 -68400.0 -0.32 589258.3026 -1670.0 -0.01 -0.2294 -0.7266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 H24 mock treatment 580311.1888 -13800.0 -0.06 557895.3069 -33000.0 -0.18 -0.1689 -0.9062 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I01 compound treatment 503533.3333 -90600.0 -0.42 548908.2126 -42000.0 -0.22 -0.453 -0.9567 PhilEx2_000505 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I02 compound treatment 586781.6594 -7340.0 -0.03 788232.3651 197000.0 1.05 0.716 0.6839 PhilEx2_000506 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I03 compound treatment 534085.5019 -60000.0 -0.28 578690.6475 -12200.0 -0.06 -0.2417 -0.8498 PhilEx2_000507 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I04 compound treatment 540020.9205 -54100.0 -0.25 575199.2481 -15700.0 -0.08 -0.2354 -0.8948 PhilEx2_000508 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I05 compound treatment 399978.2609 -194000.0 -0.9 94000.0 -497000.0 -2.64 -2.4968 -0.897 PhilEx2_000509 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I06 compound treatment 360708.3333 -233000.0 -1.08 478705.2239 -112000.0 -0.6 -1.182 -0.961 PhilEx2_000510 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I07 compound treatment 512563.1769 -81600.0 -0.38 394107.0111 -197000.0 -1.04 -1.0041 -0.9049 PhilEx2_000511 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I08 compound treatment 568800.0 -25300.0 -0.12 520369.0476 -70600.0 -0.37 -0.3472 -0.8857 PhilEx2_000512 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I09 compound treatment 566949.4585 -27200.0 -0.13 490942.492 -100000.0 -0.53 -0.4636 -0.8508 PhilEx2_000513 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I10 compound treatment 475739.1304 -118000.0 -0.55 419048.1928 -172000.0 -0.91 -1.0307 -0.9699 PhilEx2_000514 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I11 compound treatment 599019.2308 4890.0 0.02 539288.7324 -51600.0 -0.27 -0.1777 -0.6466 PhilEx2_000515 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I12 compound treatment 334750.0 -259000.0 -1.2 353554.0541 -237000.0 -1.26 -1.7361 -0.9997 PhilEx2_000516 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I13 compound treatment 579220.9302 -14900.0 -0.07 550591.7431 -40300.0 -0.21 -0.1999 -0.8895 PhilEx2_000517 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I14 compound treatment 232094.0171 -362000.0 -1.67 399106.7961 -192000.0 -1.02 -1.9 -0.9718 PhilEx2_000518 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I15 compound treatment 558896.1938 -35200.0 -0.16 615388.6463 24500.0 0.13 -0.0231 -0.1113 PhilEx2_000519 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I16 compound treatment 50847.8261 -543000.0 -2.51 59000.0 -532000.0 -2.82 -3.7666 -0.9982 PhilEx2_000520 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I17 compound treatment 565890.566 -28200.0 -0.13 581011.236 -9920.0 -0.05 -0.1293 -0.9205 PhilEx2_000521 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I18 compound treatment 366175.8794 -228000.0 -1.05 601290.0763 10400.0 0.05 -0.7045 -0.6692 PhilEx2_000522 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I19 mock treatment 506688.5813 -87400.0 -0.4 542934.2105 -48000.0 -0.25 -0.4651 -0.9754 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I20 mock treatment 499833.3333 -94300.0 -0.43 547702.1277 -43200.0 -0.23 -0.4696 -0.9553 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I21 mock treatment 597862.9738 3740.0 0.02 628792.0 37900.0 0.2 0.1542 0.765 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I22 mock treatment 552488.9706 -41600.0 -0.19 554457.2491 -36500.0 -0.19 -0.2726 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I23 mock treatment 749148.4375 155000.0 0.71 634685.259 43800.0 0.23 0.6696 0.8909 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 I24 mock treatment 570199.3127 -23900.0 -0.11 618207.0313 27300.0 0.14 0.0243 0.1335 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J01 compound treatment 158361.1111 -436000.0 -2.01 56100.0 -535000.0 -2.84 -3.4269 -0.9857 PhilEx2_000523 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J02 compound treatment 645179.8561 51100.0 0.24 588445.3125 -2480.0 -0.01 0.1572 0.6665 PhilEx2_000524 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J03 compound treatment 587427.3504 -6700.0 -0.03 533721.6495 -57200.0 -0.3 -0.2364 -0.7751 PhilEx2_000525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J04 compound treatment 643755.5556 49600.0 0.23 620339.5522 29400.0 0.16 0.2722 0.9825 PhilEx2_000526 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J05 compound treatment 608454.8872 14300.0 0.07 681847.6563 90900.0 0.48 0.3877 0.7966 PhilEx2_000527 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J06 compound treatment 620066.6667 25900.0 0.12 617184.5638 26300.0 0.14 0.1831 0.9971 PhilEx2_000528 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J07 compound treatment 646935.1145 52800.0 0.24 550082.2511 -40800.0 -0.22 0.019 0.0584 PhilEx2_000529 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J08 compound treatment 584432.7731 -9690.0 -0.04 587415.9664 -3510.0 -0.02 -0.0448 -0.9246 PhilEx2_000530 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J09 compound treatment 715717.2131 122000.0 0.56 694400.0 103000.0 0.55 0.7846 0.9999 PhilEx2_000531 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J10 compound treatment 454206.4516 -140000.0 -0.65 578500.0 -12400.0 -0.07 -0.5029 -0.7753 PhilEx2_000532 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J11 compound treatment 643003.7313 48900.0 0.23 667307.6923 76400.0 0.41 0.4459 0.9617 PhilEx2_000533 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J12 compound treatment 373683.3977 -220000.0 -1.02 417133.8583 -174000.0 -0.92 -1.3707 -0.9988 PhilEx2_000534 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J13 compound treatment 618570.3971 24400.0 0.11 577524.1379 -13400.0 -0.07 0.0294 0.221 PhilEx2_000535 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J14 compound treatment 271894.2308 -322000.0 -1.49 327149.2537 -264000.0 -1.4 -2.0401 -0.9995 PhilEx2_000536 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J15 compound treatment 552130.2817 -42000.0 -0.19 500770.4918 -90200.0 -0.48 -0.4751 -0.9208 PhilEx2_000537 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J16 compound treatment 531410.9091 -62700.0 -0.29 601161.6541 10200.0 0.05 -0.1661 -0.5645 PhilEx2_000538 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J17 compound treatment 469719.5946 -124000.0 -0.57 613254.386 22300.0 0.12 -0.3219 -0.5496 PhilEx2_000539 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J18 compound treatment 510813.6201 -83300.0 -0.38 557974.7292 -33000.0 -0.17 -0.3953 -0.9364 PhilEx2_000540 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J19 mock treatment 591017.5439 -3110.0 -0.01 534266.436 -56700.0 -0.3 -0.2226 -0.74 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J20 mock treatment 447807.0175 -146000.0 -0.67 550404.6512 -40500.0 -0.21 -0.6291 -0.8884 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J21 mock treatment 790187.6485 196000.0 0.9 535984.0256 -54900.0 -0.29 0.4333 0.4561 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J22 mock treatment 687550.4323 93400.0 0.43 516294.8328 -74600.0 -0.4 0.0247 0.0423 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J23 mock treatment 585590.7591 -8530.0 -0.04 556404.6823 -34500.0 -0.18 -0.1573 -0.8399 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 J24 mock treatment 531169.1729 -63000.0 -0.29 519692.5926 -71200.0 -0.38 -0.4725 -0.9915 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K01 compound treatment 518962.0253 -75200.0 -0.35 542930.2326 -48000.0 -0.25 -0.4251 -0.9885 PhilEx2_000541 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K02 compound treatment 619400.8097 25300.0 0.12 782681.2227 192000.0 1.02 0.8016 0.783 PhilEx2_000542 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K03 compound treatment 532181.8182 -61900.0 -0.29 609796.4286 18900.0 0.1 -0.1312 -0.4335 PhilEx2_000543 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K04 compound treatment 631557.0776 37400.0 0.17 633791.6667 42900.0 0.23 0.2828 0.9908 PhilEx2_000544 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K05 compound treatment 721138.7755 127000.0 0.59 645505.7915 54600.0 0.29 0.6189 0.9472 PhilEx2_000545 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K06 compound treatment 727510.2881 133000.0 0.62 576512.2807 -14400.0 -0.08 0.3809 0.6145 PhilEx2_000546 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K07 compound treatment 651844.6215 57700.0 0.27 560847.5836 -30100.0 -0.16 0.0754 0.243 PhilEx2_000547 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K08 compound treatment 732637.5 139000.0 0.64 660108.6957 69200.0 0.37 0.7111 0.9654 PhilEx2_000548 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K09 compound treatment 613872.807 19700.0 0.09 580141.0788 -10800.0 -0.06 0.0239 0.2226 PhilEx2_000549 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K10 compound treatment 567040.724 -27100.0 -0.12 746925.1969 156000.0 0.83 0.4967 0.5936 PhilEx2_000550 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K11 compound treatment 704664.0625 111000.0 0.51 535394.1606 -55500.0 -0.29 0.1522 0.2585 PhilEx2_000551 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K12 compound treatment 371836.6013 -222000.0 -1.03 482069.6203 -109000.0 -0.58 -1.1331 -0.9631 PhilEx2_000552 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K13 compound treatment 544962.8253 -49200.0 -0.23 575866.9202 -15100.0 -0.08 -0.2168 -0.9019 PhilEx2_000553 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K14 compound treatment 443427.2727 -151000.0 -0.69 424225.2252 -167000.0 -0.88 -1.1166 -0.9929 PhilEx2_000554 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K15 compound treatment 578730.1587 -15400.0 -0.07 658461.2069 67500.0 0.36 0.2031 0.5561 PhilEx2_000555 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K16 compound treatment 417049.7512 -177000.0 -0.82 464739.5349 -126000.0 -0.67 -1.0507 -0.9951 PhilEx2_000556 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K17 compound treatment 312507.6923 -282000.0 -1.3 646000.0 55100.0 0.29 -0.7118 -0.5347 PhilEx2_000557 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K18 compound treatment 636268.2927 42100.0 0.19 594168.0 3240.0 0.02 0.1496 0.7667 PhilEx2_000558 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K19 mock treatment 612570.922 18400.0 0.09 658297.9592 67400.0 0.36 0.3128 0.8516 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K20 mock treatment 521747.3684 -72400.0 -0.33 623532.2581 32600.0 0.17 -0.1137 -0.3025 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K21 mock treatment 640353.5354 46200.0 0.21 622068.7023 31100.0 0.17 0.2675 0.992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K22 mock treatment 579027.3973 -15100.0 -0.07 719816.5468 129000.0 0.68 0.4342 0.6318 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K23 mock treatment 749194.9861 155000.0 0.72 639400.0 48500.0 0.26 0.6875 0.9046 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 K24 mock treatment 529757.1429 -64400.0 -0.3 571138.0597 -19800.0 -0.1 -0.2841 -0.9024 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L01 compound treatment 577261.5385 -16900.0 -0.08 554131.9797 -36800.0 -0.2 -0.193 -0.9186 PhilEx2_000559 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L02 compound treatment 662121.5686 68000.0 0.31 619554.5852 28600.0 0.15 0.3291 0.9446 PhilEx2_000560 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L03 compound treatment 248990.566 -345000.0 -1.59 195252.4272 -396000.0 -2.1 -2.6094 -0.9907 PhilEx2_000561 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L04 compound treatment 724520.5993 130000.0 0.6 679781.4815 88900.0 0.47 0.7585 0.9927 PhilEx2_000562 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L05 compound treatment 670883.6364 76800.0 0.35 696775.6654 106000.0 0.56 0.6473 0.9753 PhilEx2_000563 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L06 compound treatment 580697.417 -13400.0 -0.06 657175.4967 66200.0 0.35 0.2047 0.5737 PhilEx2_000564 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L07 compound treatment 609189.5161 15100.0 0.07 628306.5134 37400.0 0.2 0.1893 0.9012 PhilEx2_000565 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L08 compound treatment 652906.5744 58800.0 0.27 569049.2958 -21900.0 -0.12 0.1096 0.3718 PhilEx2_000566 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L09 compound treatment 691464.9123 97300.0 0.45 738755.0201 148000.0 0.78 0.8718 0.965 PhilEx2_000567 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L10 compound treatment 460927.7778 -133000.0 -0.61 470893.617 -120000.0 -0.64 -0.8845 -0.9998 PhilEx2_000568 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L11 compound treatment 657290.0763 63200.0 0.29 780902.7237 190000.0 1.01 0.9185 0.8757 PhilEx2_000569 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L12 compound treatment 545043.0108 -49100.0 -0.23 554649.4845 -36300.0 -0.19 -0.2961 -0.9967 PhilEx2_000570 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L13 compound treatment 676018.5185 81900.0 0.38 582721.03 -8210.0 -0.04 0.2363 0.6215 PhilEx2_000571 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L14 compound treatment 457312.7572 -137000.0 -0.63 505848.3607 -85100.0 -0.45 -0.7652 -0.9865 PhilEx2_000572 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L15 compound treatment 625387.5433 31300.0 0.14 536062.2568 -54900.0 -0.29 -0.1038 -0.3197 PhilEx2_000573 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L16 compound treatment 490846.9751 -103000.0 -0.48 577124.498 -13800.0 -0.07 -0.3885 -0.8063 PhilEx2_000574 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L17 compound treatment 605416.6667 11300.0 0.05 608408.3045 17500.0 0.09 0.1024 0.9628 PhilEx2_000575 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L18 compound treatment 479692.029 -114000.0 -0.53 493920.7921 -97000.0 -0.51 -0.737 -0.9999 PhilEx2_000576 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L19 mock treatment 572148.4375 -22000.0 -0.1 509879.0698 -81000.0 -0.43 -0.3756 -0.8505 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L20 mock treatment 623498.0237 29400.0 0.14 612968.6275 22000.0 0.12 0.1785 0.9973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L21 mock treatment 589063.8978 -5060.0 -0.02 611838.961 20900.0 0.11 0.0619 0.5463 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L22 mock treatment 672879.6992 78800.0 0.36 579543.6893 -11400.0 -0.06 0.2141 0.5816 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L23 mock treatment 672928.5714 78800.0 0.36 505036.7893 -85900.0 -0.46 -0.0652 -0.1118 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 L24 mock treatment 693187.3351 99100.0 0.46 668096.0265 77200.0 0.41 0.6125 0.9985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M01 compound treatment 546848.3607 -47300.0 -0.22 581444.4444 -9480.0 -0.05 -0.1897 -0.848 PhilEx2_000577 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M02 compound treatment 739697.5806 146000.0 0.67 649479.6748 58600.0 0.31 0.6943 0.9386 PhilEx2_000578 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M03 compound treatment 638620.9677 44500.0 0.21 546899.2248 -44000.0 -0.23 -0.02 -0.0644 PhilEx2_000579 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M04 compound treatment 691045.6432 96900.0 0.45 600138.3399 9210.0 0.05 0.3506 0.7798 PhilEx2_000580 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M05 compound treatment 693003.663 98900.0 0.46 698416.3823 107000.0 0.57 0.7256 0.9939 PhilEx2_000581 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M06 compound treatment 114690.9091 -479000.0 -2.21 101595.2381 -489000.0 -2.6 -3.3986 -0.9968 PhilEx2_000582 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M07 compound treatment 543352.1127 -50800.0 -0.23 567093.2836 -23800.0 -0.13 -0.255 -0.9581 PhilEx2_000583 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M08 compound treatment 384685.446 -209000.0 -0.97 361982.5328 -229000.0 -1.21 -1.5416 -0.9936 PhilEx2_000584 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M09 compound treatment 632819.2308 38700.0 0.18 738472.2222 148000.0 0.78 0.6795 0.8466 PhilEx2_000585 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M10 compound treatment 597777.7778 3650.0 0.02 614151.1628 23200.0 0.12 0.099 0.7964 PhilEx2_000586 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M11 compound treatment 632875.5187 38800.0 0.18 726821.9178 136000.0 0.72 0.636 0.8565 PhilEx2_000587 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M12 compound treatment 470551.5464 -124000.0 -0.57 235675.6757 -355000.0 -1.88 -1.7353 -0.8815 PhilEx2_000588 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M13 compound treatment 559736.3344 -34400.0 -0.16 792657.9926 202000.0 1.07 0.6445 0.5958 PhilEx2_000589 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M14 compound treatment 432324.6753 -162000.0 -0.75 495400.0 -95500.0 -0.51 -0.8859 -0.9822 PhilEx2_000590 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M15 compound treatment 636886.0294 42800.0 0.2 570713.0435 -20200.0 -0.11 0.0636 0.2835 PhilEx2_000591 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M16 compound treatment 563016.8776 -31100.0 -0.14 544293.1937 -46600.0 -0.25 -0.2763 -0.9664 PhilEx2_000592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M17 compound treatment 578136.0544 -16000.0 -0.07 673831.5018 82900.0 0.44 0.2588 0.5804 PhilEx2_000593 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M18 compound treatment 409008.2305 -185000.0 -0.85 426414.7465 -165000.0 -0.87 -1.2207 -0.9999 PhilEx2_000594 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M19 mock treatment 589023.0769 -5100.0 -0.02 541561.4973 -49400.0 -0.26 -0.2018 -0.7676 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M20 mock treatment 586146.4286 -7980.0 -0.04 469792.4528 -121000.0 -0.64 -0.4803 -0.7464 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M21 mock treatment 785379.845 191000.0 0.88 623257.0423 32300.0 0.17 0.7449 0.8291 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M22 mock treatment 638714.2857 44600.0 0.21 480868.6869 -110000.0 -0.58 -0.2674 -0.432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M23 mock treatment 575111.1111 -19000.0 -0.09 536842.8094 -54100.0 -0.29 -0.2648 -0.8829 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 M24 mock treatment 546285.2234 -47800.0 -0.22 477428.0 -113000.0 -0.6 -0.5817 -0.9072 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N01 compound treatment 182505.3763 -412000.0 -1.9 215720.7207 -375000.0 -1.99 -2.7495 -0.9997 PhilEx2_000595 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N02 compound treatment 642332.0755 48200.0 0.22 613229.0076 22300.0 0.12 0.2408 0.9564 PhilEx2_000596 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N03 compound treatment 379333.3333 -215000.0 -0.99 567893.2039 -23000.0 -0.12 -0.7868 -0.7883 PhilEx2_000597 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N04 compound treatment 601937.2694 7810.0 0.04 569985.8156 -20900.0 -0.11 -0.0531 -0.4544 PhilEx2_000598 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N05 compound treatment 631555.9701 37400.0 0.17 651761.0619 60800.0 0.32 0.3502 0.957 PhilEx2_000599 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N06 compound treatment 818222.2222 224000.0 1.03 644339.6947 53400.0 0.28 0.9311 0.8689 PhilEx2_000600 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N07 compound treatment 576657.8947 -17500.0 -0.08 547404.4944 -43500.0 -0.23 -0.2202 -0.9006 PhilEx2_000601 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N08 compound treatment 593704.7244 -421.0 0.0 626528.0 35600.0 0.19 0.1322 0.6998 PhilEx2_000602 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N09 compound treatment 718553.5055 124000.0 0.57 668588.7446 77700.0 0.41 0.697 0.9868 PhilEx2_000603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N10 compound treatment 331283.5821 -263000.0 -1.21 366452.2613 -224000.0 -1.19 -1.699 -1.0 PhilEx2_000604 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N11 compound treatment 522996.3768 -71100.0 -0.33 517100.7194 -73800.0 -0.39 -0.5088 -0.9961 PhilEx2_000605 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N12 compound treatment 430205.7143 -164000.0 -0.76 385301.2048 -206000.0 -1.09 -1.3057 -0.984 PhilEx2_000606 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N13 compound treatment 629570.9459 35400.0 0.16 651133.8583 60200.0 0.32 0.3414 0.9516 PhilEx2_000607 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N14 compound treatment 632023.1023 37900.0 0.17 582800.0 -8130.0 -0.04 0.0931 0.5172 PhilEx2_000608 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N15 compound treatment 534528.481 -59600.0 -0.27 593780.1418 2850.0 0.02 -0.1836 -0.6672 PhilEx2_000609 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N16 compound treatment 563107.0111 -31000.0 -0.14 531781.3953 -59100.0 -0.31 -0.323 -0.9367 PhilEx2_000610 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N17 compound treatment 542329.1536 -51800.0 -0.24 492985.7143 -97900.0 -0.52 -0.5362 -0.9379 PhilEx2_000611 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N18 compound treatment 438309.8592 -156000.0 -0.72 535791.5309 -55100.0 -0.29 -0.7149 -0.9215 PhilEx2_000612 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N19 mock treatment 575393.3333 -18700.0 -0.09 503645.283 -87300.0 -0.46 -0.3884 -0.8248 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N20 mock treatment 519527.3973 -74600.0 -0.34 584619.0476 -6310.0 -0.03 -0.2669 -0.7722 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N21 mock treatment 947146.9194 353000.0 1.63 571389.7764 -19500.0 -0.1 1.0779 0.6608 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N22 mock treatment 506118.0812 -88000.0 -0.41 604343.0657 13400.0 0.07 -0.2367 -0.5744 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N23 mock treatment 959403.2634 365000.0 1.68 465325.1029 -126000.0 -0.67 0.7201 0.3975 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 N24 mock treatment 1075413.876 481000.0 2.22 497168.8312 -93800.0 -0.5 1.2178 0.5354 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O01 compound treatment 560047.619 -34100.0 -0.16 490441.8605 -100000.0 -0.53 -0.488 -0.8782 PhilEx2_000613 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O02 compound treatment 606954.8872 12800.0 0.06 587966.805 -2960.0 -0.02 0.0307 0.5021 PhilEx2_000614 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O03 compound treatment 505020.2429 -89100.0 -0.41 557045.614 -33900.0 -0.18 -0.4176 -0.9312 PhilEx2_000615 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O04 compound treatment 707033.195 113000.0 0.52 609040.4858 18100.0 0.1 0.4361 0.8237 PhilEx2_000616 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O05 compound treatment 513975.0 -80200.0 -0.37 542585.0622 -48300.0 -0.26 -0.4427 -0.984 PhilEx2_000617 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O06 compound treatment 541311.4035 -52800.0 -0.24 573610.3896 -17300.0 -0.09 -0.2372 -0.9111 PhilEx2_000618 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O07 compound treatment 417093.5961 -177000.0 -0.82 414416.2679 -177000.0 -0.94 -1.2393 -0.9977 PhilEx2_000619 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O08 compound treatment 522193.6937 -71900.0 -0.33 557973.9583 -33000.0 -0.17 -0.3582 -0.9552 PhilEx2_000620 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O09 compound treatment 575194.6309 -18900.0 -0.09 577869.863 -13100.0 -0.07 -0.1107 -0.9934 PhilEx2_000621 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O10 compound treatment 396532.2581 -198000.0 -0.91 455130.8901 -136000.0 -0.72 -1.1536 -0.9932 PhilEx2_000622 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O11 compound treatment 517592.8571 -76500.0 -0.35 445223.3677 -146000.0 -0.77 -0.796 -0.937 PhilEx2_000623 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O12 compound treatment 448267.2414 -146000.0 -0.67 510743.5897 -80200.0 -0.43 -0.7764 -0.9755 PhilEx2_000624 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O13 compound treatment 579501.8727 -14600.0 -0.07 528392.0 -62500.0 -0.33 -0.2822 -0.8338 PhilEx2_000625 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O14 compound treatment 391447.5138 -203000.0 -0.93 315726.1905 -275000.0 -1.46 -1.6931 -0.9768 PhilEx2_000626 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O15 compound treatment 494230.7692 -99900.0 -0.46 564707.8189 -26200.0 -0.14 -0.4241 -0.8813 PhilEx2_000627 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O16 compound treatment 346899.3711 -247000.0 -1.14 373652.1739 -217000.0 -1.15 -1.6211 -1.0 PhilEx2_000628 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O17 compound treatment 546116.7315 -48000.0 -0.22 499685.4839 -91200.0 -0.48 -0.4988 -0.9372 PhilEx2_000629 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O18 compound treatment 429116.3793 -165000.0 -0.76 379406.5421 -212000.0 -1.12 -1.3314 -0.9821 PhilEx2_000630 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O19 mock treatment 667685.259 73600.0 0.34 455459.0909 -135000.0 -0.72 -0.2682 -0.3375 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O20 mock treatment 489978.355 -104000.0 -0.48 478995.614 -112000.0 -0.59 -0.7594 -0.9945 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O21 mock treatment 982661.6915 389000.0 1.79 991272.7273 400000.0 2.12 2.7685 0.9964 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O22 mock treatment 1082480.488 488000.0 2.25 1048399.533 457000.0 2.43 3.3082 0.9993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O23 mock treatment 893145.6311 299000.0 1.38 900700.2457 310000.0 1.64 2.1369 0.9962 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 O24 mock treatment 898444.9649 304000.0 1.4 771348.2587 180000.0 0.96 1.669 0.9826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P01 compound treatment 44000.0 -550000.0 -2.54 44983.871 -546000.0 -2.9 -3.8415 -0.9978 PhilEx2_000631 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P02 compound treatment 50962.2642 -543000.0 -2.5 47111.1111 -544000.0 -2.88 -3.8108 -0.9975 PhilEx2_000632 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P03 compound treatment 48673.0769 -545000.0 -2.52 43553.5714 -547000.0 -2.9 -3.8316 -0.9974 PhilEx2_000633 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P04 compound treatment 329251.0823 -265000.0 -1.22 438756.0976 -152000.0 -0.81 -1.4344 -0.9798 PhilEx2_000634 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P05 compound treatment 520017.6056 -74100.0 -0.34 556788.6179 -34100.0 -0.18 -0.3697 -0.9559 PhilEx2_000635 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P06 compound treatment 606973.384 12800.0 0.06 505712.6866 -85200.0 -0.45 -0.2777 -0.6092 PhilEx2_000636 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P07 compound treatment 589406.639 -4720.0 -0.02 571362.9032 -19600.0 -0.1 -0.0888 -0.8372 PhilEx2_000637 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P08 compound treatment 452569.6721 -142000.0 -0.65 428359.8485 -163000.0 -0.86 -1.0713 -0.9906 PhilEx2_000638 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P09 compound treatment 566345.3815 -27800.0 -0.13 529112.0 -61800.0 -0.33 -0.3224 -0.916 PhilEx2_000639 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P10 compound treatment 39378.3784 -555000.0 -2.56 48491.2281 -542000.0 -2.88 -3.8434 -0.9983 PhilEx2_000640 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P11 compound treatment 613172.0 19000.0 0.09 585772.3881 -5150.0 -0.03 0.0428 0.465 PhilEx2_000641 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P12 compound treatment 199479.7297 -395000.0 -1.82 219273.9726 -372000.0 -1.97 -2.6808 -0.9992 PhilEx2_000642 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P13 compound treatment 640675.5725 46600.0 0.21 454554.386 -136000.0 -0.72 -0.3597 -0.4767 PhilEx2_000643 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P14 compound treatment 443944.2379 -150000.0 -0.69 545238.4615 -45700.0 -0.24 -0.6611 -0.901 PhilEx2_000644 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P15 compound treatment 447916.9675 -146000.0 -0.67 485328.5199 -106000.0 -0.56 -0.8728 -0.9957 PhilEx2_000645 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P16 compound treatment 491386.1004 -103000.0 -0.47 455895.3069 -135000.0 -0.72 -0.8415 -0.9799 PhilEx2_000646 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P17 compound treatment 443031.9489 -151000.0 -0.7 467149.5017 -124000.0 -0.66 -0.9569 -0.9996 PhilEx2_000647 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P18 compound treatment 413128.6765 -181000.0 -0.83 409590.604 -181000.0 -0.96 -1.2703 -0.9975 PhilEx2_000648 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P19 mock treatment 413050.0 -181000.0 -0.84 488167.2862 -103000.0 -0.55 -0.9759 -0.9786 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P20 mock treatment 467812.7341 -126000.0 -0.58 435473.4848 -155000.0 -0.82 -0.9949 -0.9855 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P21 mock treatment 900219.5122 306000.0 1.41 872776.7221 282000.0 1.49 2.0552 0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P22 mock treatment 843635.1039 250000.0 1.15 735891.6479 145000.0 0.77 1.3573 0.9808 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P23 mock treatment 823938.8646 230000.0 1.06 821500.0 231000.0 1.22 1.6142 0.9975 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1342 P24 mock treatment 718354.0052 124000.0 0.57 801863.6364 211000.0 1.12 1.1962 0.9517 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A01 compound treatment 504882.1293 -46600.0 -0.22 504527.1318 -33800.0 -0.18 -0.2787 -0.9959 2065275 ICCB5_000001 O=C(N[C@@H]1[C@@H](COC(=O)c2ccccc2)Nc3cc4OCOc4cc13)OCc5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A02 compound treatment 502175.6757 -49300.0 -0.23 574666.6667 36400.0 0.19 -0.0244 -0.0819 2065276 ICCB5_000002 COCCOCOc1ccc2N([C@@H](Cc2c1)C(O)C=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A03 compound treatment 521396.2264 -30100.0 -0.14 667733.0097 129000.0 0.69 0.3873 0.5529 2065277 ICCB5_000003 OC[C@@H]1[C@@H](NC(=O)OCc2ccccc2)c3cc4OCOc4cc3N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A04 compound treatment 561109.2896 9600.0 0.04 733981.4815 196000.0 1.04 0.7652 0.7366 2065278 ICCB5_000004 COCCOCOc1ccc2[C@H](NC(=O)[C@H](C)NC(=O)OCc3ccccc3)[C@@H](COC(=O)c4ccccc4)Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A05 compound treatment 626133.9713 74600.0 0.34 545700.9804 7410.0 0.04 0.2711 0.7828 2065279 ICCB5_000005 O=C(N[C@@H]1[C@@H](COC(=O)c2ccccc2)N(C(=O)OCC3c4ccccc4-c5ccccc35)c6cc7OCOc7cc16)OCc8ccccc8 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A06 compound treatment 498531.25 -53000.0 -0.24 685090.9091 147000.0 0.78 0.3778 0.463 2065280 ICCB5_000006 COCCOCOc1ccc2[C@H](NC(=O)OCC=C)[C@H](Oc2c1)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A07 compound treatment 609556.0538 58000.0 0.27 604514.4033 66200.0 0.35 0.4377 0.991 2065281 ICCB5_000007 ClC(Cl)(Cl)COC(=O)N1[C@H](COC(=O)c2ccccc2)[C@@H](NC(=O)OCc3ccccc3)c4cc5OCOc5cc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A08 compound treatment 506995.7082 -44500.0 -0.21 657401.8692 119000.0 0.63 0.3016 0.454 2065282 ICCB5_000008 CCOC(=O)[C@H]1Oc2cc(OCOCCOC)ccc2[C@@H]1NC(=O)[C@H](Cc3ccccc3)NC(=O)OCc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A09 compound treatment 647995.4545 96500.0 0.44 677683.1276 139000.0 0.74 0.8374 0.9705 2065283 ICCB5_000009 O=C(N[C@@H]1[C@H]2C=CC(=O)N2c3cc4OCOc4cc13)OCc5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A10 compound treatment 550595.8333 -915.0 0.0 480928.2297 -57400.0 -0.3 -0.2181 -0.7169 2065284 ICCB5_000010 COCCOCOc1ccc2[C@H](N)[C@H](Oc2c1)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A11 compound treatment 536213.9303 -15300.0 -0.07 532937.0079 -5350.0 -0.03 -0.07 -0.9199 2065285 ICCB5_000011 COCCOCOc1ccc2N[C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)OCc4ccccc4)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A12 compound treatment 567480.7692 16000.0 0.07 726255.2301 188000.0 1.0 0.757 0.7573 2065286 ICCB5_000012 COCCOCOc1ccc2[C@H](NC(=O)OCC=C)[C@H](Oc2c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A13 compound treatment 634443.9024 82900.0 0.38 670465.3465 132000.0 0.7 0.7662 0.9594 2065287 ICCB5_000013 COCCOCOc1ccc2N([C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)OCc4ccccc4)c2c1)C(=O)OCC(Cl)(Cl)Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A14 compound treatment 623970.5882 72500.0 0.33 572663.9004 34400.0 0.18 0.3652 0.9594 2065288 ICCB5_000014 CCOC(=O)[C@H]1Oc2cc(OCOCCOC)ccc2[C@@H]1N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A15 compound treatment 572883.1169 21400.0 0.1 485744.9393 -52500.0 -0.28 -0.1274 -0.4309 2065289 ICCB5_000015 COCCOCOc1ccc2N([C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)OCC=C)c2c1)C(=O)OCC(Cl)(Cl)Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A16 compound treatment 598366.1417 46900.0 0.22 524507.7519 -13800.0 -0.07 0.1011 0.4432 2065290 ICCB5_000016 CCOC(=O)[C@H]1Oc2cc(OCOCCOC)ccc2[C@@H]1NCc3ccc(Br)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A17 compound treatment 637277.5665 85800.0 0.4 664443.4389 126000.0 0.67 0.7528 0.9685 2065291 ICCB5_000017 COCCOCOc1ccc2N([C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)OCc4ccccc4)c2c1)C(=O)OC(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A18 compound treatment 630606.6946 79100.0 0.36 731548.5437 193000.0 1.03 0.9827 0.9032 2065292 ICCB5_000018 CCOC(=O)[C@H]1Oc2cc(OCOCCOC)ccc2[C@@H]1N(Cc3ccc(Br)cc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A19 compound treatment 445237.2881 -106000.0 -0.49 518495.5357 -19800.0 -0.1 -0.4208 -0.8395 2065293 ICCB5_000019 COCCOCOc1ccc2N([C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)OCc4ccccc4)c2c1)C(=O)OCC[Si](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A20 compound treatment 557520.7547 6010.0 0.03 628995.7806 90700.0 0.48 0.3598 0.7466 2065294 ICCB5_000020 COCCOCOc1ccc2[C@@H]([C@@H](CO)Oc2c1)N(Cc3ccc(Br)cc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A21 compound treatment 436762.7737 -115000.0 -0.53 471365.4822 -66900.0 -0.35 -0.6252 -0.9811 2065295 ICCB5_000021 COCCOCOc1ccc2N([C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)OCC=C)c2c1)C(=O)OCC[Si](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A22 compound treatment 549200.0 -2310.0 -0.01 624251.0823 86000.0 0.46 0.3149 0.6904 2065296 ICCB5_000022 COCCOCOc1ccc2[C@@H]([C@H](Oc2c1)[C@@H](O)CC=C)N(Cc3ccc(Br)cc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A23 mock treatment 558350.9615 6840.0 0.03 499538.7931 -38700.0 -0.21 -0.123 -0.5917 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 A24 mock treatment 601541.6667 50000.0 0.23 651403.6697 113000.0 0.6 0.5874 0.9138 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B01 compound treatment 375813.7255 -176000.0 -0.81 56339.2857 -482000.0 -2.56 -2.3805 -0.8877 2065297 ICCB5_000023 CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B02 compound treatment 645584.7953 94100.0 0.43 684211.7647 146000.0 0.77 0.8541 0.9626 2065298 ICCB5_000024 CCOC(=O)[C@@H]1OC(C)(C)N([C@H]1c2cc(OCOCCOC)ccc2[N+](=O)[O-])C(=O)OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B03 compound treatment 615543.5685 64000.0 0.3 603442.5532 65200.0 0.35 0.4532 0.9969 2065299 ICCB5_000025 CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B04 compound treatment 547449.7817 -4060.0 -0.02 650964.4444 113000.0 0.6 0.4093 0.6846 2065300 ICCB5_000026 CCOC(=O)C[C@@H]1Nc2cc3OCOc3cc2[C@H]4[C@H]1OC(C)(C)N4C(=O)OCc5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B05 compound treatment 703814.6552 152000.0 0.7 624351.3514 86100.0 0.46 0.8194 0.9782 2065301 ICCB5_000027 CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B06 compound treatment 625908.2969 74400.0 0.34 742394.1909 204000.0 1.08 1.0081 0.8877 2065302 ICCB5_000028 CCOC(=O)[C@H]1Nc2ccc(OCOCCOC)cc2C[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B07 compound treatment 643745.4545 92200.0 0.43 714620.5534 176000.0 0.94 0.9621 0.9364 2065303 ICCB5_000029 CCCCCC/C=C\CCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B08 compound treatment 531145.3744 -20400.0 -0.09 568550.4202 30300.0 0.16 0.0471 0.2532 2065304 ICCB5_000030 COCCOCOc1ccc2N([C@H](CO[Si](C)(C)C(C)(C)C)[C@H](Cc2c1)OC(=O)OCC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B09 compound treatment 672704.5455 121000.0 0.56 501465.0206 -36800.0 -0.2 0.2571 0.4343 2065305 ICCB5_000031 CCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B10 compound treatment 396653.2258 -155000.0 -0.71 405717.1053 -133000.0 -0.7 -1.0022 -1.0 2065306 ICCB5_000032 CC(C)(C)[Si](C)(C)OC[C@@H]1[C@H](Cc2cc(O)ccc2N1C(=O)OCC=C)OC(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B11 compound treatment 734289.2157 183000.0 0.84 660775.5906 122000.0 0.65 1.0554 0.9917 2065307 ICCB5_000033 CCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B12 compound treatment 646903.8462 95400.0 0.44 768838.565 231000.0 1.22 1.1757 0.9047 2065308 ICCB5_000034 COCCOCOc1ccc2N([C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)Cc2c1)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B13 compound treatment 777895.6522 226000.0 1.04 644309.1787 106000.0 0.56 1.1359 0.9579 2065309 ICCB5_000035 CCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B14 compound treatment 714991.8699 163000.0 0.75 727706.5637 189000.0 1.0 1.2435 0.99 2065310 ICCB5_000036 CC(C)(C)[Si](C)(C)OC[C@@H]1[C@@H]2Cc3cc(O)ccc3N1C(=O)/C=C\CCC(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B15 compound treatment 624947.3684 73400.0 0.34 720768.0 182000.0 0.97 0.9239 0.901 2065311 ICCB5_000037 CCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B16 compound treatment 798831.1688 247000.0 1.14 717940.7115 180000.0 0.95 1.4803 0.996 2065312 ICCB5_000038 CC(C)(C)[Si](C)(C)OC[C@@H]1[C@@H]2Cc3cc4OCOc4cc3N1C(=O)/C=C\CCC(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B17 compound treatment 651035.2423 99500.0 0.46 654421.9409 116000.0 0.62 0.7601 0.9895 2065313 ICCB5_000039 CCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B18 compound treatment 643239.3822 91700.0 0.42 644556.962 106000.0 0.56 0.6977 0.99 2065314 ICCB5_000040 OC[C@@H]1[C@@H]2Cc3cc4OCOc4cc3N1C(=O)/C=C\CCC(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B19 compound treatment 606382.6087 54900.0 0.25 611540.146 73300.0 0.39 0.4537 0.9784 2065315 ICCB5_000041 CCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B20 compound treatment 601573.1707 50100.0 0.23 777255.9055 239000.0 1.27 1.0595 0.8224 2065316 ICCB5_000042 CC(C)(C)C(=O)OC[C@@H]1[C@@H]2Cc3cc4OCOc4cc3N1C(=O)/C=C\CCC(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B21 compound treatment 618769.4915 67300.0 0.31 585252.0661 47000.0 0.25 0.3955 0.9941 2065317 ICCB5_000043 CCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B22 compound treatment 511821.4286 -39700.0 -0.18 572740.7407 34500.0 0.18 -2.0E-4 -8.0E-4 2065318 ICCB5_000044 C[Si](C)(CBr)OC[C@@H]1[C@@H]2Cc3cc4OCOc4cc3N1C(=O)/C=C\CCC(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B23 mock treatment 542139.3443 -9370.0 -0.04 564933.8843 26600.0 0.14 0.0694 0.4694 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 B24 mock treatment 552788.0 1280.0 0.01 563330.4721 25000.0 0.13 0.0981 0.7377 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C01 compound treatment 514679.803 -36800.0 -0.17 637240.7407 99000.0 0.52 0.251 0.455 2065319 ICCB5_000045 COCCOCOc1ccc2N([C@H](CO)[C@@H](NC(=O)OCC=C)c2c1)C(=O)OCC[Si](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C02 compound treatment 653904.7619 102000.0 0.47 627354.8387 89100.0 0.47 0.6679 1.0 2065320 ICCB5_000046 COCCOCOc1ccc2[C@@H]([C@H](Oc2c1)[C@H](O)CC=C)N(Cc3ccc(Br)cc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C03 compound treatment 690360.8696 139000.0 0.64 722451.2821 184000.0 0.98 1.1435 0.979 2065321 ICCB5_000047 CCOC(=O)/C=C/[C@@H]1[C@@H](NC(=O)OCC=C)c2cc(OCOCCOC)ccc2N1C(=O)OCC[Si](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C04 compound treatment 617148.3254 65600.0 0.3 738709.4017 200000.0 1.06 0.9657 0.8737 2065322 ICCB5_000048 COCCOCOc1ccc2[C@H]3[C@H](Oc2c1)[C@@H](CC=CC(=O)N3Cc4ccc(Br)cc4)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C05 compound treatment 707750.0 156000.0 0.72 644892.7039 107000.0 0.57 0.9093 0.9928 2065323 ICCB5_000049 CCOC(=O)/C=C/[C@H]1Nc2ccc(OCOCCOC)cc2[C@@H]1NC(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C06 compound treatment 540161.5721 -11300.0 -0.05 681709.3596 143000.0 0.76 0.5009 0.6569 2065324 ICCB5_000050 COCCOCOc1ccc2[C@H]3[C@H](Oc2c1)[C@H](CC=CC(=O)N3Cc4ccc(Br)cc4)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C07 compound treatment 665637.4502 114000.0 0.53 654123.506 116000.0 0.61 0.8066 0.997 2065325 ICCB5_000051 CCOC(=O)C[C@@H]1N[C@@H](C)C(=O)N2[C@H]1[C@@H](NC(=O)OCC=C)c3cc(OCOCCOC)ccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C08 compound treatment 614934.5794 63400.0 0.29 569654.8673 31400.0 0.17 0.3245 0.9642 2065326 ICCB5_000052 CCOC(=O)[C@H]1Oc2cc(OCOCCOC)ccc2C[C@@H]1O[Si](CC)(CC)CC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C09 compound treatment 547574.2574 -3940.0 -0.02 667560.0 129000.0 0.69 0.472 0.6881 2065327 ICCB5_000053 CCOC(=O)/C=C/[C@@H]1[C@@H](NC(=O)OCC=C)c2cc(OCOCCOC)ccc2N1C(=O)OCC3c4ccccc4-c5ccccc35 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C10 compound treatment 591231.7073 39700.0 0.18 741539.4191 203000.0 1.08 0.8918 0.8156 2065328 ICCB5_000054 COCCOCOc1ccc2C[C@H](O)[C@@H](CO)Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C11 compound treatment 476837.9447 -74700.0 -0.34 544796.0 6510.0 0.03 -0.2191 -0.6331 2065329 ICCB5_000055 CCOC(=O)/C=C/[C@@H]1[C@@H](NC(=O)OCC=C)c2cc(O)ccc2N1C(=O)OCC3c4ccccc4-c5ccccc35 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C12 compound treatment 642264.574 90800.0 0.42 720865.6716 183000.0 0.97 0.9807 0.9296 2065330 ICCB5_000056 COCCOCOc1ccc2C[C@H](OC(=O)[C@H](Cc3ccccc3)NS(=O)(=O)c4ccccc4[N+](=O)[O-])[C@@H](CO[Si](C)(C)C(C)(C)C)Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C13 compound treatment 653157.2581 102000.0 0.47 616497.3822 78200.0 0.41 0.6248 0.9981 2065331 ICCB5_000057 COCCOCOc1ccc2N([C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)CCC=C)c2c1)C(=O)CCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C14 compound treatment 679819.9052 128000.0 0.59 605140.625 66900.0 0.35 0.6691 0.97 2065332 ICCB5_000058 CCOC(=O)[C@H](Cc1ccccc1)NC[C@H]2Oc3cc(OCOCCOC)ccc3C[C@@H]2O[Si](CC)(CC)CC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C15 compound treatment 568965.5172 17500.0 0.08 616560.3865 78300.0 0.42 0.3505 0.8288 2065333 ICCB5_000059 Oc1ccc2N([C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)CCC=C)c2c1)C(=O)CCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C16 compound treatment 652676.1905 101000.0 0.47 588634.2857 50300.0 0.27 0.5187 0.965 2065334 ICCB5_000060 CCOC(=O)[C@H](Cc1ccccc1)N(C[C@H]2Oc3cc(OCOCCOC)ccc3C[C@@H]2O[Si](CC)(CC)CC)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C17 compound treatment 615128.0992 63600.0 0.29 578779.3427 40500.0 0.21 0.3593 0.9882 2065335 ICCB5_000061 COCCOCOc1ccc2N3[C@H](COC(=O)c4ccccc4)[C@@H](NC(=O)CC/C=C/CCC3=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C18 compound treatment 621442.0601 69900.0 0.32 674593.75 136000.0 0.72 0.7393 0.9338 2065336 ICCB5_000062 CCOC(=O)[C@H]1Oc2cc(O)ccc2C[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C19 compound treatment 673304.1825 122000.0 0.56 655952.0 118000.0 0.62 0.8385 0.9986 2065337 ICCB5_000063 CCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C20 compound treatment 516405.0633 -35100.0 -0.16 541586.2069 3300.0 0.02 -0.1021 -0.6271 2065338 ICCB5_000064 CCOC(=O)[C@H]1Oc2cc(OCc3ccccc3)ccc2C[C@@H]1O[Si](CC)(CC)CC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C21 compound treatment 564987.9518 13500.0 0.06 495938.0531 -42300.0 -0.22 -0.1149 -0.4929 2065339 ICCB5_000065 CCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C22 compound treatment 522560.8856 -29000.0 -0.13 479422.5352 -58900.0 -0.31 -0.3152 -0.9282 2065340 ICCB5_000066 O=Cc1ccc(OCc2ccccc2)cc1OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C23 mock treatment 513332.0463 -38200.0 -0.18 570040.0 31800.0 0.17 -0.0054 -0.0222 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 C24 mock treatment 553895.1965 2380.0 0.01 503990.6542 -34300.0 -0.18 -0.1209 -0.6632 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D01 compound treatment 730795.2381 179000.0 0.83 669313.5135 131000.0 0.69 1.076 0.9963 2065341 ICCB5_000067 CCCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D02 compound treatment 722500.0 171000.0 0.79 483123.0769 -55200.0 -0.29 0.3507 0.4169 2065342 ICCB5_000068 CC(C)(C)[Si](C)(C)OC[C@@H]1[C@@H]2Cc3cc4OCOc4cc3N1C(=O)OC/C=C/CCC(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D03 compound treatment 657711.2069 106000.0 0.49 628304.7619 90000.0 0.48 0.6839 0.9999 2065343 ICCB5_000069 CCCCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D04 compound treatment 645807.6923 94300.0 0.43 744360.5948 206000.0 1.09 1.0804 0.9184 2065344 ICCB5_000070 CCOC(=O)[C@@H](O)[C@@H](NC(=O)OCc1ccccc1)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D05 compound treatment 639794.9791 88300.0 0.41 620445.3782 82200.0 0.44 0.596 0.9994 2065345 ICCB5_000071 CCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D06 compound treatment 496694.7791 -54800.0 -0.25 615333.3333 77000.0 0.41 0.1102 0.2293 2065346 ICCB5_000072 CCOC(=O)[C@@H]1OC(C)(C)N([C@H]1c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])C(=O)OCc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D07 compound treatment 563455.814 11900.0 0.06 606494.4444 68200.0 0.36 0.2948 0.8055 2065347 ICCB5_000073 CCCCCCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D08 compound treatment 455690.1961 -95800.0 -0.44 739240.0 201000.0 1.07 0.4412 0.3824 2065348 ICCB5_000074 CCOC(=O)C[C@@H]1Nc2cc3OCOc3cc2[C@@H]4OC(C)(C)O[C@H]41 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D09 compound treatment 674537.037 123000.0 0.57 598727.8107 60400.0 0.32 0.6279 0.9635 2065349 ICCB5_000075 CCCCCCCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D10 compound treatment 616363.9847 64900.0 0.3 592871.1111 54600.0 0.29 0.4162 0.9999 2065350 ICCB5_000076 CCOC(=O)C[C@H]1[C@@H]2OC(C)(C)O[C@H]2c3cc4OCOc4cc3N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D11 compound treatment 713075.1174 162000.0 0.75 545021.164 6730.0 0.04 0.5521 0.7401 2065351 ICCB5_000077 CCCCCCCCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D12 compound treatment 727929.2035 176000.0 0.81 553838.8278 15600.0 0.08 0.6336 0.7748 2065352 ICCB5_000078 CCOC(=O)C[C@H]1[C@H](O)[C@@H](O)c2cc3OCOc3cc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D13 compound treatment 565101.2658 13600.0 0.06 620888.4298 82600.0 0.44 0.3541 0.8001 2065353 ICCB5_000079 CCCCCCCCCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D14 compound treatment 619359.8485 67800.0 0.31 682138.1215 144000.0 0.76 0.7608 0.9225 2065354 ICCB5_000080 CCOC(=O)/C=C\[C@@H]1OC(C)(C)O[C@H]1c2cc3OCOc3cc2NCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D15 compound treatment 471371.3235 -80100.0 -0.37 508470.5882 -29800.0 -0.16 -0.3732 -0.9283 2065355 ICCB5_000081 CCCCCCCCCCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D16 compound treatment 559950.7389 8440.0 0.04 537128.7129 -1160.0 -0.01 0.0232 0.5881 2065356 ICCB5_000082 CC(C)(C)[Si](C)(C)O[C@H]([C@H]1OC(=O)C=C1)c2cc3OCOc3cc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D17 compound treatment 623575.0 72100.0 0.33 676177.2152 138000.0 0.73 0.7521 0.9363 2065357 ICCB5_000083 CCCCCCCCCCCCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D18 compound treatment 580312.7962 28800.0 0.13 587632.2314 49300.0 0.26 0.279 0.9506 2065358 ICCB5_000084 CCOC(=O)C[C@@H]1C[C@H]2[C@H](O)[C@@H](O1)c3cc4OCOc4cc3N2C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D19 compound treatment 563815.8996 12300.0 0.06 545905.2632 7620.0 0.04 0.0687 0.9861 2065359 ICCB5_000085 CCCCCC/C=C\CCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D20 compound treatment 528547.9452 -23000.0 -0.11 569074.6269 30800.0 0.16 0.0406 0.2085 2065360 ICCB5_000086 COC(=O)C[C@@H]1C[C@H]2[C@H](O)[C@@H](O1)c3cc4OCOc4cc3N2C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D21 compound treatment 565357.8595 13800.0 0.06 581551.5695 43300.0 0.23 0.2074 0.8708 2065361 ICCB5_000087 CCCC/C=C\CCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D22 compound treatment 480258.9928 -71300.0 -0.33 490113.8211 -48200.0 -0.26 -0.413 -0.9923 2065362 ICCB5_000088 CC1(C)O[C@@H]2[C@@H](O1)c3cc4OCOc4cc3N([C@H]2CCO)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D23 mock treatment 590679.3893 39200.0 0.18 557338.6454 19100.0 0.1 0.1992 0.9623 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 D24 mock treatment 588452.2968 36900.0 0.17 494599.1736 -43700.0 -0.23 -0.0434 -0.1509 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E01 compound treatment 506070.7547 -45400.0 -0.21 537480.4469 -808.0 0.0 -0.1512 -0.7214 2065363 ICCB5_000089 CCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E02 compound treatment 670603.7736 119000.0 0.55 563913.2948 25600.0 0.14 0.4845 0.8563 2065364 ICCB5_000090 O=CCc1ccc(OCc2ccccc2)cc1OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E03 compound treatment 477789.4737 -73700.0 -0.34 484956.044 -53300.0 -0.28 -0.4404 -0.9958 2065365 ICCB5_000091 CCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E04 compound treatment 664341.0138 113000.0 0.52 688837.8378 151000.0 0.8 0.9326 0.9785 2065366 ICCB5_000092 CCOC(=O)/C=C/Cc1ccc(OCc2ccccc2)cc1OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E05 compound treatment 664456.2212 113000.0 0.52 746942.3077 209000.0 1.11 1.1509 0.9409 2065367 ICCB5_000093 CCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E06 compound treatment 570525.1142 19000.0 0.09 611974.7475 73700.0 0.39 0.3384 0.8447 2065368 ICCB5_000094 CCOC(=O)[C@H](O)[C@@H](O)Cc1ccc(OCc2ccccc2)cc1OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E07 compound treatment 578787.0722 27300.0 0.13 672649.1228 134000.0 0.71 0.5929 0.8193 2065369 ICCB5_000095 CCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E08 compound treatment 604126.4822 52600.0 0.24 560072.7969 21800.0 0.12 0.2533 0.9424 2065370 ICCB5_000096 CCOC(=O)[C@H](OS(=O)(=O)c1ccc(C)cc1)[C@@H](O)Cc2ccc(OCc3ccccc3)cc2OCc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E09 compound treatment 612690.3766 61200.0 0.28 651438.5965 113000.0 0.6 0.6239 0.9408 2065371 ICCB5_000097 CCOC(=O)[C@H](O)[C@@H](NC(=O)OCc1ccccc1)c2cc(OCOCCOC)ccc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E10 compound treatment 697444.9541 146000.0 0.67 652339.6226 114000.0 0.6 0.9036 0.9986 2065372 ICCB5_000098 COCCOCOc1ccc(C=C)c(OCc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E11 compound treatment 614411.215 62900.0 0.29 583576.9231 45300.0 0.24 0.375 0.9956 2065373 ICCB5_000099 COCCOCOc1ccc([N+](=O)[O-])c(c1)[C@H](NC(=O)OCc2ccccc2)[C@@H](O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E12 compound treatment 741233.9623 190000.0 0.87 630516.0142 92200.0 0.49 0.9646 0.9623 2065374 ICCB5_000100 CCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E13 compound treatment 644119.403 92600.0 0.43 693079.646 155000.0 0.82 0.8825 0.9536 2065375 ICCB5_000101 COCCOCOc1ccc([N+](=O)[O-])c(c1)[C@H](NC(=O)OCc2ccccc2)[C@@H](O)COC(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E14 compound treatment 575107.5697 23600.0 0.11 646239.6694 108000.0 0.57 0.4818 0.8267 2065376 ICCB5_000102 COCCOCOc1ccc(CC=O)c(OCc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E15 compound treatment 500012.5 -51500.0 -0.24 660562.0438 122000.0 0.65 0.2907 0.4208 2065377 ICCB5_000103 COCCOCOc1ccc([N+](=O)[O-])c(c1)[C@H](NC(=O)OCc2ccccc2)[C@H](COC(=O)c3ccccc3)OS(=O)(=O)c4ccc(C)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E16 compound treatment 556148.5507 4640.0 0.02 573773.1092 35500.0 0.19 0.1482 0.7824 2065378 ICCB5_000104 CCOC(=O)/C=C/Cc1ccc(OCOCCOC)cc1OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E17 compound treatment 428197.8417 -123000.0 -0.57 620619.0476 82300.0 0.44 -0.0933 -0.1302 2065285 ICCB5_000105 COCCOCOc1ccc2N[C@H](COC(=O)c3ccccc3)[C@@H](NC(=O)OCc4ccccc4)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E18 compound treatment 611557.6923 60000.0 0.28 670497.8903 132000.0 0.7 0.6917 0.9174 2065379 ICCB5_000106 CCOC(=O)[C@H](O)[C@@H](O)Cc1ccc(OCOCCOC)cc1OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E19 compound treatment 659741.784 108000.0 0.5 663995.3704 126000.0 0.67 0.8244 0.9898 2065380 ICCB5_000107 CCOC(=O)/C=C/c1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E20 compound treatment 488406.639 -63100.0 -0.29 659081.1966 121000.0 0.64 0.2473 0.3514 2065381 ICCB5_000108 CCCCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E21 compound treatment 544698.5294 -6810.0 -0.03 521262.9108 -17000.0 -0.09 -0.0861 -0.9002 2065382 ICCB5_000109 CCOC(=O)[C@H](O)[C@@H](O)c1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E22 compound treatment 532269.2308 -19200.0 -0.09 554239.2344 16000.0 0.08 -0.0029 -0.0238 2065383 ICCB5_000110 CCOC(=O)[C@H]1Oc2cc(OCOCCOC)ccc2C[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E23 mock treatment 552181.8182 671.0 0.0 504132.5758 -34200.0 -0.18 -0.1259 -0.6949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 E24 mock treatment 481513.9442 -70000.0 -0.32 569528.3019 31200.0 0.17 -0.1111 -0.3062 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F01 compound treatment 607602.5641 56100.0 0.26 612098.3607 73800.0 0.39 0.4597 0.9798 2065384 ICCB5_000111 CCCCCC/C=C\CCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F02 compound treatment 580465.0 29000.0 0.13 674296.6507 136000.0 0.72 0.6045 0.824 2065385 ICCB5_000112 CC1(C)O[C@@H]2[C@@H](O1)c3cc(OCc4ccccc4)ccc3N[C@H]2CCO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F03 compound treatment 40607.1429 -511000.0 -2.36 41509.434 -497000.0 -2.63 -3.5292 -0.9984 2065386 ICCB5_000113 CCCCCCCC/C=C\CCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F04 compound treatment 621927.8846 70400.0 0.32 672907.6923 135000.0 0.71 0.7345 0.9364 2065387 ICCB5_000114 CCOC(=O)C[C@@H]1Nc2ccc(O)cc2[C@@H]3OC(C)(C)O[C@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F05 compound treatment 423280.5755 -128000.0 -0.59 298811.8812 -239000.0 -1.27 -1.3163 -0.9395 2065388 ICCB5_000115 CCCCCCCC/C=C\CCCCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F06 compound treatment 698922.0779 147000.0 0.68 679124.0 141000.0 0.75 1.0089 0.9989 2065389 ICCB5_000116 CCOC(=O)C[C@H]1[C@@H]2OC(C)(C)O[C@H]2c3cc(O)ccc3N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F07 compound treatment 591650.2058 40100.0 0.19 569533.3333 31200.0 0.17 0.2481 0.9985 2065390 ICCB5_000117 CCCCC/C=C\C/C=C\CCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F08 compound treatment 736629.6296 185000.0 0.85 678862.8319 141000.0 0.75 1.1309 0.9977 2065391 ICCB5_000118 CCOC(=O)C[C@@H]1Nc2ccc(OC(=O)OCC=C)cc2[C@@H]3OC(C)(C)O[C@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F09 compound treatment 687370.1923 136000.0 0.63 657155.2511 119000.0 0.63 0.8888 1.0 2065392 ICCB5_000119 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F10 compound treatment 600982.0359 49500.0 0.23 587102.1505 48800.0 0.26 0.3444 0.998 2065393 ICCB5_000120 CC1(C)O[C@@H]2[C@@H](O1)c3cc(OCc4ccccc4)ccc3N([C@H]2CCO)C(=O)OCc5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F11 compound treatment 584409.6386 32900.0 0.15 565250.9225 27000.0 0.14 0.2084 0.9996 2065394 ICCB5_000121 CCCCCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F12 compound treatment 590682.6923 39200.0 0.18 518314.6067 -20000.0 -0.11 0.0528 0.2522 2065395 ICCB5_000122 CC1(C)O[C@@H]2[C@@H](O1)c3cc(OCc4ccccc4)ccc3N([C@H]2CCOC(=O)OCc5ccccc5)C(=O)OCc6ccccc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F13 compound treatment 677371.308 126000.0 0.58 575725.7384 37400.0 0.2 0.5508 0.8979 2065396 ICCB5_000123 CCCCCCCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F14 compound treatment 591334.8837 39800.0 0.18 629073.8916 90800.0 0.48 0.4704 0.9127 2065397 ICCB5_000124 CC1(C)O[C@@H]2[C@@H](O1)c3cc(O)ccc3N[C@H]2CCOC(=O)OCc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F15 compound treatment 710492.4812 159000.0 0.73 689986.9565 152000.0 0.8 1.0874 0.9989 2065398 ICCB5_000125 CCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F16 compound treatment 656410.2564 105000.0 0.48 614487.0849 76200.0 0.4 0.6279 0.996 2065399 ICCB5_000126 CC1(C)O[C@@H]2[C@@H](O1)c3cc(O)ccc3N([C@H]2CCOC(=O)OCc4ccccc4)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F17 compound treatment 726220.5882 175000.0 0.81 584139.4422 45900.0 0.24 0.7417 0.8813 2065400 ICCB5_000127 CCCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F18 compound treatment 628156.7797 76600.0 0.35 596714.2857 58400.0 0.31 0.4691 0.9979 2065401 ICCB5_000128 CCOC(=O)/C=C/C[C@H]1[C@@H]2OC(C)(C)O[C@H]2c3cc(O)ccc3N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F19 compound treatment 632189.3204 80700.0 0.37 594618.8811 56300.0 0.3 0.4744 0.9941 2065402 ICCB5_000129 CCCCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F20 compound treatment 566418.9189 14900.0 0.07 684924.6032 147000.0 0.78 0.5986 0.7666 2065403 ICCB5_000130 CCOC(=O)C[C@@H]1C[C@H]2[C@H](O)[C@@H](O1)c3cc(O)ccc3N2C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F21 compound treatment 619899.1935 68400.0 0.32 676040.4858 138000.0 0.73 0.7396 0.9294 2065404 ICCB5_000131 CCCCCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F22 compound treatment 527703.0568 -23800.0 -0.11 608215.7534 69900.0 0.37 0.1846 0.4773 2065405 ICCB5_000132 CCOC(=O)/C=C/C[C@H]1[C@H](O)[C@@H](O)c2cc(O)ccc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F23 mock treatment 447957.8544 -104000.0 -0.48 514770.9924 -23500.0 -0.12 -0.4259 -0.8629 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 F24 mock treatment 451181.3725 -100000.0 -0.46 558742.8571 20500.0 0.11 -0.2505 -0.527 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G01 compound treatment 484800.0 -66700.0 -0.31 524435.7798 -13900.0 -0.07 -0.2695 -0.852 2065406 ICCB5_000133 CCOC(=O)[C@@H](O)[C@H](O)c1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G02 compound treatment 117627.451 -434000.0 -2.0 106914.8936 -431000.0 -2.29 -3.0327 -0.9978 2065407 ICCB5_000134 CN1C(=O)C2C(C3N(Cc4ccccc4I)C2C=CC3=O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G03 compound treatment 580583.3333 29100.0 0.13 568682.4034 30400.0 0.16 0.2088 0.9958 2065408 ICCB5_000135 CCOC(=O)[C@H](O)[C@@H](O)c1cc2OCOc2cc1NC(=O)OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G04 compound treatment 533487.7049 -18000.0 -0.08 591578.9474 53300.0 0.28 0.1411 0.4789 2065409 ICCB5_000136 COc1cccc(C=C)c1OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G05 compound treatment 671246.0733 120000.0 0.55 538884.1202 596.0 0.0 0.3927 0.7111 2065410 ICCB5_000137 CCOC(=O)[C@H](OS(=O)(=O)c1ccc(C)cc1)[C@@H](O)c2cc3OCOc3cc2NC(=O)OCc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G06 compound treatment 511802.2814 -39700.0 -0.18 534388.2979 -3900.0 -0.02 -0.1441 -0.782 2065411 ICCB5_000138 COc1cccc(CCO)c1OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G07 compound treatment 715140.4255 164000.0 0.75 655549.0196 117000.0 0.62 0.9734 0.9954 2065412 ICCB5_000139 CCOC(=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)c1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G08 compound treatment 518142.0765 -33400.0 -0.15 522365.9574 -15900.0 -0.08 -0.1685 -0.9601 2065413 ICCB5_000140 COc1cccc(CC=O)c1OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G09 compound treatment 537771.2766 -13700.0 -0.06 611723.1405 73400.0 0.39 0.2306 0.5844 2065414 ICCB5_000141 CCOC(=O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)c1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G10 compound treatment 549219.6262 -2290.0 -0.01 517383.1776 -20900.0 -0.11 -0.0859 -0.771 2065415 ICCB5_000142 CCOC(=O)/C=C/Cc1cccc(OC)c1OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G11 compound treatment 612852.0179 61300.0 0.28 480168.2243 -58100.0 -0.31 -0.018 -0.0429 2065416 ICCB5_000143 CC(C)(C)[Si](C)(C)OC[C@H](O)[C@@H](O)c1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G12 compound treatment 573366.4122 21900.0 0.1 600491.3793 62200.0 0.33 0.3046 0.8828 2065417 ICCB5_000144 CCOC(=O)[C@H](O)[C@@H](O)Cc1cccc(OC)c1OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G13 compound treatment 558097.561 6590.0 0.03 554181.8182 15900.0 0.08 0.0811 0.9049 2065418 ICCB5_000145 CC(C)(C)[Si](C)(C)OC[C@@H]1OC(C)(C)O[C@H]1c2cc3OCOc3cc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G14 compound treatment 585657.1429 34100.0 0.16 524612.6126 -13700.0 -0.07 0.0601 0.3464 2065419 ICCB5_000146 CC[Si](CC)(CC)O[C@H]1Cc2ccc(OCc3ccccc3)cc2O[C@@H]1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G15 compound treatment 490567.3077 -60900.0 -0.28 466294.3396 -72000.0 -0.38 -0.4687 -0.9886 2065420 ICCB5_000147 CCOC(=O)[C@@H]1OC(C)(C)O[C@H]1c2cc3OCOc3cc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G16 compound treatment 538195.5556 -13300.0 -0.06 571568.1818 33300.0 0.18 0.0814 0.4355 2065421 ICCB5_000148 CC[Si](CC)(CC)O[C@H]1Cc2ccc(OCc3ccccc3)cc2O[C@@H]1C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G17 compound treatment 506042.8016 -45500.0 -0.21 493725.7384 -44600.0 -0.24 -0.3154 -0.9982 2065422 ICCB5_000149 OCCCc1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G18 compound treatment 573315.4122 21800.0 0.1 534253.9683 -4030.0 -0.02 0.056 0.5445 2065423 ICCB5_000150 CC[Si](CC)(CC)O[C@H]1Cc2ccc(OCc3ccccc3)cc2O[C@@H]1C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G19 compound treatment 503766.5198 -47700.0 -0.22 445365.3846 -92900.0 -0.49 -0.5042 -0.934 2065424 ICCB5_000151 OC/C=C/c1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G20 compound treatment 589986.0465 38500.0 0.18 464161.1111 -74100.0 -0.39 -0.1525 -0.3537 2065425 ICCB5_000152 C(Oc1ccc2C[C@@H]3OCC=C[C@H]3Oc2c1)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G21 compound treatment 454388.0 -97100.0 -0.45 542994.9239 4710.0 0.02 -0.2991 -0.6667 2065426 ICCB5_000153 [O-][N+](=O)c1cc2OCOc2cc1CC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G22 compound treatment 472700.4049 -78800.0 -0.36 488480.6867 -49800.0 -0.26 -0.4438 -0.9877 2065427 ICCB5_000154 C(Oc1ccc2C[C@@H]3OCCCC=C[C@H]3Oc2c1)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G23 mock treatment 513870.6897 -37600.0 -0.17 491734.2995 -46600.0 -0.25 -0.2973 -0.9851 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 G24 mock treatment 484248.0 -67300.0 -0.31 486213.9535 -52100.0 -0.28 -0.4146 -0.9983 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H01 compound treatment 672435.2332 121000.0 0.56 644115.3846 106000.0 0.56 0.7912 1.0 2065428 ICCB5_000155 CCCCCCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H02 compound treatment 587922.3744 36400.0 0.17 536060.1504 -2230.0 -0.01 0.1104 0.6557 2065429 ICCB5_000156 CC1(C)O[C@@H]2[C@@H](O1)c3cc4OCOc4cc3N([C@H]2CC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H03 compound treatment 639737.8049 88200.0 0.41 568148.1481 29900.0 0.16 0.3997 0.9154 2065430 ICCB5_000157 CCCCCCCCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H04 compound treatment 582375.5459 30900.0 0.14 613706.6667 75400.0 0.4 0.3835 0.9032 2065431 ICCB5_000158 CC1(C)O[C@@H]2[C@@H](O1)c3cc4OCOc4cc3N([C@H]2CC=C)C(=O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H05 compound treatment 565849.1379 14300.0 0.07 28826.6667 -509000.0 -2.7 -1.864 -0.6896 2065432 ICCB5_000159 CCCCCCCCCCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H06 compound treatment 536924.3243 -14600.0 -0.07 572632.9787 34300.0 0.18 0.0812 0.4184 2065433 ICCB5_000160 CC1(C)O[C@@H]2[C@@H](O1)c3cc(OCc4ccccc4)ccc3N([C@H]2CCOC(=O)OCC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H07 compound treatment 807123.8938 256000.0 1.18 696972.332 159000.0 0.84 1.4287 0.9864 2065434 ICCB5_000161 CCCCCCCC/C=C\CCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H08 compound treatment 589477.1574 38000.0 0.18 520197.9695 -18100.0 -0.1 0.056 0.2803 2065435 ICCB5_000162 CC1(C)O[C@@H]2[C@@H](O1)c3cc(OCc4ccccc4)ccc3N([C@H]2CC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H09 compound treatment 337322.5806 -214000.0 -0.99 493211.8227 -45100.0 -0.24 -0.8675 -0.8536 2065436 ICCB5_000163 CCCCC/C=C\C/C=C\CCCCCCCC(=O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H10 compound treatment 546035.533 -5480.0 -0.03 576522.8216 38200.0 0.2 0.1255 0.6143 2065437 ICCB5_000164 CC1(C)O[C@@H]2[C@@H](O1)c3cc(OCc4ccccc4)ccc3N([C@H]2CCO)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H11 compound treatment 672031.6206 121000.0 0.56 600000.0 61700.0 0.33 0.6245 0.9681 2065438 ICCB5_000165 CCCC(=O)CC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H12 compound treatment 491965.6489 -59500.0 -0.27 525659.0909 -12600.0 -0.07 -0.2415 -0.8545 2065439 ICCB5_000166 CC1(C)O[C@@H]2[C@@H](O1)c3cc(O)ccc3N([C@H]2CC=O)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H13 compound treatment 568004.0486 16500.0 0.08 546642.8571 8350.0 0.04 0.0851 0.9669 2065440 ICCB5_000167 CCCCC(=O)CC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H14 compound treatment 514125.0 -37400.0 -0.17 514072.3982 -24200.0 -0.13 -0.2127 -0.9895 2065441 ICCB5_000168 CC1(C)O[C@@H]2[C@@H](O1)c3cc(O)ccc3N([C@H]2CCO)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H15 compound treatment 561785.7143 10300.0 0.05 577829.8755 39500.0 0.21 0.1818 0.8455 2065442 ICCB5_000169 CCCCCC(=O)CC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H16 compound treatment 490767.0251 -60700.0 -0.28 453148.4099 -85100.0 -0.45 -0.5174 -0.9736 2065443 ICCB5_000170 COCCOCOc1ccc2N([C@@H](CC(=O)O)[C@@H]3OC(C)(C)O[C@H]3c2c1)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H17 compound treatment 553625.9259 2110.0 0.01 542187.2659 3900.0 0.02 0.0215 0.9411 2065444 ICCB5_000171 CCCCCCC(=O)CC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H18 compound treatment 532185.654 -19300.0 -0.09 512222.6563 -26100.0 -0.14 -0.1608 -0.9774 2065445 ICCB5_000172 CCOC(=O)C[C@@H]1C[C@H]2[C@H](O)[C@@H](O1)c3cc(OCc4ccccc4)ccc3N2C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H19 compound treatment 472807.8431 -78700.0 -0.36 500000.0 -38300.0 -0.2 -0.4002 -0.9624 2065446 ICCB5_000173 CCCCCCCC(=O)CC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H20 compound treatment 607056.4516 55500.0 0.26 533018.018 -5270.0 -0.03 0.1614 0.6262 2065447 ICCB5_000174 CC1(C)O[C@@H]2[C@@H](O1)c3cc4OCOc4cc3N([C@H]2C[C@@H](O)CC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H21 compound treatment 479829.2683 -71700.0 -0.33 572218.1208 33900.0 0.18 -0.1065 -0.2829 2065448 ICCB5_000175 CCCCCCCCC(=O)CC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H22 compound treatment 482295.3586 -69200.0 -0.32 529443.8776 -8840.0 -0.05 -0.2589 -0.8024 2065449 ICCB5_000176 CC1(C)O[C@@H]2[C@@H](O1)c3cc4OCOc4cc3N[C@H]2C[C@@H](O)CC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H23 mock treatment 571487.8788 20000.0 0.09 502612.5461 -35700.0 -0.19 -0.0687 -0.3262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 H24 mock treatment 474078.8177 -77400.0 -0.36 431359.2593 -107000.0 -0.57 -0.6535 -0.9751 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I01 compound treatment 529668.2028 -21800.0 -0.1 556347.8261 18100.0 0.1 -0.0035 -0.0251 2065450 ICCB5_000177 OC[C@H](O)Cc1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I02 compound treatment 699056.0748 148000.0 0.68 526444.4444 -11800.0 -0.06 0.4367 0.6391 2065451 ICCB5_000178 Oc1ccc2C[C@H](OC(=O)c3ccccc3)[C@H](Oc2c1)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I03 compound treatment 609567.7083 58100.0 0.27 727960.9756 190000.0 1.01 0.9007 0.8652 2065452 ICCB5_000179 Nc1cc2OCOc2cc1C[C@@H](O)COC(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I04 compound treatment 535884.7926 -15600.0 -0.07 747696.8326 209000.0 1.11 0.7344 0.6598 2065453 ICCB5_000180 CCOC(=O)[C@H]1Oc2cc(OCOCCOC)ccc2[C@@H]1O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I05 compound treatment 594446.9027 42900.0 0.2 697807.0175 160000.0 0.85 0.7383 0.8496 2065454 ICCB5_000181 Cc1ccc(cc1)S(=O)(=O)O[C@@H](CO[Si](C)(C)C(C)(C)C)Cc2cc3OCOc3cc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I06 compound treatment 748116.6667 197000.0 0.91 850271.4932 312000.0 1.65 1.8112 0.9599 2065455 ICCB5_000182 CCOC(=O)[C@H]1Oc2cc(OCOCCOC)ccc2[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I07 compound treatment 656553.0973 105000.0 0.48 727162.2807 189000.0 1.0 1.0509 0.9444 2065456 ICCB5_000183 CC(C)(C)[Si](C)(C)OC[C@@H]1Cc2cc3OCOc3cc2N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I08 compound treatment 724494.6809 173000.0 0.8 612535.2697 74200.0 0.39 0.8425 0.9471 2065457 ICCB5_000184 COCCOCOc1ccc2[C@H](OCC=C)[C@@H](CO)Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I09 compound treatment 778972.6027 227000.0 1.05 803289.7196 265000.0 1.41 1.7356 0.9896 2065458 ICCB5_000185 O=C(OC[C@@H]1Cc2cc3OCOc3cc2N1)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I10 compound treatment 775173.1602 224000.0 1.03 673456.4315 135000.0 0.72 1.2363 0.9842 2065459 ICCB5_000186 COCCOCOc1ccc2[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO[Si](C)(C)C(C)(C)C)Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I11 compound treatment 569630.8244 18100.0 0.08 560648.0 22400.0 0.12 0.1429 0.9853 2065460 ICCB5_000187 OC[C@@H]1Cc2cc3OCOc3cc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I12 compound treatment 685145.2282 134000.0 0.62 717617.5115 179000.0 0.95 1.1083 0.9779 2065461 ICCB5_000188 CCOC(=O)[C@H](O)[C@@H](O)c1ccc(OCOCCOC)cc1OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I13 compound treatment 639621.9512 88100.0 0.41 604410.9589 66100.0 0.35 0.5353 0.9973 2065462 ICCB5_000189 C=CCOC(=O)N1[C@@H](Cc2cc3OCOc3cc12)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I14 compound treatment 732403.1414 181000.0 0.83 455807.3394 -82500.0 -0.44 0.2805 0.2978 2065463 ICCB5_000190 CCOC(=O)[C@H](OS(=O)(=O)c1ccc(C)cc1)[C@@H](O)c2ccc(OCOCCOC)cc2OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I15 compound treatment 498490.4459 -53000.0 -0.24 530452.0548 -7840.0 -0.04 -0.2023 -0.8156 2065464 ICCB5_000191 O[C@@H](CC=C)[C@@H]1Cc2cc3OCOc3cc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I16 compound treatment 530439.7163 -21100.0 -0.1 645276.0181 107000.0 0.57 0.3325 0.5776 2065465 ICCB5_000192 COCCOCOc1ccc2[C@H](O)[C@H](Oc2c1)C(CC=C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I17 compound treatment 751253.0612 200000.0 0.92 675282.0513 137000.0 0.73 1.1651 0.9931 2065466 ICCB5_000193 CC(C)(C)[Si](C)(C)O[C@@H](CC=C)[C@@H]1Cc2cc3OCOc3cc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I18 compound treatment 531911.7647 -19600.0 -0.09 551674.6575 13400.0 0.07 -0.0137 -0.1192 2065467 ICCB5_000194 COCCOCOc1ccc2[C@H](NC(=O)OCC=C)[C@@H](COC(=O)c3ccccc3)Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I19 compound treatment 739573.5294 188000.0 0.87 760410.4803 222000.0 1.18 1.4463 0.9886 2065468 ICCB5_000195 CC(C)(C)[Si](C)(C)O[C@H]1CC=CC(=O)N2[C@H]1Cc3cc4OCOc4cc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I20 compound treatment 587854.3689 36300.0 0.17 699986.6667 162000.0 0.86 0.725 0.8296 2065469 ICCB5_000196 CCOC(=O)[C@H]1Oc2cc(O)ccc2[C@@H]1NC(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I21 compound treatment 578711.3821 27200.0 0.13 584030.1724 45700.0 0.24 0.2603 0.9529 2065470 ICCB5_000197 CO/C=C/c1cc(O)ccc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I22 compound treatment 543948.9362 -7560.0 -0.03 525705.6452 -12600.0 -0.07 -0.0719 -0.9542 2065471 ICCB5_000198 COCCOCOc1ccc(C=O)c(OCOCCOC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I23 mock treatment 568289.5753 16800.0 0.08 598150.2347 59900.0 0.32 0.2792 0.8544 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 I24 mock treatment 561466.9604 9960.0 0.05 578910.7143 40600.0 0.22 0.1848 0.8389 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J01 compound treatment 1204089.286 653000.0 3.01 790552.2388 252000.0 1.34 3.0741 0.9334 2065472 ICCB5_000199 CCCCCCCCCCCCCC(=O)CC(=O)N[C@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J02 compound treatment 736004.4843 184000.0 0.85 621588.7446 83300.0 0.44 0.914 0.9534 2065473 ICCB5_000200 CC1(C)O[C@@H]2[C@@H](O1)c3cc(O)ccc3N([C@H]2CC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J03 compound treatment 641284.3602 89800.0 0.41 742279.4118 204000.0 1.08 1.0578 0.9131 2065474 ICCB5_000201 CC(O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J04 compound treatment 602326.7327 50800.0 0.23 605476.4706 67200.0 0.36 0.4177 0.9793 2065475 ICCB5_000202 CC1(C)O[C@@H]2[C@@H](O1)c3cc4OCOc4cc3N5[C@H]2C[C@H](CC5=O)Sc6ccccc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J05 compound treatment 796956.6929 245000.0 1.13 845715.5172 307000.0 1.63 1.9534 0.9841 2065476 ICCB5_000203 CCCCCCCC(O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J06 compound treatment 649823.2759 98300.0 0.45 776763.1579 238000.0 1.26 1.215 0.9042 2065477 ICCB5_000204 CC(=O)O[C@@H]1CC=CC(=O)N2[C@@H](C1)[C@@H]3OC(C)(C)O[C@H]3c4cc5OCOc5cc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J07 compound treatment 640450.7576 88900.0 0.41 692584.7458 154000.0 0.82 0.8687 0.949 2065478 ICCB5_000205 CCCCCCCCCC(O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J08 compound treatment 762350.8772 211000.0 0.97 571968.6411 33700.0 0.18 0.8138 0.8232 2065479 ICCB5_000206 CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)c2cc(OC3CCCCO3)ccc2NC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J09 compound treatment 750619.6078 199000.0 0.92 649148.4099 111000.0 0.59 1.0651 0.9768 2065480 ICCB5_000207 CCCCCCCCCCCC(O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J10 compound treatment 705750.0 154000.0 0.71 724064.6552 186000.0 0.99 1.1997 0.9872 2065481 ICCB5_000208 CC(=O)O[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)C(=O)Nc2ccc(O)cc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J11 compound treatment 623707.6923 72200.0 0.33 669663.1579 131000.0 0.7 0.7281 0.9429 2065482 ICCB5_000209 CCCCCCCCCCCCCC(O)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J12 compound treatment 652199.1525 101000.0 0.46 582761.9048 44500.0 0.24 0.4951 0.9507 2065483 ICCB5_000210 O[C@@H]1[C@@H](O)c2cc(OCc3ccccc3)ccc2N(C(=O)OCC=C)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J13 compound treatment 603912.4579 52400.0 0.24 783706.9767 245000.0 1.3 1.0913 0.8243 2065484 ICCB5_000211 CCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J14 compound treatment 514220.4724 -37300.0 -0.17 613518.6567 75200.0 0.4 0.1605 0.3695 2065485 ICCB5_000212 COCCOCOc1ccc2NC(=O)[C@H](OC(=O)OCC=C)[C@@H](NC(=O)OCC=C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J15 compound treatment 590979.9197 39500.0 0.18 585728.5714 47400.0 0.25 0.3066 0.9874 2065486 ICCB5_000213 CCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J16 compound treatment 469768.4211 -81700.0 -0.38 568520.5479 30200.0 0.16 -0.1532 -0.3739 2065487 ICCB5_000214 COCCOCOc1ccc2NC[C@H](O)[C@@H](NC(=O)OCC=C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J17 compound treatment 557358.8517 5850.0 0.03 608971.6312 70700.0 0.37 0.2842 0.756 2065488 ICCB5_000215 CCCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J18 compound treatment 473491.0394 -78000.0 -0.36 513231.0924 -25100.0 -0.13 -0.3484 -0.9083 2065489 ICCB5_000216 Oc1ccc2NC(=O)[C@H](OCc3ccccc3)[C@@H](NC(=O)OCC=C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J19 compound treatment 588612.4567 37100.0 0.17 587730.1587 49400.0 0.26 0.3064 0.9786 2065490 ICCB5_000217 CCCCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J20 compound treatment 580893.1298 29400.0 0.14 575720.4301 37400.0 0.2 0.2362 0.9827 2065491 ICCB5_000218 O[C@@H]1[C@@H](NC(=O)OCC=C)c2cc(O)ccc2NC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J21 compound treatment 457243.5065 -94300.0 -0.43 620470.5882 82200.0 0.44 8.0E-4 0.0013 2065492 ICCB5_000219 CCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J22 compound treatment 560088.4354 8580.0 0.04 680721.8045 142000.0 0.76 0.5622 0.7431 2065493 ICCB5_000220 COCCOCOc1ccc2N=C(OCc3ccccc3)[C@H](OCc4ccccc4)[C@@H](NC(=O)OCC=C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J23 mock treatment 559869.1275 8360.0 0.04 595971.0145 57700.0 0.31 0.2436 0.7899 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 J24 mock treatment 574089.4942 22600.0 0.1 550234.7418 11900.0 0.06 0.1184 0.9716 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K01 compound treatment 570447.1154 18900.0 0.09 498742.6901 -39500.0 -0.21 -0.0866 -0.381 2065494 ICCB5_000221 Oc1ccc([N+](=O)[O-])c(CC=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K02 compound treatment 648455.3571 96900.0 0.45 662712.3894 124000.0 0.66 0.7828 0.982 2065495 ICCB5_000222 COCCOCOc1ccc(C=O)c(O[Si](C)(C)C(C)(C)C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K03 compound treatment 647678.5714 96200.0 0.44 554670.0508 16400.0 0.09 0.375 0.8299 2065496 ICCB5_000223 Oc1ccc([N+](=O)[O-])c(CC=C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K04 compound treatment 612790.795 61300.0 0.28 598297.0297 60000.0 0.32 0.4249 0.9982 2065497 ICCB5_000224 CCOC(=O)N[C@@H]1[C@H](Oc2cc(OCOCCOC)ccc12)C(=O)OCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K05 compound treatment 545774.8918 -5740.0 -0.03 548303.7975 10000.0 0.05 0.0189 0.3178 2065498 ICCB5_000225 COCCOCOc1ccc([N+](=O)[O-])c(CC=C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K06 compound treatment 682986.6667 131000.0 0.61 678480.3493 140000.0 0.74 0.9545 0.9949 2065499 ICCB5_000226 CCOC(=O)N[C@H]([C@@H](OS(=O)(=O)c1ccc(C)cc1)C(=O)OCC)c2ccc(OCOCCOC)cc2OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K07 compound treatment 597489.7959 46000.0 0.21 712705.8824 174000.0 0.93 0.8041 0.8472 2065500 ICCB5_000227 COCCOCOc1ccc([N+](=O)[O-])c(C[C@@H](O)CO)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K08 compound treatment 794116.8831 243000.0 1.12 658229.8387 120000.0 0.64 1.241 0.9642 2065501 ICCB5_000228 CCOC(=O)[C@H](O)[C@@H](NC(=O)OCc1ccccc1)c2ccc(OCOCCOC)cc2O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K09 compound treatment 598099.6169 46600.0 0.21 657061.9835 119000.0 0.63 0.5974 0.8975 2065502 ICCB5_000229 COCCOCOc1ccc([N+](=O)[O-])c(C[C@@H](O)COC(=O)c2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K10 compound treatment 630828.3262 79300.0 0.37 684985.1301 147000.0 0.78 0.8088 0.9408 2065503 ICCB5_000230 CCOC(=O)/C=C/c1ccc(OCOCCOC)cc1O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K11 compound treatment 617162.6506 65700.0 0.3 640964.467 103000.0 0.54 0.5992 0.9616 2065504 ICCB5_000231 COCCOCOc1ccc([N+](=O)[O-])c(C[C@H](COC(=O)c2ccccc2)OS(=O)(=O)c3ccc(C)cc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K12 compound treatment 653042.1053 102000.0 0.47 726323.5294 188000.0 1.0 1.0363 0.9406 2065505 ICCB5_000232 COCCOCOc1ccc2[C@H](O[Si](C)(C)C(C)(C)C)[C@H](Oc2c1)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K13 compound treatment 610868.6441 59400.0 0.27 619689.0459 81400.0 0.43 0.4989 0.9758 2065506 ICCB5_000233 COCCOCOc1ccc2N[C@H](COC(=O)c3ccccc3)Cc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K14 compound treatment 463468.6347 -88000.0 -0.41 545852.0 7560.0 0.04 -0.2587 -0.6341 2065507 ICCB5_000234 COCCOCOc1ccc2[C@@H]([C@H](Oc2c1)C=C)N(Cc3ccc(Br)cc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K15 compound treatment 565535.545 14000.0 0.06 615300.0 77000.0 0.41 0.3346 0.809 2065508 ICCB5_000235 COCCOCOc1ccc2N([C@H](CO)Cc2c1)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K16 compound treatment 704031.6206 153000.0 0.7 711951.6729 174000.0 0.92 1.1487 0.9911 2065509 ICCB5_000236 COCCOCOc1ccc2[C@@H]([C@H](Oc2c1)C=O)N(Cc3ccc(Br)cc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K17 compound treatment 546650.7937 -4860.0 -0.02 662425.4545 124000.0 0.66 0.4497 0.6826 2065510 ICCB5_000237 COCCOCOc1ccc2N([C@@H](Cc2c1)C=O)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K18 compound treatment 636394.4223 84900.0 0.39 646892.7203 109000.0 0.58 0.6841 0.9823 2065511 ICCB5_000238 COCCOCOc1ccc2[C@H](NCc3ccc(Br)cc3)[C@@H](CO)Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K19 compound treatment 526565.371 -24900.0 -0.12 529076.9231 -9210.0 -0.05 -0.1159 -0.9272 2065512 ICCB5_000239 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@H](O)CC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K20 compound treatment 537312.9771 -14200.0 -0.07 559123.0159 20800.0 0.11 0.0318 0.2479 2065513 ICCB5_000240 COCCOCOc1ccc2[C@H](NCc3ccc(Br)cc3)[C@H](Oc2c1)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K21 compound treatment 630981.4126 79500.0 0.37 592143.4263 53900.0 0.29 0.4611 0.9924 2065514 ICCB5_000241 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@@H](O)CC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K22 compound treatment 501028.6885 -50500.0 -0.23 549122.6054 10800.0 0.06 -0.124 -0.517 2065515 ICCB5_000242 COCCOCOc1ccc2[C@@H]([C@H](Oc2c1)C=C)N(Cc3ccc(Br)cc3)C(=O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K23 mock treatment 575170.6161 23700.0 0.11 652302.2222 114000.0 0.6 0.5048 0.8214 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 K24 mock treatment 562066.0793 10600.0 0.05 533129.8701 -5160.0 -0.03 0.0151 0.2699 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L01 compound treatment 769888.8889 218000.0 1.01 623765.2174 85500.0 0.45 1.0327 0.9351 2065516 ICCB5_000243 CCCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L02 compound treatment 705529.6443 154000.0 0.71 620230.4348 81900.0 0.43 0.8096 0.9722 2065517 ICCB5_000244 CC(=O)O[C@H](CC=C)C[C@H]1[C@@H]2OC(C)(C)O[C@H]2c3cc(OCc4ccccc4)ccc3N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L03 compound treatment 736609.4421 185000.0 0.85 666888.8889 129000.0 0.68 1.0859 0.9938 2065518 ICCB5_000245 CCCCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L04 compound treatment 791298.5782 240000.0 1.11 779033.4728 241000.0 1.28 1.6848 0.9974 2065519 ICCB5_000246 CC(=O)O[C@@H](CC=C)C[C@H]1[C@@H]2OC(C)(C)O[C@H]2c3cc(OCc4ccccc4)ccc3N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L05 compound treatment 748612.782 197000.0 0.91 773531.3808 235000.0 1.25 1.525 0.9879 2065520 ICCB5_000247 CCCCCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L06 compound treatment 599719.5767 48200.0 0.22 664590.9091 126000.0 0.67 0.6309 0.8938 2065521 ICCB5_000248 CC(=O)O[C@@H](CC=C)C[C@H]1[C@@H]2OC(C)(C)O[C@H]2c3cc(OCc4ccccc4)ccc3N1C(=O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L07 compound treatment 686174.1071 135000.0 0.62 656434.4569 118000.0 0.63 0.8822 1.0 2065522 ICCB5_000249 CCCCCCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L08 compound treatment 657666.6667 106000.0 0.49 576291.8288 38000.0 0.2 0.4887 0.9231 2065523 ICCB5_000250 CC(=O)O[C@@H]1CC=CC(=O)N2[C@@H](C1)[C@@H]3OC(C)(C)O[C@H]3c4cc(OCc5ccccc5)ccc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L09 compound treatment 699635.3383 148000.0 0.68 715638.6555 177000.0 0.94 1.1482 0.9877 2065524 ICCB5_000251 CCCCCCCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L10 compound treatment 650836.5385 99300.0 0.46 556516.2602 18200.0 0.1 0.3923 0.8379 2065525 ICCB5_000252 CC(=O)O[C@H]1CC=CC(=O)N2[C@@H](C1)[C@@H]3OC(C)(C)O[C@H]3c4cc(OCc5ccccc5)ccc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L11 compound treatment 680975.8065 129000.0 0.6 613375.0 75100.0 0.4 0.7038 0.9806 2065526 ICCB5_000253 CCCCCCCCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L12 compound treatment 59965.5172 -492000.0 -2.27 83673.0769 -455000.0 -2.41 -3.3079 -0.9995 2065527 ICCB5_000254 CCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L13 compound treatment 684116.041 133000.0 0.61 626763.8889 88500.0 0.47 0.7642 0.9914 2065528 ICCB5_000255 CCCCCCCCCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L14 compound treatment 502713.0045 -48800.0 -0.23 639055.7621 101000.0 0.53 0.2188 0.3773 2065529 ICCB5_000256 CCCCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L15 compound treatment 614815.1659 63300.0 0.29 576643.4783 38400.0 0.2 0.3503 0.9844 2065530 ICCB5_000257 CCCCCCCCCCCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L16 compound treatment 583923.8754 32400.0 0.15 587022.6244 48700.0 0.26 0.2885 0.9661 2065531 ICCB5_000258 CCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L17 compound treatment 668486.7257 117000.0 0.54 557148.4099 18900.0 0.1 0.4522 0.8242 2065532 ICCB5_000259 CCCCCCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L18 compound treatment 608831.9328 57300.0 0.26 532678.9668 -5610.0 -0.03 0.1659 0.6236 2065533 ICCB5_000260 CCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L19 compound treatment 608098.1132 56600.0 0.26 656920.0 119000.0 0.63 0.6295 0.924 2065534 ICCB5_000261 CCCCCCCCCCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L20 compound treatment 638201.4925 86700.0 0.4 544003.7736 5720.0 0.03 0.3041 0.7586 2065535 ICCB5_000262 CCCCCCCCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L21 compound treatment 505507.7882 -46000.0 -0.21 691837.5 154000.0 0.81 0.4259 0.506 2065536 ICCB5_000263 CCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L22 compound treatment 545433.657 -6080.0 -0.03 569219.2308 30900.0 0.16 0.0962 0.5779 2065537 ICCB5_000264 CCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L23 mock treatment 606384.3844 54900.0 0.25 616278.125 78000.0 0.41 0.4714 0.9722 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 L24 mock treatment 608210.3321 56700.0 0.26 512895.9108 -25400.0 -0.13 0.0897 0.3048 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M01 compound treatment 468934.4978 -82600.0 -0.38 516027.907 -22300.0 -0.12 -0.3528 -0.8848 2065538 ICCB5_000265 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@@H](CC=C)OC(=O)c3ccccc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M02 compound treatment 495723.5023 -55800.0 -0.26 585990.0 47700.0 0.25 -0.003 -0.0084 2065539 ICCB5_000266 CCOC(=O)/C=C\Cc1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M03 compound treatment 570706.9767 19200.0 0.09 532596.9388 -5690.0 -0.03 0.0413 0.4411 2065540 ICCB5_000267 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@H](CC=C)OC(=O)c3ccccc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M04 compound treatment 540848.1481 -10700.0 -0.05 554293.8776 16000.0 0.08 0.0253 0.2575 2065541 ICCB5_000268 CCOC(=O)[C@H](OS(=O)(=O)c1ccc(C)cc1)[C@@H](O)Cc2cc3OCOc3cc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M05 compound treatment 542588.9328 -8920.0 -0.04 570790.2622 32500.0 0.17 0.0928 0.5236 2065542 ICCB5_000269 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@@H](CC=C)O[Si](C)(C)C(C)(C)C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M06 compound treatment 504682.9268 -46800.0 -0.22 565094.4882 26800.0 0.14 -0.0522 -0.2018 2065380 ICCB5_000270 CCOC(=O)/C=C/c1cc2OCOc2cc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M07 compound treatment 706650.655 155000.0 0.72 730510.3734 192000.0 1.02 1.2268 0.985 2065543 ICCB5_000271 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@H](CC=C)O[Si](C)(C)C(C)(C)C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M08 compound treatment 598618.677 47100.0 0.22 573925.9259 35600.0 0.19 0.2873 0.9976 2065544 ICCB5_000272 CCOC(=O)[C@H](O)[C@@H](NC(=O)OCc1ccccc1)c2cc3OCOc3cc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M09 compound treatment 615611.1111 64100.0 0.3 619924.4604 81600.0 0.43 0.5152 0.9827 2065545 ICCB5_000273 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@H](CC=C)OC(=O)C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M10 compound treatment 675368.8525 124000.0 0.57 615756.3025 77500.0 0.41 0.6944 0.9869 2065546 ICCB5_000274 CCOC(=O)[C@@H]1OC(C)(C)N([C@H]1c2cc3OCOc3cc2[N+](=O)[O-])C(=O)OCc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M11 compound treatment 623497.3822 72000.0 0.33 567729.9578 29400.0 0.16 0.3452 0.9408 2065547 ICCB5_000275 Oc1ccc2N([C@@H](Cc2c1)[C@@H](CC=C)OC(=O)c3ccccc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M12 compound treatment 636420.2899 84900.0 0.39 512898.1132 -25400.0 -0.13 0.1817 0.4387 2065548 ICCB5_000276 CC1(C)O[C@@H](CO)[C@@H](N1C(=O)OCc2ccccc2)c3cc4OCOc4cc3[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M13 compound treatment 695662.8352 144000.0 0.66 814336.5854 276000.0 1.46 1.5054 0.9362 2065549 ICCB5_000277 COCCOCOc1ccc2N[C@@H](Cc2c1)[C@@H](CC=C)O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M14 compound treatment 672567.9612 121000.0 0.56 731832.0896 194000.0 1.03 1.1206 0.959 2065550 ICCB5_000278 CCOC(=O)[C@H]1Nc2cc3OCOc3cc2C[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M15 compound treatment 577122.2707 25600.0 0.12 591037.8788 52700.0 0.28 0.2814 0.9264 2065551 ICCB5_000279 COCCOCOc1ccc2N[C@@H](Cc2c1)[C@H](CC=C)O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M16 compound treatment 582953.7815 31400.0 0.15 582515.748 44200.0 0.23 0.2684 0.9733 2065552 ICCB5_000280 CCOC(=O)[C@@H]1[C@@H](O)Cc2cc3OCOc3cc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M17 compound treatment 735010.4167 183000.0 0.85 580021.2766 41700.0 0.22 0.7549 0.863 2065553 ICCB5_000281 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@@H](CC=C)O[Si](C)(C)C(C)(C)C)C(=O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M18 compound treatment 563822.6415 12300.0 0.06 535189.5161 -3100.0 -0.02 0.0285 0.4826 2065554 ICCB5_000282 CCOC(=O)[C@@H]1[C@H](Cc2cc3OCOc3cc2N1C(=O)C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M19 compound treatment 583838.0567 32300.0 0.15 530291.498 -8000.0 -0.04 0.0754 0.4866 2065555 ICCB5_000283 COCCOCOc1ccc2N([C@@H](Cc2c1)[C@H](CC=C)O[Si](C)(C)C(C)(C)C)C(=O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M20 compound treatment 558277.7778 6770.0 0.03 651652.1739 113000.0 0.6 0.4472 0.7428 2065556 ICCB5_000284 CC(C)(C)[Si](C)(C)OC[C@@H]1[C@@H](O)Cc2cc3OCOc3cc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M21 compound treatment 577000.0 25500.0 0.12 549687.5 11400.0 0.06 0.1259 0.9522 2065557 ICCB5_000285 COCCOCOc1ccc2N3[C@@H](Cc2c1)[C@H](CC=CC3=O)O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M22 compound treatment 599458.0153 47900.0 0.22 534454.9763 -3830.0 -0.02 0.142 0.6394 2065558 ICCB5_000286 CC(C)(C)[Si](C)(C)OC[C@@H]1[C@H](Cc2cc3OCOc3cc2N1C(=O)OCC=C)OC(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M23 mock treatment 624742.268 73200.0 0.34 537615.0628 -673.0 0.0 0.2363 0.6996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 M24 mock treatment 510060.7287 -41500.0 -0.19 498126.7606 -40200.0 -0.21 -0.2858 -0.9985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N01 compound treatment 703489.1775 152000.0 0.7 1162619.355 624000.0 3.31 2.8371 0.8382 2065559 ICCB5_000287 CCCCCCCCC(=O)O/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N02 compound treatment 869893.8053 318000.0 1.47 787371.179 249000.0 1.32 1.9724 0.9986 2065560 ICCB5_000288 CCCCCCCCCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N03 compound treatment 675826.8398 124000.0 0.57 716326.087 178000.0 0.94 1.0731 0.9714 2065561 ICCB5_000289 CCCCCCCCCCCCCCC(=O)O/C=C\c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N04 compound treatment 646855.4217 95300.0 0.44 786716.1572 248000.0 1.32 1.2426 0.8946 2065562 ICCB5_000290 CCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N05 compound treatment 658450.1992 107000.0 0.49 824836.0656 287000.0 1.52 1.4234 0.8908 3057099 ICCB5_000291 O=C(NCc1ccccc1)C(OC(=O)c2ccccc2)c3ccco3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N06 compound treatment 762277.3109 211000.0 0.97 774564.6552 236000.0 1.25 1.5734 0.9921 2065563 ICCB5_000292 CCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N07 compound treatment 737820.6278 186000.0 0.86 724239.3617 186000.0 0.99 1.3049 0.9976 3057100 ICCB5_000293 COc1ccc(NC(=O)C(OC(=O)c2ccccc2)c3ccco3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N08 compound treatment 752212.2642 201000.0 0.93 680806.867 143000.0 0.76 1.189 0.9949 2065564 ICCB5_000294 CCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N09 compound treatment 645476.8519 94000.0 0.43 697056.0 159000.0 0.84 0.9019 0.9523 3176076 ICCB5_000295 CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c2ccco2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N10 compound treatment 661950.6173 110000.0 0.51 662451.7544 124000.0 0.66 0.8258 0.9919 2065565 ICCB5_000296 CCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N11 compound treatment 570872.8814 19400.0 0.09 554059.7826 15800.0 0.08 0.1223 0.9995 2065566 ICCB5_000297 CCCCNC(=O)C(OC(=O)c1ccccc1)c2ccco2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N12 compound treatment 591342.1053 39800.0 0.18 581494.1634 43200.0 0.23 0.2919 0.994 2065567 ICCB5_000298 CCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N13 compound treatment 680326.5306 129000.0 0.59 619744.5887 81500.0 0.43 0.7256 0.9878 2065568 ICCB5_000299 CCCCCNC(=O)C(OC(=O)c1ccccc1)c2ccco2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N14 compound treatment 561464.8649 9950.0 0.05 549437.2294 11100.0 0.06 0.0743 0.9922 2065569 ICCB5_000300 CCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N15 compound treatment 649465.4378 98000.0 0.45 969083.5443 431000.0 2.28 1.9351 0.8308 2065570 ICCB5_000301 O=C(NCc1ccccc1)C(COCc2ccccc2)OC(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N16 compound treatment 440616.8224 -111000.0 -0.51 631535.7143 93200.0 0.49 -0.0119 -0.0167 2065571 ICCB5_000302 CCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N17 compound treatment 574794.4664 23300.0 0.11 559752.7675 21500.0 0.11 0.1564 0.9996 2065572 ICCB5_000303 COc1ccc(NC(=O)C(COCc2ccccc2)OC(=O)c3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N18 compound treatment 572438.0531 20900.0 0.1 559261.4841 21000.0 0.11 0.1469 0.9975 2065573 ICCB5_000304 CCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N19 compound treatment 585879.5181 34400.0 0.16 626120.4819 87800.0 0.47 0.4415 0.8972 2065574 ICCB5_000305 CC(C)(C)NC(=O)C(COCc1ccccc1)OC(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N20 compound treatment 45893.617 -506000.0 -2.33 48148.9362 -490000.0 -2.6 -3.487 -0.9985 2065575 ICCB5_000306 CCCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N21 compound treatment 561674.0741 10200.0 0.05 572000.0 33700.0 0.18 0.1596 0.8633 2065576 ICCB5_000307 CCCCNC(=O)C(COCc1ccccc1)OC(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N22 compound treatment 531888.8889 -19600.0 -0.09 619829.7101 81500.0 0.43 0.2418 0.5473 2065577 ICCB5_000308 CCCCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N23 mock treatment 625152.0913 73600.0 0.34 488313.253 -50000.0 -0.27 0.0527 0.1223 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 N24 mock treatment 485442.7861 -66100.0 -0.3 570984.7328 32700.0 0.17 -0.0928 -0.2647 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O01 compound treatment 566463.5193 15000.0 0.07 577050.8475 38800.0 0.21 0.1941 0.8953 2065578 ICCB5_000309 COCCOCOc1ccc2N3[C@@H](Cc2c1)[C@@H](CC=CC3=O)O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O02 compound treatment 560573.7705 9060.0 0.04 615169.4215 76900.0 0.41 0.3179 0.7755 2065579 ICCB5_000310 OC[C@@H]1[C@@H](O)Cc2cc3OCOc3cc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O03 compound treatment 615624.4131 64100.0 0.3 646746.8354 108000.0 0.58 0.6158 0.9521 2065580 ICCB5_000311 COCCOCOc1ccc2N3[C@@H](Cc2c1)[C@@H](C[C@H](CC3=O)Sc4ccccc4)O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O04 compound treatment 561857.7982 10300.0 0.05 620182.2034 81900.0 0.43 0.3409 0.7801 2065581 ICCB5_000312 C=CCOC(=O)OC[C@@H]1[C@H](Cc2cc3OCOc3cc2N1C(=O)OCC=C)OC(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O05 compound treatment 610596.5665 59100.0 0.27 541000.0 2710.0 0.01 0.2028 0.7434 2065582 ICCB5_000313 COCCOCOc1ccc2N3[C@@H](Cc2c1)[C@H](C[C@@H](CC3=O)Sc4ccccc4)O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O06 compound treatment 512427.1845 -39100.0 -0.18 568611.1111 30300.0 0.16 -0.0137 -0.0568 2065583 ICCB5_000314 CC(=O)O[C@H]1Cc2cc3OCOc3cc2N([C@@H]1COC(=O)OCC=C)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O07 compound treatment 574274.4186 22800.0 0.1 544435.8974 6150.0 0.03 0.0973 0.885 2065584 ICCB5_000315 COCCOCOc1ccc2N3[C@@H](Cc2c1)[C@H](O)CC=CC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O08 compound treatment 488232.7586 -63300.0 -0.29 509678.5714 -28600.0 -0.15 -0.3136 -0.9536 2065585 ICCB5_000316 CC(C)(C)C(=O)OC[C@@H]1[C@H](Cc2cc3OCOc3cc2N1CC=C)O[Si](C)(C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O09 compound treatment 668719.6653 117000.0 0.54 547732.1429 9440.0 0.05 0.4176 0.7693 2065586 ICCB5_000317 COCCOCOc1ccc2N3[C@@H](Cc2c1)[C@@H](O)CC=CC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O10 compound treatment 570636.7925 19100.0 0.09 672756.0976 134000.0 0.71 0.5667 0.7885 2065587 ICCB5_000318 CCOC(=O)/C=C/Cc1cc(OCOCCOC)ccc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O11 compound treatment 652013.6364 101000.0 0.46 582000.0 43700.0 0.23 0.4917 0.9487 2065588 ICCB5_000319 COCCOCOc1ccc2N3[C@@H](Cc2c1)[C@@H]4C[C@@H](C[Si](C)(C)O4)CC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O12 compound treatment 536720.6478 -14800.0 -0.07 475913.0435 -62400.0 -0.33 -0.2822 -0.8353 2065589 ICCB5_000320 CCOC(=O)[C@H](OS(=O)(=O)c1ccc(C)cc1)[C@@H](O)Cc2cc(OCOCCOC)ccc2N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O13 compound treatment 586906.5041 35400.0 0.16 522798.2833 -15500.0 -0.08 0.0573 0.3137 2065590 ICCB5_000321 COCCOCOc1ccc2N3[C@@H](Cc2c1)C=CC=CC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O14 compound treatment 547953.4884 -3560.0 -0.02 588649.789 50400.0 0.27 0.1773 0.6624 2065591 ICCB5_000322 CCOC(=O)[C@H](OS(=O)(=O)c1ccc(C)cc1)[C@@H](O)Cc2cc(OC3CCCCO3)ccc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O15 compound treatment 510238.5321 -41300.0 -0.19 501162.1622 -37100.0 -0.2 -0.2738 -0.9999 2065592 ICCB5_000323 OCCCOc1ccc2N([C@@H](Cc2c1)[C@@H](CC=C)OC(=O)c3ccccc3)C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O16 compound treatment 541915.9664 -9600.0 -0.04 683044.898 145000.0 0.77 0.5116 0.6652 2065593 ICCB5_000324 CCOC(=O)/C=C/c1cc(O)ccc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O17 compound treatment 558717.7033 7210.0 0.03 530309.5238 -7980.0 -0.04 -0.0064 -0.1194 2065594 ICCB5_000325 CCOC(=O)/C=C/[C@@H]1Cc2cc(OCOCCOC)ccc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O18 compound treatment 455715.5963 -95800.0 -0.44 458663.5514 -79600.0 -0.42 -0.611 -0.9997 2065595 ICCB5_000326 CCOC(=O)/C=C/c1cc(OCOCCOC)ccc1[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O19 compound treatment 644163.0901 92700.0 0.43 523695.4733 -14600.0 -0.08 0.2474 0.5697 2065596 ICCB5_000327 CCOC(=O)/C=C/[C@@H]1Cc2ccccc2N1C(=O)OCC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O20 compound treatment 584792.1569 33300.0 0.15 480728.3019 -57600.0 -0.31 -0.1074 -0.3142 2065371 ICCB5_000328 CCOC(=O)[C@H](O)[C@@H](NC(=O)OCc1ccccc1)c2cc(OCOCCOC)ccc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O21 compound treatment 522581.3953 -28900.0 -0.13 467198.1132 -71100.0 -0.38 -0.361 -0.9025 2065597 ICCB5_000329 CCOC(=O)/C=C/[C@@H]1Cc2ccccc2N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O22 compound treatment 403394.3662 -148000.0 -0.68 519459.2275 -18800.0 -0.1 -0.5536 -0.802 2065598 ICCB5_000330 CCOC(=O)[C@H](OC(C)C)[C@@H](N(C(C)C)C(=O)OCc1ccccc1)c2cc(OCOCCOC)ccc2[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O23 mock treatment 527831.2757 -23700.0 -0.11 498342.4658 -39900.0 -0.21 -0.227 -0.9525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 O24 mock treatment 499461.5385 -52000.0 -0.24 529239.3822 -9050.0 -0.05 -0.2037 -0.832 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P01 compound treatment 981909.8592 430000.0 1.98 541540.1786 3250.0 0.02 1.4157 0.7132 2065599 ICCB5_000331 CCCCCNC(=O)C(COCc1ccccc1)OC(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P02 compound treatment 581391.8919 29900.0 0.14 408320.8333 -130000.0 -0.69 -0.39 -0.5548 2065600 ICCB5_000332 CCCCCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P03 compound treatment 1110209.239 559000.0 2.58 569447.4886 31200.0 0.17 1.9387 0.7509 2065601 ICCB5_000333 O=C(NCc1ccccc1)C(OC(=O)c2ccccc2)c3cccs3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P04 compound treatment 500312.2363 -51200.0 -0.24 486995.7447 -51300.0 -0.27 -0.3593 -0.9975 2065602 ICCB5_000334 CCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P05 compound treatment 876870.9677 325000.0 1.5 909822.4044 372000.0 1.97 2.4544 0.991 2065603 ICCB5_000335 COc1ccc(NC(=O)C(OC(=O)c2ccccc2)c3cccs3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P06 compound treatment 360980.5825 -191000.0 -0.88 490480.9524 -47800.0 -0.25 -0.8006 -0.8754 2065604 ICCB5_000336 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P07 compound treatment 969167.5532 418000.0 1.93 856878.3069 319000.0 1.69 2.5568 0.9979 2065605 ICCB5_000337 CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c2cccs2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P08 compound treatment 492076.087 -59400.0 -0.27 507561.5764 -30700.0 -0.16 -0.3091 -0.9692 2065606 ICCB5_000338 CCCC/C=C\CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P09 compound treatment 1004412.742 453000.0 2.09 553983.6735 15700.0 0.08 1.5357 0.7347 2065607 ICCB5_000339 CCCCNC(=O)C(OC(=O)c1ccccc1)c2cccs2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P10 compound treatment 413774.8344 -138000.0 -0.64 379589.7436 -159000.0 -0.84 -1.0443 -0.9904 2065608 ICCB5_000340 CCCCCC/C=C\CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P11 compound treatment 499796.6102 -51700.0 -0.24 511361.1111 -26900.0 -0.14 -0.2696 -0.9699 2065609 ICCB5_000341 CCCCCNC(=O)C(OC(=O)c1ccccc1)c2cccs2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P12 compound treatment 29916.6667 -522000.0 -2.41 39055.5556 -499000.0 -2.65 -3.5732 -0.9989 2065610 ICCB5_000342 CCCCCC/C=C\CCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P13 compound treatment 875199.4609 324000.0 1.49 550141.7004 11900.0 0.06 1.1 0.7362 2065611 ICCB5_000343 COc1ccc(CN2C(C(=O)N(CC=C)Cc3ccccc3)C4(OC5C=C4)C(C5C(=O)O)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P14 compound treatment 36947.3684 -515000.0 -2.37 52288.4615 -486000.0 -2.58 -3.5007 -0.9991 2065612 ICCB5_000344 CCCCCCCCCCC/C=C\CCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P15 compound treatment 1105613.699 554000.0 2.56 1148050.265 610000.0 3.23 4.0938 0.9932 2065613 ICCB5_000345 CCOC(=O)C1C2OC3(C=C2)C(N(Cc4ccc(OC)cc4)C(=O)C13)C(=O)NCc5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P16 compound treatment 44958.3333 -507000.0 -2.34 55543.4783 -483000.0 -2.56 -3.4624 -0.999 2065614 ICCB5_000346 CCCCCCCC/C=C\CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P17 compound treatment 430102.7668 -121000.0 -0.56 458558.8235 -79700.0 -0.42 -0.6949 -0.9904 2065615 ICCB5_000347 COc1ccc(CN2[C@H]3C(=O)N(Cc4ccccc4)C/C=C/CCC(=O)N(C)[C@H](C)[C@H](OC(=O)[C@@H]5[C@H]6O[C@]3(C=C6)[C@H]5C2=O)c7ccccc7)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P18 compound treatment 51265.3061 -500000.0 -2.31 57553.1915 -481000.0 -2.55 -3.4343 -0.9988 2065616 ICCB5_000348 CCCC/C=C\CCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P19 compound treatment 544423.7288 -7090.0 -0.03 527463.035 -10800.0 -0.06 -0.0637 -0.9643 2065617 ICCB5_000349 COc1ccc(CN2[C@@H](C(=O)N(CC=C)Cc3ccccc3)[C@]4(O[C@H]5C=C4)[C@H]([C@@H]5C(=O)O[C@H]([C@H](C)N(C)C(=O)CCC=C)c6ccccc6)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P20 compound treatment 335920.904 -216000.0 -0.99 350378.7879 -188000.0 -1.0 -1.4078 -1.0 2065618 ICCB5_000350 CCCCCCCC/C=C\CCCCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P21 compound treatment 501736.4017 -49800.0 -0.23 452530.1205 -85800.0 -0.45 -0.4839 -0.9499 2065619 ICCB5_000351 COc1ccc(CN2[C@H](C(=O)N(CC=C)Cc3ccccc3)[C@@]4(O[C@@H]5C=C4)[C@@H]([C@H]5C(=O)O[C@H]([C@H](C)N(C)C(=O)CCC=C)c6ccccc6)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P22 compound treatment 381827.5862 -170000.0 -0.78 391239.819 -147000.0 -0.78 -1.1048 -1.0 2065620 ICCB5_000352 CCCCC/C=C\C/C=C\CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P23 mock treatment 840030.5011 289000.0 1.33 852425.3898 314000.0 1.67 2.119 0.9938 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1363 P24 mock treatment 442394.3089 -109000.0 -0.5 462163.6364 -76100.0 -0.4 -0.6413 -0.994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A01 compound treatment 492635.1351 -142000.0 -0.65 379547.9452 -189000.0 -1.0 -1.172 -0.9786 ICBGEx1_000353 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A02 compound treatment 534339.5349 -100000.0 -0.46 475458.5366 -93200.0 -0.49 -0.6763 -0.9994 ICBGEx1_000354 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A03 compound treatment 580950.0 -53600.0 -0.25 606733.3333 38100.0 0.2 -0.0319 -0.1 ICBGEx1_000355 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A04 compound treatment 639000.0 4410.0 0.02 608525.3456 39900.0 0.21 0.1641 0.7715 ICBGEx1_000356 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A05 compound treatment 522101.5625 -112000.0 -0.52 455991.9355 -113000.0 -0.6 -0.7892 -0.9975 ICBGEx1_000357 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A06 compound treatment 421386.3636 -213000.0 -0.98 331309.5238 -237000.0 -1.26 -1.5852 -0.9925 ICBGEx1_000358 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A07 compound treatment 611771.3004 -22800.0 -0.11 506204.918 -62400.0 -0.33 -0.3085 -0.8881 ICBGEx1_000359 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A08 compound treatment 408586.2069 -226000.0 -1.04 551611.7647 -17000.0 -0.09 -0.8007 -0.7654 ICBGEx1_000360 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A09 compound treatment 487610.5263 -147000.0 -0.68 520319.5021 -48300.0 -0.26 -0.6604 -0.9114 ICBGEx1_000361 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A10 compound treatment 563743.1193 -70800.0 -0.33 582396.3964 13800.0 0.07 -0.1793 -0.5356 ICBGEx1_000362 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A11 compound treatment 491395.9732 -143000.0 -0.66 467988.3721 -101000.0 -0.53 -0.8443 -0.9944 ICBGEx1_000363 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A12 compound treatment 371553.0303 -263000.0 -1.21 320208.6331 -248000.0 -1.32 -1.7894 -0.9991 ICBGEx1_000364 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A13 compound treatment 691408.1633 56800.0 0.26 500106.0606 -68500.0 -0.36 -0.0717 -0.1599 ICBGEx1_000365 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A14 compound treatment 589845.8333 -44700.0 -0.21 557443.5484 -11200.0 -0.06 -0.1878 -0.8748 ICBGEx1_000366 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A15 compound treatment 521327.2727 -113000.0 -0.52 406854.4601 -162000.0 -0.86 -0.976 -0.9717 ICBGEx1_000367 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A16 compound treatment 428693.3333 -206000.0 -0.95 429318.4713 -139000.0 -0.74 -1.1938 -0.9923 ICBGEx1_000368 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A17 compound treatment 727078.2609 92500.0 0.43 519406.3604 -49200.0 -0.26 0.117 0.2341 ICBGEx1_000369 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A18 compound treatment 480323.2323 -154000.0 -0.71 428049.0196 -141000.0 -0.75 -1.0302 -0.9997 ICBGEx1_000370 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A19 compound treatment 475345.5882 -159000.0 -0.73 424908.4967 -144000.0 -0.76 -1.0582 -0.9998 ICBGEx1_000371 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A20 compound treatment 544750.0 -89800.0 -0.41 523403.3149 -45200.0 -0.24 -0.4625 -0.9662 ICBGEx1_000372 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A21 compound treatment 458660.0 -176000.0 -0.81 369566.6667 -199000.0 -1.06 -1.3202 -0.9915 ICBGEx1_000373 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A22 compound treatment 565060.0 -69500.0 -0.32 383904.7619 -185000.0 -0.98 -0.9195 -0.892 ICBGEx1_000374 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A23 mock treatment 689810.1266 55200.0 0.25 810179.803 242000.0 1.28 1.0861 0.8314 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 A24 mock treatment 836252.0107 202000.0 0.93 653165.9091 84600.0 0.45 0.9747 0.9441 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B01 compound treatment 767782.2222 133000.0 0.61 607938.7755 39300.0 0.21 0.5818 0.8969 ICBGEx1_000375 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B02 compound treatment 474103.0303 -160000.0 -0.74 412616.5803 -156000.0 -0.83 -1.1084 -0.9985 ICBGEx1_000376 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B03 compound treatment 667188.8889 32600.0 0.15 438989.899 -130000.0 -0.69 -0.3798 -0.5397 ICBGEx1_000377 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B04 compound treatment 753015.2284 118000.0 0.55 537330.5439 -31300.0 -0.17 0.2689 0.471 ICBGEx1_000378 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B05 compound treatment 484377.451 -150000.0 -0.69 359021.0526 -210000.0 -1.11 -1.2759 -0.9741 ICBGEx1_000379 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B06 compound treatment 636470.5882 1880.0 0.01 656675.2577 88100.0 0.47 0.3364 0.7201 ICBGEx1_000380 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B07 compound treatment 542780.1418 -91800.0 -0.42 364321.6374 -204000.0 -1.08 -1.0656 -0.916 ICBGEx1_000381 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B08 compound treatment 664251.938 29700.0 0.14 712587.7551 144000.0 0.76 0.6367 0.8207 ICBGEx1_000382 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B09 compound treatment 606722.8261 -27900.0 -0.13 632333.3333 63700.0 0.34 0.1481 0.4096 ICBGEx1_000383 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B10 compound treatment 681781.6594 47200.0 0.22 535101.5625 -33500.0 -0.18 0.0282 0.1004 ICBGEx1_000384 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B11 compound treatment 477005.2083 -158000.0 -0.73 481975.0 -86600.0 -0.46 -0.8388 -0.9756 ICBGEx1_000385 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B12 compound treatment 758524.0175 124000.0 0.57 562914.8936 -5700.0 -0.03 0.3828 0.6688 ICBGEx1_000386 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B13 compound treatment 552771.4286 -81800.0 -0.38 460751.8248 -108000.0 -0.57 -0.6713 -0.9796 ICBGEx1_000387 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B14 compound treatment 558979.5918 -75600.0 -0.35 767413.0435 199000.0 1.05 0.499 0.4493 ICBGEx1_000388 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B15 compound treatment 414111.1111 -220000.0 -1.02 352215.6863 -216000.0 -1.15 -1.5306 -0.9982 ICBGEx1_000389 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B16 compound treatment 295138.2114 -339000.0 -1.57 332063.3803 -237000.0 -1.25 -1.9941 -0.994 ICBGEx1_000390 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B17 compound treatment 579659.5745 -54900.0 -0.25 481961.165 -86700.0 -0.46 -0.5041 -0.9606 ICBGEx1_000391 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B18 compound treatment 59086.9565 -576000.0 -2.65 67211.5385 -501000.0 -2.66 -3.7572 -1.0 ICBGEx1_000392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B19 compound treatment 476412.5874 -158000.0 -0.73 539982.3944 -28600.0 -0.15 -0.6232 -0.8364 ICBGEx1_000393 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B20 compound treatment 474598.9848 -160000.0 -0.74 396392.3445 -172000.0 -0.91 -1.1676 -0.9944 ICBGEx1_000394 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B21 compound treatment 446839.5062 -188000.0 -0.87 345017.301 -224000.0 -1.19 -1.4508 -0.988 ICBGEx1_000395 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B22 compound treatment 610180.3279 -24400.0 -0.11 548344.0233 -20300.0 -0.11 -0.1556 -0.9997 ICBGEx1_000396 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B23 mock treatment 545534.296 -89100.0 -0.41 500625.0 -68000.0 -0.36 -0.5454 -0.9979 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 B24 mock treatment 513967.7419 -121000.0 -0.56 635256.6845 66600.0 0.35 -0.1434 -0.2176 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C01 compound treatment 338230.2158 -296000.0 -1.37 290234.2342 -278000.0 -1.48 -2.0105 -0.9993 ICBGEx1_000397 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C02 compound treatment 408452.8302 -226000.0 -1.04 347713.2867 -221000.0 -1.17 -1.5659 -0.9983 ICBGEx1_000398 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C03 compound treatment 492213.7931 -142000.0 -0.66 534302.1978 -34300.0 -0.18 -0.593 -0.8703 ICBGEx1_000399 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C04 compound treatment 637987.7301 3400.0 0.02 495730.5389 -72900.0 -0.39 -0.2623 -0.6779 ICBGEx1_000400 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C05 compound treatment 362330.0 -272000.0 -1.26 373539.4737 -195000.0 -1.03 -1.6194 -0.9954 ICBGEx1_000401 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C06 compound treatment 464572.9167 -170000.0 -0.78 541563.7255 -27000.0 -0.14 -0.6559 -0.8228 ICBGEx1_000402 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C07 compound treatment 687103.2609 52500.0 0.24 449203.7915 -119000.0 -0.63 -0.2766 -0.4079 ICBGEx1_000403 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C08 compound treatment 382268.2927 -252000.0 -1.16 361386.3636 -207000.0 -1.1 -1.6 -0.9996 ICBGEx1_000404 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C09 compound treatment 571060.0 -63500.0 -0.29 471487.3418 -97100.0 -0.52 -0.5714 -0.9642 ICBGEx1_000405 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C10 compound treatment 529556.2914 -105000.0 -0.48 441567.5676 -127000.0 -0.67 -0.819 -0.9869 ICBGEx1_000406 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C11 compound treatment 213609.7561 -421000.0 -1.94 247081.0811 -322000.0 -1.71 -2.5787 -0.9979 ICBGEx1_000407 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C12 compound treatment 528215.7895 -106000.0 -0.49 444300.5464 -124000.0 -0.66 -0.8131 -0.9894 ICBGEx1_000408 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C13 compound treatment 573025.7732 -61600.0 -0.28 502120.6897 -66500.0 -0.35 -0.4501 -0.9942 ICBGEx1_000409 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C14 compound treatment 649656.1086 15100.0 0.07 574313.3803 5700.0 0.03 0.0705 0.9306 ICBGEx1_000410 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C15 compound treatment 628201.2987 -6390.0 -0.03 445624.2775 -123000.0 -0.65 -0.4821 -0.7383 ICBGEx1_000411 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C16 compound treatment 372907.4074 -262000.0 -1.21 375352.9412 -193000.0 -1.03 -1.5781 -0.9967 ICBGEx1_000412 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C17 compound treatment 528155.3785 -106000.0 -0.49 621058.8235 52400.0 0.28 -0.1504 -0.2665 ICBGEx1_000413 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C18 compound treatment 516180.0 -118000.0 -0.55 582054.5455 13400.0 0.07 -0.3357 -0.6096 ICBGEx1_000414 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C19 compound treatment 548073.1707 -86500.0 -0.4 444044.1176 -125000.0 -0.66 -0.7493 -0.9708 ICBGEx1_000415 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C20 compound treatment 540240.3846 -94400.0 -0.44 485177.8846 -83400.0 -0.44 -0.6206 -1.0 ICBGEx1_000416 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C21 compound treatment 491972.6776 -143000.0 -0.66 427250.0 -141000.0 -0.75 -0.9952 -0.9979 ICBGEx1_000417 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C22 compound treatment 564537.931 -70100.0 -0.32 473803.3708 -94800.0 -0.5 -0.584 -0.9771 ICBGEx1_000418 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C23 mock treatment 565803.3473 -68800.0 -0.32 554425.2874 -14200.0 -0.08 -0.2775 -0.8512 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 C24 mock treatment 584600.0 -50000.0 -0.23 452849.3976 -116000.0 -0.61 -0.5972 -0.9105 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D01 compound treatment 353873.0159 -281000.0 -1.29 455675.2137 -113000.0 -0.6 -1.339 -0.9387 ICBGEx1_000419 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D02 compound treatment 528752.1368 -106000.0 -0.49 526696.4286 -41900.0 -0.22 -0.5023 -0.9366 ICBGEx1_000420 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D03 compound treatment 692761.0619 58200.0 0.27 548014.8699 -20600.0 -0.11 0.1124 0.3882 ICBGEx1_000421 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D04 compound treatment 45231.8841 -589000.0 -2.72 52316.6667 -516000.0 -2.74 -3.8582 -1.0 ICBGEx1_000422 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D05 compound treatment 723387.234 88800.0 0.41 632100.4184 63500.0 0.34 0.5277 0.9953 ICBGEx1_000423 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D06 compound treatment 551029.1667 -83600.0 -0.39 580876.494 12300.0 0.07 -0.2265 -0.5795 ICBGEx1_000424 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D07 compound treatment 611726.4574 -22900.0 -0.11 650588.2353 82000.0 0.43 0.2329 0.5205 ICBGEx1_000425 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D08 compound treatment 710153.8462 75600.0 0.35 493919.4915 -74700.0 -0.4 -0.0337 -0.0639 ICBGEx1_000426 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D09 compound treatment 512116.1826 -122000.0 -0.56 452498.0545 -116000.0 -0.62 -0.8349 -0.9991 ICBGEx1_000427 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D10 compound treatment 508411.5226 -126000.0 -0.58 583693.75 15100.0 0.08 -0.3549 -0.6042 ICBGEx1_000428 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D11 compound treatment 541917.3228 -92700.0 -0.43 480000.0 -88600.0 -0.47 -0.6345 -0.9989 ICBGEx1_000429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D12 compound treatment 570720.9302 -63900.0 -0.29 538704.6632 -29900.0 -0.16 -0.3204 -0.9578 ICBGEx1_000430 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D13 compound treatment 645670.1031 11100.0 0.05 551306.9307 -17300.0 -0.09 -0.0288 -0.2739 ICBGEx1_000431 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D14 compound treatment 646626.8657 12000.0 0.06 468009.772 -101000.0 -0.53 -0.3381 -0.6301 ICBGEx1_000432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D15 compound treatment 475472.0 -159000.0 -0.73 354537.931 -214000.0 -1.14 -1.3218 -0.9777 ICBGEx1_000433 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D16 compound treatment 47745.7627 -587000.0 -2.71 41121.2121 -527000.0 -2.8 -3.892 -0.9999 ICBGEx1_000434 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D17 compound treatment 441668.2464 -193000.0 -0.89 412298.3871 -156000.0 -0.83 -1.2154 -0.9994 ICBGEx1_000435 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D18 compound treatment 637208.6331 2620.0 0.01 538509.0253 -30100.0 -0.16 -0.1044 -0.6518 ICBGEx1_000436 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D19 compound treatment 44450.0 -590000.0 -2.72 41358.209 -527000.0 -2.8 -3.9019 -0.9999 ICBGEx1_000437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D20 compound treatment 583481.7814 -51100.0 -0.24 560079.0378 -8530.0 -0.05 -0.1987 -0.8278 ICBGEx1_000438 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D21 compound treatment 531108.7866 -103000.0 -0.48 452707.6271 -116000.0 -0.61 -0.7721 -0.9922 ICBGEx1_000439 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D22 compound treatment 480592.0 -154000.0 -0.71 521594.5946 -47000.0 -0.25 -0.6785 -0.9014 ICBGEx1_000440 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D23 mock treatment 549701.3423 -84900.0 -0.39 543584.2391 -25000.0 -0.13 -0.3707 -0.8967 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 D24 mock treatment 502309.3525 -132000.0 -0.61 469354.6099 -99300.0 -0.53 -0.8036 -0.9973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E01 compound treatment 422605.0955 -212000.0 -0.98 390668.8312 -178000.0 -0.94 -1.3586 -0.9998 ICBGEx1_000441 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E02 compound treatment 544303.3708 -90300.0 -0.42 387377.9528 -181000.0 -0.96 -0.9741 -0.9299 ICBGEx1_000442 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E03 compound treatment 606735.6322 -27900.0 -0.13 605282.6087 36700.0 0.19 0.0467 0.2003 ICBGEx1_000443 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E04 compound treatment 547956.5217 -86600.0 -0.4 420867.052 -148000.0 -0.78 -0.8366 -0.9511 ICBGEx1_000444 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E05 compound treatment 619098.5915 -15500.0 -0.07 489239.2157 -79400.0 -0.42 -0.3482 -0.8154 ICBGEx1_000445 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E06 compound treatment 45063.8298 -590000.0 -2.72 64288.8889 -504000.0 -2.67 -3.8139 -1.0 ICBGEx1_000446 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E07 compound treatment 497913.5135 -137000.0 -0.63 446395.3488 -122000.0 -0.65 -0.9041 -0.9999 ICBGEx1_000447 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E08 compound treatment 141543.8596 -493000.0 -2.27 98603.1746 -470000.0 -2.49 -3.3705 -0.9989 ICBGEx1_000448 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E09 compound treatment 339207.9208 -295000.0 -1.36 553213.4146 -15400.0 -0.08 -1.021 -0.7482 ICBGEx1_000449 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E10 compound treatment 610222.9299 -24400.0 -0.11 517397.8495 -51200.0 -0.27 -0.2715 -0.9237 ICBGEx1_000450 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E11 compound treatment 486817.5182 -148000.0 -0.68 600553.3981 31900.0 0.17 -0.3621 -0.5156 ICBGEx1_000451 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E12 compound treatment 566375.8865 -68200.0 -0.31 493937.8531 -74700.0 -0.4 -0.5025 -0.9935 ICBGEx1_000452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E13 compound treatment 650310.8808 15700.0 0.07 493500.0 -75100.0 -0.4 -0.2304 -0.5691 ICBGEx1_000453 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E14 compound treatment 377575.5814 -257000.0 -1.19 553180.6167 -15400.0 -0.08 -0.896 -0.7541 ICBGEx1_000454 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E15 compound treatment 541048.583 -93500.0 -0.43 470336.3229 -98300.0 -0.52 -0.6736 -0.9956 ICBGEx1_000455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E16 compound treatment 456858.4071 -178000.0 -0.82 436532.2581 -132000.0 -0.7 -1.0749 -0.9969 ICBGEx1_000456 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E17 compound treatment 577007.0922 -57600.0 -0.27 591022.3881 22400.0 0.12 -0.1037 -0.3565 ICBGEx1_000457 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E18 compound treatment 332844.1558 -302000.0 -1.39 251592.5926 -317000.0 -1.68 -2.1729 -0.9956 ICBGEx1_000458 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E19 compound treatment 651035.2113 16400.0 0.08 575695.6522 7080.0 0.04 0.0802 0.9475 ICBGEx1_000459 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E20 compound treatment 509530.6122 -125000.0 -0.58 408936.1702 -160000.0 -0.85 -1.0067 -0.9825 ICBGEx1_000460 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E21 compound treatment 564055.2995 -70500.0 -0.33 526741.2281 -41900.0 -0.22 -0.387 -0.9827 ICBGEx1_000461 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E22 compound treatment 527380.1653 -107000.0 -0.49 533458.3333 -35200.0 -0.19 -0.4814 -0.9111 ICBGEx1_000462 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E23 mock treatment 599248.503 -35300.0 -0.16 543122.5806 -25500.0 -0.14 -0.2108 -0.9957 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 E24 mock treatment 550215.3846 -84400.0 -0.39 729905.618 161000.0 0.86 0.3298 0.3509 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F01 compound treatment 385260.274 -249000.0 -1.15 389366.4596 -179000.0 -0.95 -1.4853 -0.9955 ICBGEx1_000463 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F02 compound treatment 471558.4416 -163000.0 -0.75 479920.6349 -88700.0 -0.47 -0.8643 -0.9745 ICBGEx1_000464 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F03 compound treatment 71596.1539 -563000.0 -2.6 71642.8571 -497000.0 -2.64 -3.6998 -1.0 ICBGEx1_000465 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F04 compound treatment 433122.6994 -201000.0 -0.93 255600.0 -313000.0 -1.66 -1.8309 -0.9624 ICBGEx1_000466 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F05 compound treatment 497135.1351 -137000.0 -0.63 441417.7778 -127000.0 -0.67 -0.9253 -0.9995 ICBGEx1_000467 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F06 compound treatment 65959.1837 -569000.0 -2.62 58215.6863 -510000.0 -2.71 -3.7685 -0.9999 ICBGEx1_000468 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F07 compound treatment 545631.3131 -89000.0 -0.41 655833.91 87200.0 0.46 0.037 0.0599 ICBGEx1_000469 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F08 compound treatment 460432.6531 -174000.0 -0.8 513391.3043 -55200.0 -0.29 -0.775 -0.9066 ICBGEx1_000470 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F09 compound treatment 504020.4082 -131000.0 -0.6 508666.6667 -59900.0 -0.32 -0.6506 -0.9555 ICBGEx1_000471 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F10 compound treatment 508887.0968 -126000.0 -0.58 601276.1194 32700.0 0.17 -0.2874 -0.475 ICBGEx1_000472 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F11 compound treatment 562590.4059 -72000.0 -0.33 530657.0397 -38000.0 -0.2 -0.3771 -0.9713 ICBGEx1_000473 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F12 compound treatment 546144.4867 -88400.0 -0.41 632962.6866 64400.0 0.34 -0.0471 -0.0885 ICBGEx1_000474 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F13 compound treatment 513254.902 -121000.0 -0.56 502453.4161 -66200.0 -0.35 -0.6438 -0.9747 ICBGEx1_000475 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F14 compound treatment 523130.2817 -111000.0 -0.51 511730.7692 -56900.0 -0.3 -0.5768 -0.9678 ICBGEx1_000476 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F15 compound treatment 655121.7391 20500.0 0.09 554285.7143 -14300.0 -0.08 0.0132 0.1089 ICBGEx1_000477 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F16 compound treatment 551930.5556 -82700.0 -0.38 517260.6383 -51400.0 -0.27 -0.4621 -0.9864 ICBGEx1_000478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F17 compound treatment 334238.806 -300000.0 -1.39 460870.6897 -108000.0 -0.57 -1.3835 -0.9233 ICBGEx1_000479 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F18 compound treatment 365553.0726 -269000.0 -1.24 420721.6495 -148000.0 -0.78 -1.432 -0.9755 ICBGEx1_000480 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F19 compound treatment 419992.5651 -215000.0 -0.99 446909.465 -122000.0 -0.65 -1.1562 -0.9786 ICBGEx1_000481 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F20 compound treatment 542824.0741 -91800.0 -0.42 578575.4717 9960.0 0.05 -0.2619 -0.614 ICBGEx1_000482 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F21 compound treatment 519624.2236 -115000.0 -0.53 535496.6887 -33100.0 -0.18 -0.4991 -0.8936 ICBGEx1_000483 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F22 compound treatment 516708.6093 -118000.0 -0.54 446151.8987 -122000.0 -0.65 -0.8437 -0.9961 ICBGEx1_000484 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F23 mock treatment 529613.5135 -105000.0 -0.48 650772.6098 82200.0 0.44 -0.0342 -0.0525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 F24 mock treatment 573767.1233 -60800.0 -0.28 547085.3242 -21500.0 -0.11 -0.2791 -0.9215 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G01 compound treatment 458621.4689 -176000.0 -0.81 588017.094 19400.0 0.1 -0.501 -0.6125 ICBGEx1_000485 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G02 compound treatment 390062.5 -245000.0 -1.13 366178.1609 -202000.0 -1.07 -1.5566 -0.9997 ICBGEx1_000486 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G03 compound treatment 444116.4021 -190000.0 -0.88 432396.9849 -136000.0 -0.72 -1.132 -0.9953 ICBGEx1_000487 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G04 compound treatment 483142.8571 -151000.0 -0.7 508080.1887 -60500.0 -0.32 -0.7209 -0.9378 ICBGEx1_000488 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G05 compound treatment 430688.7417 -204000.0 -0.94 598598.4848 30000.0 0.16 -0.5524 -0.5793 ICBGEx1_000489 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G06 compound treatment 505203.8217 -129000.0 -0.6 471551.0204 -97100.0 -0.51 -0.7859 -0.9973 ICBGEx1_000490 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G07 compound treatment 385815.7895 -249000.0 -1.15 464520.4678 -104000.0 -0.55 -1.2016 -0.9438 ICBGEx1_000491 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G08 compound treatment 446831.4607 -188000.0 -0.87 450361.9632 -118000.0 -0.63 -1.0558 -0.9875 ICBGEx1_000492 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G09 compound treatment 481704.0816 -153000.0 -0.71 437363.0952 -131000.0 -0.7 -0.9908 -1.0 ICBGEx1_000493 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G10 compound treatment 68282.6087 -566000.0 -2.61 81541.6667 -487000.0 -2.58 -3.6734 -1.0 ICBGEx1_000494 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G11 compound treatment 443762.3318 -191000.0 -0.88 543225.6637 -25400.0 -0.13 -0.7175 -0.8059 ICBGEx1_000495 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G12 compound treatment 577791.6667 -56800.0 -0.26 494722.2222 -73900.0 -0.39 -0.4623 -0.9808 ICBGEx1_000496 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G13 compound treatment 534688.4058 -99900.0 -0.46 562168.0 -6440.0 -0.03 -0.3499 -0.7575 ICBGEx1_000497 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G14 compound treatment 492072.3982 -143000.0 -0.66 578624.1135 10000.0 0.05 -0.4272 -0.6479 ICBGEx1_000498 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G15 compound treatment 399762.5 -235000.0 -1.08 484331.8386 -84300.0 -0.45 -1.0818 -0.9234 ICBGEx1_000499 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G16 compound treatment 313360.5442 -321000.0 -1.48 424397.0588 -144000.0 -0.76 -1.5884 -0.9527 ICBGEx1_000500 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G17 compound treatment 414165.8986 -220000.0 -1.02 558470.0 -10100.0 -0.05 -0.7568 -0.7435 ICBGEx1_000501 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G18 compound treatment 391260.8696 -243000.0 -1.12 451582.8571 -117000.0 -0.62 -1.2324 -0.961 ICBGEx1_000502 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G19 compound treatment 567141.3043 -67400.0 -0.31 462187.7256 -106000.0 -0.56 -0.6191 -0.9606 ICBGEx1_000503 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G20 compound treatment 454707.2072 -180000.0 -0.83 536383.7209 -32200.0 -0.17 -0.7075 -0.8353 ICBGEx1_000504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G21 compound treatment 360557.4468 -274000.0 -1.26 407746.988 -161000.0 -0.85 -1.4969 -0.9817 ICBGEx1_000505 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G22 compound treatment 499207.9208 -135000.0 -0.62 411142.8571 -157000.0 -0.84 -1.0321 -0.9897 ICBGEx1_000506 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G23 mock treatment 624346.049 -10200.0 -0.05 483764.4788 -84800.0 -0.45 -0.3516 -0.7771 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 G24 mock treatment 540940.367 -93700.0 -0.43 470901.2346 -97700.0 -0.52 -0.6718 -0.9959 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H01 compound treatment 282042.735 -353000.0 -1.63 221783.0189 -347000.0 -1.84 -2.4504 -0.9981 ICBGEx1_000507 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H02 compound treatment 494589.4737 -140000.0 -0.65 454308.5106 -114000.0 -0.61 -0.8852 -0.9995 ICBGEx1_000508 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H03 compound treatment 787798.3871 153000.0 0.71 766233.9623 198000.0 1.05 1.2408 0.9816 ICBGEx1_000509 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H04 compound treatment 365595.0413 -269000.0 -1.24 519713.0045 -48900.0 -0.26 -1.0606 -0.8369 ICBGEx1_000510 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H05 compound treatment 446552.8455 -188000.0 -0.87 461378.1095 -107000.0 -0.57 -1.0154 -0.9791 ICBGEx1_000511 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H06 compound treatment 566089.3617 -68500.0 -0.32 728653.9924 160000.0 0.85 0.3769 0.4161 ICBGEx1_000512 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H07 compound treatment 509202.2472 -125000.0 -0.58 733093.633 164000.0 0.87 0.208 0.1987 ICBGEx1_000513 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H08 compound treatment 440706.9767 -194000.0 -0.89 578542.735 9930.0 0.05 -0.595 -0.6643 ICBGEx1_000514 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H09 compound treatment 440020.0 -195000.0 -0.9 433167.7852 -135000.0 -0.72 -1.1425 -0.9939 ICBGEx1_000515 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H10 compound treatment 510232.7586 -124000.0 -0.57 467455.1724 -101000.0 -0.54 -0.7849 -0.9994 ICBGEx1_000516 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H11 compound treatment 443503.3557 -191000.0 -0.88 465894.7368 -103000.0 -0.54 -1.0084 -0.9733 ICBGEx1_000517 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H12 compound treatment 517869.9187 -117000.0 -0.54 475677.6557 -92900.0 -0.49 -0.7292 -0.999 ICBGEx1_000518 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H13 compound treatment 535910.0 -98700.0 -0.46 477172.1311 -91400.0 -0.48 -0.6647 -0.9995 ICBGEx1_000519 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H14 compound treatment 507055.794 -128000.0 -0.59 479975.1773 -88600.0 -0.47 -0.7483 -0.9938 ICBGEx1_000520 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H15 compound treatment 219110.2941 -415000.0 -1.92 272691.358 -296000.0 -1.57 -2.4647 -0.9951 ICBGEx1_000521 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H16 compound treatment 457073.8255 -178000.0 -0.82 477349.3151 -91300.0 -0.48 -0.9211 -0.9686 ICBGEx1_000522 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H17 compound treatment 468050.5051 -167000.0 -0.77 474823.5294 -93800.0 -0.5 -0.8948 -0.9779 ICBGEx1_000523 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H18 compound treatment 529930.6569 -105000.0 -0.48 452487.2881 -116000.0 -0.62 -0.7768 -0.9927 ICBGEx1_000524 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H19 compound treatment 634561.8375 -28.7 0.0 633462.1514 64900.0 0.34 0.2431 0.7068 ICBGEx1_000525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H20 compound treatment 498873.8739 -136000.0 -0.63 455053.0303 -114000.0 -0.6 -0.8685 -0.9998 ICBGEx1_000526 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H21 compound treatment 481486.5772 -153000.0 -0.71 431213.2867 -137000.0 -0.73 -1.0146 -0.9999 ICBGEx1_000527 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H22 compound treatment 561000.0 -73600.0 -0.34 519604.1667 -49000.0 -0.26 -0.4238 -0.9913 ICBGEx1_000528 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H23 mock treatment 545365.4971 -89200.0 -0.41 444250.0 -124000.0 -0.66 -0.7574 -0.9742 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 H24 mock treatment 586890.0 -47700.0 -0.22 660235.1598 91600.0 0.49 0.1881 0.3526 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I01 compound treatment 330010.989 -305000.0 -1.4 275516.9492 -293000.0 -1.55 -2.0925 -0.9987 ICBGEx1_000529 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I02 compound treatment 362487.1795 -272000.0 -1.25 311419.7531 -257000.0 -1.36 -1.8519 -0.9991 ICBGEx1_000530 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I03 compound treatment 425638.5542 -209000.0 -0.96 389635.8696 -179000.0 -0.95 -1.3526 -1.0 ICBGEx1_000531 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I04 compound treatment 467476.1905 -167000.0 -0.77 524276.1905 -44300.0 -0.24 -0.7112 -0.8827 ICBGEx1_000532 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I05 compound treatment 604622.807 -30000.0 -0.14 535646.3415 -33000.0 -0.17 -0.2214 -0.9932 ICBGEx1_000533 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I06 compound treatment 550705.8824 -83900.0 -0.39 728454.5455 160000.0 0.85 0.3259 0.3498 ICBGEx1_000534 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I07 compound treatment 607075.2688 -27500.0 -0.13 576356.383 7740.0 0.04 -0.0607 -0.455 ICBGEx1_000535 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I08 compound treatment 424857.1429 -210000.0 -0.97 493465.2778 -75100.0 -0.4 -0.9658 -0.9232 ICBGEx1_000536 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I09 compound treatment 196041.0959 -439000.0 -2.02 570539.5683 1930.0 0.01 -1.4228 -0.7035 ICBGEx1_000537 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I10 compound treatment 381367.5676 -253000.0 -1.17 621478.4946 52900.0 0.28 -0.6275 -0.5225 ICBGEx1_000538 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I11 compound treatment 275603.2609 -359000.0 -1.66 556158.6538 -12500.0 -0.07 -1.2173 -0.7347 ICBGEx1_000539 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I12 compound treatment 328855.615 -306000.0 -1.41 510746.9388 -57900.0 -0.31 -1.214 -0.8413 ICBGEx1_000540 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I13 compound treatment 594075.8929 -40500.0 -0.19 630788.7931 62200.0 0.33 0.1011 0.2667 ICBGEx1_000541 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I14 compound treatment 540621.7949 -94000.0 -0.43 541566.1376 -27000.0 -0.14 -0.4079 -0.8935 ICBGEx1_000542 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I15 compound treatment 537430.1676 -97200.0 -0.45 492789.2377 -75800.0 -0.4 -0.6012 -0.9985 ICBGEx1_000543 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I16 compound treatment 393000.0 -242000.0 -1.11 655413.4615 86800.0 0.46 -0.4623 -0.3835 ICBGEx1_000544 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I17 compound treatment 412220.8333 -222000.0 -1.03 595965.7795 27400.0 0.15 -0.6225 -0.6011 ICBGEx1_000545 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I18 compound treatment 561439.3064 -73200.0 -0.34 563758.9744 -4850.0 -0.03 -0.2567 -0.7589 ICBGEx1_000546 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I19 compound treatment 626900.0 -7690.0 -0.04 547886.9863 -20700.0 -0.11 -0.1028 -0.8901 ICBGEx1_000547 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I20 compound treatment 480620.1923 -154000.0 -0.71 579010.7527 10400.0 0.06 -0.4631 -0.6502 ICBGEx1_000548 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I21 compound treatment 539615.942 -95000.0 -0.44 521973.4513 -46600.0 -0.25 -0.4846 -0.9634 ICBGEx1_000549 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I22 compound treatment 547604.5752 -87000.0 -0.4 644503.4965 75900.0 0.4 0.001 0.0017 ICBGEx1_000550 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I23 mock treatment 632444.4444 -2150.0 -0.01 466647.482 -102000.0 -0.54 -0.3894 -0.7199 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 I24 mock treatment 789987.3096 155000.0 0.72 1007978.365 439000.0 2.33 2.1546 0.8837 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J01 compound treatment 293829.7872 -341000.0 -1.57 420576.6423 -148000.0 -0.79 -1.6664 -0.9486 ICBGEx1_000551 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J02 compound treatment 442583.3333 -192000.0 -0.89 570301.0753 1690.0 0.01 -0.6198 -0.6999 ICBGEx1_000552 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J03 compound treatment 406276.4706 -228000.0 -1.05 433787.234 -135000.0 -0.72 -1.2502 -0.9822 ICBGEx1_000553 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J04 compound treatment 686088.2353 51500.0 0.24 630144.9814 61500.0 0.33 0.3987 0.9878 ICBGEx1_000554 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J05 compound treatment 462153.2258 -172000.0 -0.8 537448.7805 -31200.0 -0.17 -0.6792 -0.8362 ICBGEx1_000555 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J06 compound treatment 540302.1583 -94300.0 -0.43 588240.2235 19600.0 0.1 -0.2339 -0.523 ICBGEx1_000556 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J07 compound treatment 641369.0476 6780.0 0.03 636800.0 68200.0 0.36 0.2778 0.7654 ICBGEx1_000557 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J08 compound treatment 488877.193 -146000.0 -0.67 688004.329 119000.0 0.63 -0.0274 -0.0297 ICBGEx1_000558 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J09 compound treatment 218728.2609 -416000.0 -1.92 278000.0 -291000.0 -1.54 -2.446 -0.9941 ICBGEx1_000559 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J10 compound treatment 454204.0816 -180000.0 -0.83 630143.4109 61500.0 0.33 -0.3575 -0.4 ICBGEx1_000560 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J11 compound treatment 572294.5736 -62300.0 -0.29 612675.4386 44100.0 0.23 -0.0379 -0.1023 ICBGEx1_000561 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J12 compound treatment 507993.921 -127000.0 -0.58 604611.5108 36000.0 0.19 -0.2778 -0.4523 ICBGEx1_000562 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J13 compound treatment 482069.9301 -153000.0 -0.7 576854.9223 8240.0 0.04 -0.4664 -0.6619 ICBGEx1_000563 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J14 compound treatment 567223.2143 -67400.0 -0.31 467315.4362 -101000.0 -0.54 -0.5996 -0.9661 ICBGEx1_000564 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J15 compound treatment 499532.1101 -135000.0 -0.62 461885.5932 -107000.0 -0.57 -0.8407 -0.9989 ICBGEx1_000565 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J16 compound treatment 436775.5102 -198000.0 -0.91 584166.0079 15600.0 0.08 -0.5867 -0.6405 ICBGEx1_000566 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J17 compound treatment 536878.1726 -97700.0 -0.45 587763.5135 19200.0 0.1 -0.2468 -0.5343 ICBGEx1_000567 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J18 compound treatment 599466.9421 -35100.0 -0.16 500401.5748 -68200.0 -0.36 -0.3704 -0.9343 ICBGEx1_000568 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J19 compound treatment 482226.5372 -152000.0 -0.7 546408.0882 -22200.0 -0.12 -0.5801 -0.8143 ICBGEx1_000569 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J20 compound treatment 369987.7301 -265000.0 -1.22 568949.1525 337.0 0.0 -0.8616 -0.7061 ICBGEx1_000570 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J21 compound treatment 525964.9682 -109000.0 -0.5 510448.6692 -58200.0 -0.31 -0.5724 -0.9729 ICBGEx1_000571 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J22 compound treatment 535434.555 -99200.0 -0.46 503711.8644 -64900.0 -0.34 -0.5667 -0.9902 ICBGEx1_000572 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J23 mock treatment 682662.6506 48100.0 0.22 499776.9784 -68800.0 -0.37 -0.1014 -0.2374 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 J24 mock treatment 535951.5152 -98600.0 -0.45 470098.9011 -98500.0 -0.52 -0.6911 -0.9976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K01 compound treatment 738723.6842 104000.0 0.48 677617.284 109000.0 0.58 0.7484 0.9957 ICBGEx1_000573 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K02 compound treatment 798471.9626 164000.0 0.76 605965.5172 37400.0 0.2 0.6745 0.8633 ICBGEx1_000574 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K03 compound treatment 704593.3014 70000.0 0.32 569300.9259 689.0 0.0 0.2309 0.7151 ICBGEx1_000575 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K04 compound treatment 471583.3333 -163000.0 -0.75 556020.7254 -12600.0 -0.07 -0.5788 -0.7669 ICBGEx1_000576 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K05 compound treatment 385485.7143 -249000.0 -1.15 466970.0599 -102000.0 -0.54 -1.1935 -0.9405 ICBGEx1_000577 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K06 compound treatment 417217.9487 -217000.0 -1.0 486639.5349 -82000.0 -0.43 -1.0163 -0.9301 ICBGEx1_000578 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K07 compound treatment 924806.4516 290000.0 1.34 521563.3803 -47000.0 -0.25 0.7699 0.5655 ICBGEx1_000579 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K08 compound treatment 152969.697 -482000.0 -2.22 567646.0905 -966.0 -0.01 -1.5742 -0.7087 ICBGEx1_000580 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K09 compound treatment 527507.3171 -107000.0 -0.49 523995.6897 -44600.0 -0.24 -0.5165 -0.9432 ICBGEx1_000581 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K10 compound treatment 711149.8127 76600.0 0.35 611480.2632 42900.0 0.23 0.4104 0.9773 ICBGEx1_000582 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K11 compound treatment 377243.9024 -257000.0 -1.19 327300.0 -241000.0 -1.28 -1.7442 -0.9993 ICBGEx1_000583 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K12 compound treatment 379815.6682 -255000.0 -1.17 551389.0909 -17200.0 -0.09 -0.8954 -0.7598 ICBGEx1_000584 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K13 compound treatment 432282.3529 -202000.0 -0.93 518975.9036 -49600.0 -0.26 -0.8459 -0.8726 ICBGEx1_000585 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K14 compound treatment 183727.2727 -451000.0 -2.08 139343.75 -429000.0 -2.28 -3.0802 -0.999 ICBGEx1_000586 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K15 compound treatment 585103.4483 -49500.0 -0.23 610100.6711 41500.0 0.22 -0.0058 -0.0182 ICBGEx1_000587 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K16 compound treatment 61428.5714 -573000.0 -2.64 349622.5166 -219000.0 -1.16 -2.6904 -0.9318 ICBGEx1_000588 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K17 compound treatment 595715.4472 -38900.0 -0.18 665062.069 96400.0 0.51 0.235 0.4335 ICBGEx1_000589 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K18 compound treatment 538557.377 -96000.0 -0.44 622730.2905 54100.0 0.29 -0.1102 -0.2088 ICBGEx1_000590 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K19 compound treatment 460274.5098 -174000.0 -0.8 505227.4368 -63400.0 -0.34 -0.8062 -0.9252 ICBGEx1_000591 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K20 compound treatment 586732.7586 -47900.0 -0.22 630330.9609 61700.0 0.33 0.0754 0.191 ICBGEx1_000592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K21 compound treatment 507187.5 -127000.0 -0.59 496196.4286 -72400.0 -0.38 -0.687 -0.9788 ICBGEx1_000593 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K22 compound treatment 546976.1905 -87600.0 -0.4 453285.7143 -115000.0 -0.61 -0.7182 -0.9797 ICBGEx1_000594 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K23 mock treatment 662861.7363 28300.0 0.13 602819.8529 34200.0 0.18 0.2205 0.9869 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 K24 mock treatment 640097.9021 5510.0 0.03 746115.8392 178000.0 0.94 0.6837 0.7259 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L01 compound treatment 438527.5591 -196000.0 -0.9 469135.9223 -99500.0 -0.53 -1.0124 -0.9671 ICBGEx1_000595 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L02 compound treatment 555590.0 -79000.0 -0.36 650310.3448 81700.0 0.43 0.0488 0.0862 ICBGEx1_000596 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L03 compound treatment 532577.9817 -102000.0 -0.47 588214.2857 19600.0 0.1 -0.2591 -0.5379 ICBGEx1_000597 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L04 compound treatment 608383.8384 -26200.0 -0.12 644027.3438 75400.0 0.4 0.1974 0.4724 ICBGEx1_000598 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L05 compound treatment 465709.6774 -169000.0 -0.78 606482.7586 37900.0 0.2 -0.4087 -0.5081 ICBGEx1_000599 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L06 compound treatment 825057.6923 190000.0 0.88 593894.1176 25300.0 0.13 0.7159 0.8057 ICBGEx1_000600 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L07 compound treatment 417750.0 -217000.0 -1.0 555239.3822 -13400.0 -0.07 -0.7573 -0.7554 ICBGEx1_000601 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L08 compound treatment 732823.9437 98200.0 0.45 802700.3891 234000.0 1.24 1.1983 0.9066 ICBGEx1_000602 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L09 compound treatment 628573.5294 -6020.0 -0.03 680244.5415 112000.0 0.59 0.3991 0.6732 ICBGEx1_000603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L10 compound treatment 601799.0431 -32800.0 -0.15 547704.5455 -20900.0 -0.11 -0.1853 -0.9884 ICBGEx1_000604 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L11 compound treatment 653866.6667 19300.0 0.09 591689.6552 23100.0 0.12 0.1494 0.9877 ICBGEx1_000605 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L12 compound treatment 758967.3913 124000.0 0.57 752391.7526 184000.0 0.97 1.0948 0.968 ICBGEx1_000606 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L13 compound treatment 366711.1111 -268000.0 -1.24 591290.4564 22700.0 0.12 -0.7885 -0.6353 ICBGEx1_000607 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L14 compound treatment 605289.2562 -29300.0 -0.14 570165.0943 1550.0 0.01 -0.0897 -0.6628 ICBGEx1_000608 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L15 compound treatment 605826.9231 -28800.0 -0.13 698969.697 130000.0 0.69 0.3951 0.5612 ICBGEx1_000609 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L16 compound treatment 672146.789 37600.0 0.17 623621.9512 55000.0 0.29 0.3288 0.969 ICBGEx1_000610 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L17 compound treatment 584023.6486 -50600.0 -0.23 557582.4561 -11000.0 -0.06 -0.2063 -0.8579 ICBGEx1_000611 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L18 compound treatment 521433.8843 -113000.0 -0.52 670401.9608 102000.0 0.54 0.0128 0.017 ICBGEx1_000612 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L19 compound treatment 683862.069 49300.0 0.23 666647.8405 98000.0 0.52 0.5284 0.9311 ICBGEx1_000613 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L20 compound treatment 491994.012 -143000.0 -0.66 427522.8426 -141000.0 -0.75 -0.9941 -0.9979 ICBGEx1_000614 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L21 compound treatment 543981.7518 -90600.0 -0.42 610177.2152 41600.0 0.22 -0.1396 -0.2954 ICBGEx1_000615 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L22 compound treatment 487946.0432 -147000.0 -0.68 578617.0213 10000.0 0.05 -0.4407 -0.6496 ICBGEx1_000616 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L23 mock treatment 538565.625 -96000.0 -0.44 585928.0576 17300.0 0.09 -0.2482 -0.5488 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 L24 mock treatment 522407.8014 -112000.0 -0.52 555297.7099 -13300.0 -0.07 -0.4158 -0.7962 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M01 compound treatment 597871.5596 -36700.0 -0.17 566431.3725 -2180.0 -0.01 -0.1279 -0.7537 ICBGEx1_000617 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M02 compound treatment 309053.0303 -326000.0 -1.5 414298.5075 -154000.0 -0.82 -1.6403 -0.9593 ICBGEx1_000618 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M03 compound treatment 610759.1241 -23800.0 -0.11 638845.7143 70200.0 0.37 0.1857 0.4781 ICBGEx1_000619 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M04 compound treatment 629471.2644 -5120.0 -0.02 364468.75 -204000.0 -1.08 -0.7823 -0.7224 ICBGEx1_000620 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M05 compound treatment 430179.7753 -204000.0 -0.94 531408.4507 -37200.0 -0.2 -0.8061 -0.837 ICBGEx1_000621 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M06 compound treatment 153485.7143 -481000.0 -2.22 334297.2973 -234000.0 -1.24 -2.4476 -0.9625 ICBGEx1_000622 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M07 compound treatment 441754.491 -193000.0 -0.89 454480.6867 -114000.0 -0.61 -1.0569 -0.9824 ICBGEx1_000623 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M08 compound treatment 380654.321 -254000.0 -1.17 436031.0559 -133000.0 -0.7 -1.3253 -0.9702 ICBGEx1_000624 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M09 compound treatment 500044.4444 -135000.0 -0.62 758570.1357 190000.0 1.01 0.2737 0.2313 ICBGEx1_000625 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M10 compound treatment 302939.8496 -332000.0 -1.53 550891.5663 -17700.0 -0.09 -1.1479 -0.7491 ICBGEx1_000626 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M11 compound treatment 337205.4795 -297000.0 -1.37 490417.6471 -78200.0 -0.41 -1.263 -0.8815 ICBGEx1_000627 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M12 compound treatment 259794.8718 -375000.0 -1.73 480586.9565 -88000.0 -0.47 -1.5523 -0.867 ICBGEx1_000628 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M13 compound treatment 439914.2857 -195000.0 -0.9 597033.9806 28400.0 0.15 -0.5282 -0.5803 ICBGEx1_000629 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M14 compound treatment 575245.098 -59300.0 -0.27 394000.0 -175000.0 -0.93 -0.8484 -0.8785 ICBGEx1_000630 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M15 compound treatment 523016.0 -112000.0 -0.51 576038.4615 7430.0 0.04 -0.336 -0.6511 ICBGEx1_000631 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M16 compound treatment 469929.4118 -165000.0 -0.76 448856.1151 -120000.0 -0.64 -0.9861 -0.9961 ICBGEx1_000632 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M17 compound treatment 493282.0513 -141000.0 -0.65 563899.5434 -4710.0 -0.02 -0.4785 -0.7337 ICBGEx1_000633 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M18 compound treatment 527549.6183 -107000.0 -0.49 454514.7929 -114000.0 -0.61 -0.777 -0.9949 ICBGEx1_000634 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M19 compound treatment 595039.3701 -39600.0 -0.18 500044.2804 -68600.0 -0.36 -0.3861 -0.9491 ICBGEx1_000635 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M20 compound treatment 554637.3626 -80000.0 -0.37 517854.902 -50800.0 -0.27 -0.4511 -0.9881 ICBGEx1_000636 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M21 compound treatment 701775.5102 67200.0 0.31 528670.9957 -39900.0 -0.21 0.0693 0.1846 ICBGEx1_000637 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M22 compound treatment 524559.5855 -110000.0 -0.51 411604.1667 -157000.0 -0.83 -0.9477 -0.9718 ICBGEx1_000638 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M23 mock treatment 514861.1111 -120000.0 -0.55 541426.9663 -27200.0 -0.14 -0.4924 -0.8628 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 M24 mock treatment 777250.5747 143000.0 0.66 476955.7522 -91700.0 -0.49 0.1214 0.1485 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N01 compound treatment 395857.1429 -239000.0 -1.1 329254.2373 -239000.0 -1.27 -1.6762 -0.9975 ICBGEx1_000639 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N02 compound treatment 547325.3968 -87300.0 -0.4 534050.4202 -34600.0 -0.18 -0.4142 -0.9366 ICBGEx1_000640 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N03 compound treatment 310336.6337 -324000.0 -1.5 268829.0598 -300000.0 -1.59 -2.1817 -0.9995 ICBGEx1_000641 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N04 compound treatment 381466.6667 -253000.0 -1.17 459744.856 -109000.0 -0.58 -1.2337 -0.9473 ICBGEx1_000642 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N05 compound treatment 433585.5856 -201000.0 -0.93 686759.1837 118000.0 0.63 -0.2124 -0.1898 ICBGEx1_000643 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N06 compound treatment 539030.7692 -95600.0 -0.44 726542.5101 158000.0 0.84 0.2807 0.2966 ICBGEx1_000644 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N07 compound treatment 348946.8085 -286000.0 -1.32 598186.6029 29600.0 0.16 -0.8205 -0.6185 ICBGEx1_000645 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N08 compound treatment 678792.0792 44200.0 0.2 522239.0244 -46400.0 -0.25 -0.0298 -0.0932 ICBGEx1_000646 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N09 compound treatment 282797.9798 -352000.0 -1.62 207494.1176 -361000.0 -1.92 -2.5015 -0.9966 ICBGEx1_000647 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N10 compound treatment 670887.4459 36300.0 0.17 709635.6589 141000.0 0.75 0.6473 0.8445 ICBGEx1_000648 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N11 compound treatment 329630.9524 -305000.0 -1.41 299593.4959 -269000.0 -1.43 -2.0034 -1.0 ICBGEx1_000649 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N12 compound treatment 610508.1301 -24100.0 -0.11 594145.9854 25500.0 0.14 0.0172 0.0984 ICBGEx1_000650 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N13 compound treatment 522888.8889 -112000.0 -0.52 444603.5503 -124000.0 -0.66 -0.8293 -0.9927 ICBGEx1_000651 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N14 compound treatment 398654.2553 -236000.0 -1.09 574717.6471 6110.0 0.03 -0.7465 -0.6858 ICBGEx1_000652 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N15 compound treatment 1088168.831 454000.0 2.09 1007443.038 439000.0 2.33 3.1249 0.9986 ICBGEx1_000653 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N16 compound treatment 203218.75 -431000.0 -1.99 445805.1948 -123000.0 -0.65 -1.8673 -0.892 ICBGEx1_000654 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N17 compound treatment 304751.8248 -330000.0 -1.52 393258.6207 -175000.0 -0.93 -1.7332 -0.9721 ICBGEx1_000655 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N18 compound treatment 325493.6709 -309000.0 -1.43 426209.0395 -142000.0 -0.76 -1.542 -0.9559 ICBGEx1_000656 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N19 compound treatment 69886.3636 -565000.0 -2.6 101021.2766 -468000.0 -2.48 -3.5951 -0.9997 ICBGEx1_000657 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N20 compound treatment 672354.8387 37800.0 0.17 724059.2105 155000.0 0.82 0.7061 0.838 ICBGEx1_000658 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N21 compound treatment 661865.3846 27300.0 0.13 688312.2924 120000.0 0.63 0.5379 0.831 ICBGEx1_000659 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N22 compound treatment 428369.7479 -206000.0 -0.95 350586.9565 -218000.0 -1.16 -1.4902 -0.9953 ICBGEx1_000660 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N23 mock treatment 937004.4843 302000.0 1.39 473354.9488 -95300.0 -0.51 0.6289 0.424 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 N24 mock treatment 822670.4545 188000.0 0.87 485874.4589 -82700.0 -0.44 0.303 0.3117 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O01 compound treatment 385916.0305 -249000.0 -1.15 321933.8843 -247000.0 -1.31 -1.7361 -0.9978 ICBGEx1_000661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O02 compound treatment 644347.8261 9760.0 0.04 596185.9504 27600.0 0.15 0.1352 0.8838 ICBGEx1_000662 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O03 compound treatment 527807.1066 -107000.0 -0.49 368596.2441 -200000.0 -1.06 -1.0984 -0.9391 ICBGEx1_000663 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O04 compound treatment 74043.4783 -561000.0 -2.59 66425.5319 -502000.0 -2.66 -3.7113 -0.9999 ICBGEx1_000664 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O05 compound treatment 564209.3023 -70400.0 -0.32 418761.0619 -150000.0 -0.79 -0.7915 -0.922 ICBGEx1_000665 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O06 compound treatment 339439.0244 -295000.0 -1.36 460804.878 -108000.0 -0.57 -1.3668 -0.9258 ICBGEx1_000666 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O07 compound treatment 695461.039 60900.0 0.28 680341.1765 112000.0 0.59 0.6175 0.9417 ICBGEx1_000667 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O08 compound treatment 405621.3018 -229000.0 -1.06 403372.093 -165000.0 -0.88 -1.3664 -0.9957 ICBGEx1_000668 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O09 compound treatment 404268.0412 -230000.0 -1.06 485357.1429 -83300.0 -0.44 -1.0633 -0.9244 ICBGEx1_000669 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O10 compound treatment 353901.2346 -281000.0 -1.29 313808.3333 -255000.0 -1.35 -1.8709 -0.9998 ICBGEx1_000670 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O11 compound treatment 60055.5556 -575000.0 -2.65 64603.4483 -504000.0 -2.67 -3.7638 -1.0 ICBGEx1_000671 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O12 compound treatment 103225.8065 -531000.0 -2.45 91507.4627 -477000.0 -2.53 -3.5221 -0.9999 ICBGEx1_000672 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O13 compound treatment 429680.0 -205000.0 -0.94 460154.2056 -108000.0 -0.58 -1.075 -0.9717 ICBGEx1_000673 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O14 compound treatment 303684.9315 -331000.0 -1.53 344671.4286 -224000.0 -1.19 -1.9189 -0.9923 ICBGEx1_000674 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O15 compound treatment 509386.1386 -125000.0 -0.58 567121.7712 -1490.0 -0.01 -0.4139 -0.7167 ICBGEx1_000675 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O16 compound treatment 381864.1975 -253000.0 -1.17 402911.1111 -166000.0 -0.88 -1.4456 -0.9903 ICBGEx1_000676 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O17 compound treatment 604141.8919 -30400.0 -0.14 579675.5319 11100.0 0.06 -0.0578 -0.3798 ICBGEx1_000677 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O18 compound treatment 421000.0 -214000.0 -0.99 416397.5904 -152000.0 -0.81 -1.2674 -0.9951 ICBGEx1_000678 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O19 compound treatment 493621.9512 -141000.0 -0.65 398252.381 -170000.0 -0.9 -1.0986 -0.987 ICBGEx1_000679 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O20 compound treatment 595208.3333 -39400.0 -0.18 520652.9412 -48000.0 -0.25 -0.3083 -0.9864 ICBGEx1_000680 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O21 compound treatment 694536.0825 59900.0 0.28 513854.5455 -54800.0 -0.29 -0.0099 -0.0247 ICBGEx1_000681 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O22 compound treatment 380397.5155 -254000.0 -1.17 519561.7021 -49100.0 -0.26 -1.0129 -0.8435 ICBGEx1_000682 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O23 mock treatment 897623.7864 263000.0 1.21 509885.906 -58700.0 -0.31 0.6375 0.509 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 O24 mock treatment 833821.6704 199000.0 0.92 483676.9912 -84900.0 -0.45 0.3311 0.3236 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P01 compound treatment 532402.1739 -102000.0 -0.47 620532.6087 51900.0 0.28 -0.1385 -0.2537 ICBGEx1_000683 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P02 compound treatment 389540.2299 -245000.0 -1.13 282112.1495 -286000.0 -1.52 -1.8736 -0.9894 ICBGEx1_000684 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P03 compound treatment 172844.1558 -462000.0 -2.13 177933.3333 -391000.0 -2.07 -2.971 -0.9999 ICBGEx1_000685 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P04 compound treatment 603868.6869 -30700.0 -0.14 412991.8699 -156000.0 -0.83 -0.6838 -0.8165 ICBGEx1_000686 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P05 compound treatment 469394.3662 -165000.0 -0.76 587526.3158 18900.0 0.1 -0.4678 -0.6087 ICBGEx1_000687 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P06 compound treatment 569946.5241 -64600.0 -0.3 430265.4321 -138000.0 -0.73 -0.7297 -0.9213 ICBGEx1_000688 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P07 compound treatment 361220.339 -273000.0 -1.26 300812.5 -268000.0 -1.42 -1.8958 -0.9982 ICBGEx1_000689 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P08 compound treatment 502629.1667 -132000.0 -0.61 476462.8821 -92100.0 -0.49 -0.7759 -0.9941 ICBGEx1_000690 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P09 compound treatment 166791.6667 -468000.0 -2.16 173452.0548 -395000.0 -2.1 -3.0075 -0.9999 ICBGEx1_000691 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P10 compound treatment 530199.1342 -104000.0 -0.48 554156.9507 -14500.0 -0.08 -0.3946 -0.8095 ICBGEx1_000692 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P11 compound treatment 624654.4118 -9940.0 -0.05 448754.717 -120000.0 -0.64 -0.4819 -0.7561 ICBGEx1_000693 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P12 compound treatment 517120.0 -117000.0 -0.54 526226.9231 -42400.0 -0.22 -0.542 -0.9241 ICBGEx1_000694 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P13 compound treatment 428931.3725 -206000.0 -0.95 586800.0 18200.0 0.1 -0.6024 -0.6319 ICBGEx1_000695 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P14 compound treatment 325171.4286 -309000.0 -1.43 319860.2151 -249000.0 -1.32 -1.9419 -0.9992 ICBGEx1_000696 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P15 compound treatment 399653.0612 -235000.0 -1.08 402119.171 -166000.0 -0.88 -1.3905 -0.9948 ICBGEx1_000697 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P16 compound treatment 463544.4015 -171000.0 -0.79 512381.5789 -56200.0 -0.3 -0.7687 -0.9115 ICBGEx1_000698 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P17 compound treatment 378853.3333 -256000.0 -1.18 424443.2624 -144000.0 -0.76 -1.3746 -0.978 ICBGEx1_000699 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P18 compound treatment 293102.0408 -341000.0 -1.57 297201.581 -271000.0 -1.44 -2.1315 -0.999 ICBGEx1_000700 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P19 compound treatment 461745.8333 -173000.0 -0.8 326149.2537 -242000.0 -1.29 -1.473 -0.9735 ICBGEx1_000701 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P20 compound treatment 364168.8312 -270000.0 -1.25 417643.5185 -151000.0 -0.8 -1.448 -0.9771 ICBGEx1_000702 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P21 compound treatment 470953.5714 -164000.0 -0.75 438524.7148 -130000.0 -0.69 -1.0215 -0.999 ICBGEx1_000703 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P22 compound treatment 334990.8676 -300000.0 -1.38 326754.3103 -242000.0 -1.28 -1.8841 -0.9993 ICBGEx1_000704 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P23 mock treatment 729436.7089 94800.0 0.44 754527.3109 186000.0 0.99 1.0066 0.9331 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1454 P24 mock treatment 753297.7778 119000.0 0.55 825110.6095 256000.0 1.36 1.3491 0.92 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A01 compound treatment 428175.0 -306000.0 -1.41 308905.4726 -342000.0 -1.82 -2.2815 -0.9922 ICBGEx1_000705 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A02 compound treatment 551403.2258 -183000.0 -0.84 550934.3434 -100000.0 -0.53 -0.9719 -0.9755 ICBGEx1_000706 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A03 compound treatment 703782.3529 -30300.0 -0.14 673043.2099 21800.0 0.12 -0.0171 -0.0942 ICBGEx1_000707 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A04 compound treatment 558720.4301 -175000.0 -0.81 429592.3913 -222000.0 -1.18 -1.4032 -0.9833 ICBGEx1_000708 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A05 compound treatment 619431.8182 -115000.0 -0.53 649174.7573 -2090.0 -0.01 -0.3817 -0.7218 ICBGEx1_000709 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A06 compound treatment 600207.4468 -134000.0 -0.62 685590.3614 34300.0 0.18 -0.3078 -0.4782 ICBGEx1_000710 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A07 compound treatment 621321.9512 -113000.0 -0.52 589637.2093 -61600.0 -0.33 -0.5988 -0.975 ICBGEx1_000711 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A08 compound treatment 411402.6846 -323000.0 -1.49 527208.0537 -124000.0 -0.66 -1.5175 -0.9327 ICBGEx1_000712 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A09 compound treatment 520429.2683 -214000.0 -0.99 588802.6316 -62500.0 -0.33 -0.9309 -0.8956 ICBGEx1_000713 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A10 compound treatment 711951.6908 -22100.0 -0.1 705541.4634 54300.0 0.29 0.1314 0.4304 ICBGEx1_000714 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A11 mock treatment 1082829.201 349000.0 1.61 1232953.488 582000.0 3.09 3.3189 0.9539 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A12 mock treatment 1165326.87 431000.0 1.99 1146748.603 495000.0 2.63 3.2646 0.9906 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A13 mock treatment 1154597.101 421000.0 1.94 937549.5751 286000.0 1.52 2.445 0.9927 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A14 mock treatment 1097304.478 363000.0 1.68 1285676.647 634000.0 3.36 3.5638 0.9481 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A15 mock treatment 1110671.159 377000.0 1.74 1225461.326 574000.0 3.05 3.3816 0.9645 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A16 mock treatment 1061378.866 327000.0 1.51 1046908.309 396000.0 2.1 2.5512 0.9869 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A17 mock treatment 1177487.871 443000.0 2.04 917220.0 266000.0 1.41 2.4434 0.9836 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A18 mock treatment 933651.6854 200000.0 0.92 1209907.821 559000.0 2.96 2.746 0.885 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A19 mock treatment 1129328.691 395000.0 1.82 858128.3422 207000.0 1.1 2.0648 0.9705 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A20 mock treatment 1132202.186 398000.0 1.84 1209351.648 558000.0 2.96 3.3914 0.9736 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A21 mock treatment 1134430.769 400000.0 1.85 1031912.234 381000.0 2.02 2.7332 0.999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A22 mock treatment 897227.9793 163000.0 0.75 891537.2751 240000.0 1.27 1.4332 0.9684 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A23 mock treatment 822647.3552 88600.0 0.41 961352.3316 310000.0 1.64 1.4518 0.8567 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 A24 mock treatment 882903.0612 149000.0 0.69 750258.7065 99000.0 0.53 0.8566 0.9912 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B01 compound treatment 512932.9268 -221000.0 -1.02 458952.6627 -192000.0 -1.02 -1.4424 -1.0 ICBGEx1_000715 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B02 compound treatment 596581.8182 -137000.0 -0.63 553800.0 -97500.0 -0.52 -0.8139 -0.9949 ICBGEx1_000716 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B03 compound treatment 762466.3677 28400.0 0.13 694395.7447 43100.0 0.23 0.2544 0.965 ICBGEx1_000717 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B04 compound treatment 432932.0388 -301000.0 -1.39 340224.7191 -311000.0 -1.65 -2.1485 -0.9963 ICBGEx1_000718 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B05 compound treatment 710351.7588 -23700.0 -0.11 841837.5635 191000.0 1.01 0.6374 0.6269 ICBGEx1_000719 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B06 compound treatment 447736.1111 -286000.0 -1.32 499759.8039 -152000.0 -0.8 -1.5019 -0.9716 ICBGEx1_000720 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B07 compound treatment 440034.8837 -294000.0 -1.36 501072.9167 -150000.0 -0.8 -1.5221 -0.9679 ICBGEx1_000721 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B08 compound treatment 546550.4587 -188000.0 -0.86 483435.7143 -168000.0 -0.89 -1.2409 -0.9999 ICBGEx1_000722 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B09 compound treatment 588855.4913 -145000.0 -0.67 468972.973 -182000.0 -0.97 -1.1572 -0.9839 ICBGEx1_000723 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B10 compound treatment 643958.7156 -90100.0 -0.42 779669.7674 128000.0 0.68 0.1877 0.2353 ICBGEx1_000724 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B11 mock treatment 1132300.0 398000.0 1.84 1157333.333 506000.0 2.68 3.1966 0.9829 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B12 mock treatment 1170892.128 437000.0 2.01 1083638.418 432000.0 2.29 3.0461 0.9979 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B13 mock treatment 1177145.349 443000.0 2.04 972752.2388 321000.0 1.71 2.6506 0.996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B14 mock treatment 912800.578 179000.0 0.82 841460.8939 190000.0 1.01 1.2962 0.995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B15 mock treatment 1001168.937 267000.0 1.23 1169671.348 518000.0 2.75 2.8153 0.9344 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B16 mock treatment 1048791.123 315000.0 1.45 971103.352 320000.0 1.7 2.2258 0.997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B17 mock treatment 1122469.169 388000.0 1.79 947332.4324 296000.0 1.57 2.3769 0.9978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B18 mock treatment 1084692.958 351000.0 1.62 1079639.205 428000.0 2.27 2.75 0.9861 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B19 mock treatment 1133775.132 400000.0 1.84 992366.3912 341000.0 1.81 2.5827 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B20 mock treatment 1100060.274 366000.0 1.69 998883.2891 348000.0 1.84 2.4972 0.999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B21 mock treatment 1053630.435 320000.0 1.47 672093.4579 20800.0 0.11 1.1202 0.758 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B22 mock treatment 898078.8804 164000.0 0.76 640721.7391 -10500.0 -0.06 0.4953 0.653 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B23 mock treatment 519235.2941 -215000.0 -0.99 1038010.178 387000.0 2.05 0.7499 0.3292 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 B24 mock treatment 939533.6788 205000.0 0.95 840382.9268 189000.0 1.0 1.3793 0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C01 compound treatment 614338.1643 -120000.0 -0.55 627909.0909 -23400.0 -0.12 -0.478 -0.8448 ICBGEx1_000725 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C02 compound treatment 464877.9343 -269000.0 -1.24 506861.4719 -144000.0 -0.77 -1.4194 -0.9731 ICBGEx1_000726 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C03 compound treatment 563890.0 -170000.0 -0.78 661785.4077 10500.0 0.06 -0.5155 -0.6552 ICBGEx1_000727 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C04 compound treatment 707651.8219 -26400.0 -0.12 714191.9643 62900.0 0.33 0.1499 0.4218 ICBGEx1_000728 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C05 compound treatment 656451.6129 -77600.0 -0.36 714018.7793 62800.0 0.33 -0.0177 -0.0363 ICBGEx1_000729 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C06 compound treatment 594017.9641 -140000.0 -0.65 532120.7729 -119000.0 -0.63 -0.9035 -0.9999 ICBGEx1_000730 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C07 compound treatment 544247.0588 -190000.0 -0.88 558137.931 -93100.0 -0.49 -0.9683 -0.9633 ICBGEx1_000731 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C08 compound treatment 695628.692 -38400.0 -0.18 608821.8623 -42400.0 -0.23 -0.2845 -0.993 ICBGEx1_000732 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C09 compound treatment 513508.1967 -221000.0 -1.02 636022.3464 -15200.0 -0.08 -0.7764 -0.7609 ICBGEx1_000733 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C10 compound treatment 446207.5472 -288000.0 -1.33 459257.1429 -192000.0 -1.02 -1.6588 -0.9914 ICBGEx1_000734 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C11 mock treatment 1014349.854 280000.0 1.29 705308.0 54000.0 0.29 1.1167 0.8434 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C12 mock treatment 961090.9091 227000.0 1.05 758814.1593 108000.0 0.57 1.1437 0.9592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C13 mock treatment 969205.6075 235000.0 1.08 609802.4194 -41500.0 -0.22 0.6113 0.5525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C14 mock treatment 810332.2148 76300.0 0.35 621686.9565 -29600.0 -0.16 0.1378 0.3577 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C15 mock treatment 1061174.387 327000.0 1.51 692383.9662 41100.0 0.22 1.2209 0.801 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C16 mock treatment 1160292.398 426000.0 1.97 935180.9524 284000.0 1.51 2.4547 0.9913 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C17 mock treatment 752503.876 18400.0 0.09 712378.0488 61100.0 0.32 0.2893 0.8634 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C18 mock treatment 820687.1166 86600.0 0.4 531180.6167 -120000.0 -0.64 -0.1679 -0.2233 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C19 mock treatment 1031348.442 297000.0 1.37 1097306.18 446000.0 2.37 2.6423 0.9663 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C20 mock treatment 1018311.178 284000.0 1.31 637640.0 -13600.0 -0.07 0.8758 0.6671 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C21 mock treatment 868408.9636 134000.0 0.62 612574.1445 -38700.0 -0.21 0.293 0.4489 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C22 mock treatment 861873.1563 128000.0 0.59 580626.3736 -70600.0 -0.37 0.1518 0.2174 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C23 mock treatment 816432.133 82400.0 0.38 684721.1268 33500.0 0.18 0.3941 0.9399 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 C24 mock treatment 888773.0871 155000.0 0.71 628873.6462 -22400.0 -0.12 0.4205 0.5814 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D01 compound treatment 836888.8889 103000.0 0.47 625654.5455 -25600.0 -0.14 0.2392 0.485 ICBGEx1_000735 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D02 compound treatment 604434.7826 -130000.0 -0.6 531815.9509 -119000.0 -0.63 -0.8707 -0.9996 ICBGEx1_000736 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D03 compound treatment 411511.7647 -323000.0 -1.49 561397.9592 -89900.0 -0.48 -1.3889 -0.8892 ICBGEx1_000737 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D04 compound treatment 497966.2447 -236000.0 -1.09 469956.6929 -181000.0 -0.96 -1.4499 -0.9981 ICBGEx1_000738 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D05 compound treatment 625674.3295 -108000.0 -0.5 494261.0837 -157000.0 -0.83 -0.9423 -0.9702 ICBGEx1_000739 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D06 compound treatment 579098.7654 -155000.0 -0.71 611229.0076 -40000.0 -0.21 -0.6555 -0.8792 ICBGEx1_000740 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D07 compound treatment 566123.0769 -168000.0 -0.77 713948.0519 62700.0 0.33 -0.3126 -0.3708 ICBGEx1_000741 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D08 compound treatment 723267.8571 -10800.0 -0.05 672956.7901 21700.0 0.12 0.0461 0.3681 ICBGEx1_000742 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D09 compound treatment 213024.6914 -521000.0 -2.4 608781.0651 -42500.0 -0.23 -1.8584 -0.77 ICBGEx1_000743 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D10 compound treatment 526356.4356 -208000.0 -0.96 597242.3208 -54000.0 -0.29 -0.8799 -0.8801 ICBGEx1_000744 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D11 mock treatment 808694.7368 74600.0 0.34 697383.8028 46100.0 0.24 0.4163 0.986 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D12 mock treatment 632677.7108 -101000.0 -0.47 668212.5 16900.0 0.09 -0.2671 -0.5609 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D13 mock treatment 650362.9032 -83700.0 -0.39 704472.2222 53200.0 0.28 -0.0734 -0.1535 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D14 mock treatment 764835.1648 30800.0 0.14 743023.3463 91800.0 0.49 0.4445 0.8768 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D15 mock treatment 905431.5476 171000.0 0.79 676014.2349 24700.0 0.13 0.6516 0.8134 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D16 mock treatment 1099542.553 365000.0 1.69 827060.0 176000.0 0.93 1.8511 0.961 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D17 mock treatment 1154505.025 420000.0 1.94 1078105.911 427000.0 2.26 2.9719 0.997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D18 mock treatment 710251.7241 -23800.0 -0.11 705086.3787 53800.0 0.29 0.1242 0.4061 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D19 mock treatment 660452.8302 -73600.0 -0.34 579600.6711 -71700.0 -0.38 -0.5088 -0.9984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D20 mock treatment 937184.4156 203000.0 0.94 564980.4688 -86300.0 -0.46 0.3387 0.3249 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D21 mock treatment 583295.6204 -151000.0 -0.7 650764.7059 -502.0 0.0 -0.4935 -0.7098 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D22 mock treatment 785272.9529 51200.0 0.24 635981.4126 -15300.0 -0.08 0.1097 0.4392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D23 mock treatment 707994.9239 -26100.0 -0.12 566755.814 -84500.0 -0.45 -0.402 -0.8661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 D24 mock treatment 600207.3864 -134000.0 -0.62 598690.3915 -52600.0 -0.28 -0.6337 -0.9355 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E01 compound treatment 457448.9796 -277000.0 -1.28 438873.0159 -212000.0 -1.13 -1.6986 -0.9981 ICBGEx1_000745 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E02 compound treatment 645787.1287 -88300.0 -0.41 679980.3922 28700.0 0.15 -0.1802 -0.4145 ICBGEx1_000746 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E03 compound treatment 640130.2083 -93900.0 -0.43 484755.2083 -167000.0 -0.88 -0.9308 -0.9462 ICBGEx1_000747 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E04 compound treatment 733743.3628 -321.0 0.0 773199.2188 122000.0 0.65 0.4563 0.7055 ICBGEx1_000748 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E05 compound treatment 666596.9388 -67500.0 -0.31 665331.5508 14100.0 0.07 -0.1673 -0.5227 ICBGEx1_000749 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E06 compound treatment 621358.4071 -113000.0 -0.52 564245.6897 -87000.0 -0.46 -0.6939 -0.9982 ICBGEx1_000750 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E07 compound treatment 417593.0233 -316000.0 -1.46 652655.3672 1390.0 0.01 -1.0268 -0.7035 ICBGEx1_000751 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E08 compound treatment 483845.4545 -250000.0 -1.15 639794.3262 -11500.0 -0.06 -0.859 -0.7434 ICBGEx1_000752 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E09 compound treatment 777598.4252 43500.0 0.2 784489.1775 133000.0 0.71 0.6416 0.8734 ICBGEx1_000753 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E10 compound treatment 732592.1788 -1470.0 -0.01 573829.4574 -77400.0 -0.41 -0.2952 -0.7187 ICBGEx1_000754 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E11 mock treatment 721227.9412 -12800.0 -0.06 740770.2703 89500.0 0.47 0.2938 0.6142 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E12 mock treatment 920222.2222 186000.0 0.86 1075155.0 424000.0 2.25 2.1968 0.9128 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E13 mock treatment 771777.7778 37700.0 0.17 801559.387 150000.0 0.8 0.6867 0.8416 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E14 mock treatment 731819.2771 -2250.0 -0.01 704796.2264 53500.0 0.28 0.1934 0.6809 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E15 mock treatment 655042.2535 -79000.0 -0.36 770125.9542 119000.0 0.63 0.1881 0.2583 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E16 mock treatment 760918.9189 26900.0 0.12 734374.1259 83100.0 0.44 0.3993 0.872 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E17 mock treatment 798364.1975 64300.0 0.3 696320.1439 45100.0 0.24 0.3786 0.9943 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E18 mock treatment 708888.8889 -25200.0 -0.12 638642.6117 -12600.0 -0.07 -0.1294 -0.9658 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E19 mock treatment 726865.1316 -7200.0 -0.03 686057.4713 34800.0 0.18 0.107 0.5707 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E20 mock treatment 706873.8739 -27200.0 -0.13 680539.2491 29300.0 0.16 0.0211 0.1058 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E21 mock treatment 647665.5949 -86400.0 -0.4 601162.4549 -50100.0 -0.27 -0.4697 -0.9806 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E22 mock treatment 651849.6503 -82200.0 -0.38 710361.204 59100.0 0.31 -0.0465 -0.0945 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E23 mock treatment 682710.4377 -51400.0 -0.24 590051.1811 -61200.0 -0.32 -0.397 -0.988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 E24 mock treatment 672090.2778 -62000.0 -0.29 610237.4429 -41000.0 -0.22 -0.356 -0.991 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F01 compound treatment 509902.5641 -224000.0 -1.03 594486.1878 -56800.0 -0.3 -0.9439 -0.8767 ICBGEx1_000755 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F02 compound treatment 578304.0936 -156000.0 -0.72 560736.0 -90500.0 -0.48 -0.8475 -0.9808 ICBGEx1_000756 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F03 compound treatment 550132.2751 -184000.0 -0.85 498463.6872 -153000.0 -0.81 -1.1729 -0.9997 ICBGEx1_000757 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F04 compound treatment 531425.5319 -203000.0 -0.93 593795.4545 -57500.0 -0.3 -0.8763 -0.8915 ICBGEx1_000758 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F05 compound treatment 650000.0 -84100.0 -0.39 562950.0 -88300.0 -0.47 -0.6054 -0.9956 ICBGEx1_000759 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F06 compound treatment 650561.2648 -83500.0 -0.39 699995.7983 48700.0 0.26 -0.0895 -0.1931 ICBGEx1_000760 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F07 compound treatment 305125.0 -429000.0 -1.98 524453.9007 -127000.0 -0.67 -1.8743 -0.8971 ICBGEx1_000761 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F08 compound treatment 519260.0733 -215000.0 -0.99 519425.2874 -132000.0 -0.7 -1.1949 -0.9855 ICBGEx1_000762 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F09 compound treatment 460331.2883 -274000.0 -1.26 474164.2857 -177000.0 -0.94 -1.5568 -0.9894 ICBGEx1_000763 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F10 compound treatment 570830.8824 -163000.0 -0.75 507389.1626 -144000.0 -0.76 -1.0719 -1.0 ICBGEx1_000764 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F11 mock treatment 662755.7003 -71300.0 -0.33 715383.3333 64100.0 0.34 0.0079 0.0168 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F12 mock treatment 793178.0822 59100.0 0.27 671437.2624 20200.0 0.11 0.2684 0.9166 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F13 mock treatment 850886.0294 117000.0 0.54 635088.0282 -16200.0 -0.09 0.3203 0.5871 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F14 mock treatment 641741.784 -92300.0 -0.43 594981.1321 -56300.0 -0.3 -0.5122 -0.9849 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F15 mock treatment 733422.3827 -642.0 0.0 551649.4465 -99600.0 -0.53 -0.3757 -0.7111 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F16 mock treatment 742386.0759 8320.0 0.04 659691.7808 8430.0 0.04 0.0587 0.9971 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F17 mock treatment 660808.0495 -73300.0 -0.34 588387.3239 -62900.0 -0.33 -0.4747 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F18 mock treatment 620620.3704 -113000.0 -0.52 646177.0833 -5090.0 -0.03 -0.389 -0.7426 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F19 mock treatment 641116.6667 -92900.0 -0.43 489389.2405 -162000.0 -0.86 -0.9102 -0.9485 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F20 mock treatment 987925.9259 254000.0 1.17 968979.4344 318000.0 1.69 2.0194 0.9842 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F21 mock treatment 579326.4605 -155000.0 -0.71 553976.0479 -97300.0 -0.52 -0.8695 -0.9873 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F22 mock treatment 657398.2301 -76700.0 -0.35 562071.6612 -89200.0 -0.47 -0.5845 -0.9897 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F23 mock treatment 664963.4146 -69100.0 -0.32 593412.9693 -57900.0 -0.31 -0.4423 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 F24 mock treatment 592032.3887 -142000.0 -0.66 553109.0226 -98200.0 -0.52 -0.8313 -0.9935 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G01 compound treatment 425731.25 -308000.0 -1.42 382516.4835 -269000.0 -1.43 -2.0134 -1.0 ICBGEx1_000765 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G02 compound treatment 601932.1267 -132000.0 -0.61 606512.3153 -44800.0 -0.24 -0.5987 -0.9155 ICBGEx1_000766 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G03 compound treatment 742708.8608 8640.0 0.04 746619.5122 95400.0 0.51 0.3858 0.7605 ICBGEx1_000767 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G04 compound treatment 676145.0777 -57900.0 -0.27 666373.7864 15100.0 0.08 -0.1322 -0.4741 ICBGEx1_000768 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G05 compound treatment 559747.8261 -174000.0 -0.8 553153.8462 -98100.0 -0.52 -0.9364 -0.9778 ICBGEx1_000769 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G06 compound treatment 505005.5866 -229000.0 -1.06 584394.2857 -66900.0 -0.35 -0.9977 -0.8954 ICBGEx1_000770 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G07 compound treatment 464157.0681 -270000.0 -1.24 553062.5 -98200.0 -0.52 -1.2485 -0.9253 ICBGEx1_000771 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G08 compound treatment 459521.7391 -275000.0 -1.27 544548.8722 -107000.0 -0.57 -1.2955 -0.9341 ICBGEx1_000772 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G09 compound treatment 507285.0679 -227000.0 -1.05 671802.3715 20500.0 0.11 -0.6625 -0.6301 ICBGEx1_000773 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G10 compound treatment 657010.8108 -77100.0 -0.36 608773.913 -42500.0 -0.23 -0.4106 -0.9759 ICBGEx1_000774 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G11 mock treatment 598789.644 -135000.0 -0.62 588188.2845 -63100.0 -0.33 -0.6777 -0.9573 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G12 mock treatment 706489.726 -27600.0 -0.13 542955.3903 -108000.0 -0.57 -0.4961 -0.8432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G13 mock treatment 954148.3376 220000.0 1.01 872448.6216 221000.0 1.17 1.5472 0.9974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G14 mock treatment 552105.4852 -182000.0 -0.84 533463.8158 -118000.0 -0.62 -1.0352 -0.9895 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G15 mock treatment 659405.0633 -74700.0 -0.34 612645.6693 -38600.0 -0.2 -0.3883 -0.9692 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G16 mock treatment 724249.0421 -9820.0 -0.05 565188.4615 -86100.0 -0.46 -0.3548 -0.7734 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G17 mock treatment 533303.9216 -201000.0 -0.93 520231.0231 -131000.0 -0.7 -1.1461 -0.99 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G18 mock treatment 593542.0561 -141000.0 -0.65 473813.1148 -177000.0 -0.94 -1.1238 -0.9834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G19 mock treatment 661826.2195 -72200.0 -0.33 507216.73 -144000.0 -0.76 -0.7758 -0.9308 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G20 mock treatment 607748.1752 -126000.0 -0.58 566434.2105 -84800.0 -0.45 -0.7301 -0.9919 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G21 mock treatment 571952.2293 -162000.0 -0.75 490455.414 -161000.0 -0.85 -1.1318 -0.9978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G22 mock treatment 589416.6667 -145000.0 -0.67 516605.364 -135000.0 -0.71 -0.9767 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G23 mock treatment 613010.3093 -121000.0 -0.56 553543.6508 -97700.0 -0.52 -0.7613 -0.9993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 G24 mock treatment 524049.1071 -210000.0 -0.97 506536.2903 -145000.0 -0.77 -1.2277 -0.9934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H01 compound treatment 671388.664 -62700.0 -0.29 740084.1121 88800.0 0.47 0.1287 0.2329 ICBGEx1_000775 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H02 compound treatment 456165.0485 -278000.0 -1.28 440487.1795 -211000.0 -1.12 -1.6967 -0.9977 ICBGEx1_000776 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H03 compound treatment 487073.1707 -247000.0 -1.14 615376.1062 -35900.0 -0.19 -0.94 -0.814 ICBGEx1_000777 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H04 compound treatment 65339.6226 -669000.0 -3.08 65650.0 -586000.0 -3.11 -4.377 -1.0 ICBGEx1_000778 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H05 compound treatment 563713.5922 -170000.0 -0.79 612555.5556 -38700.0 -0.21 -0.7007 -0.8629 ICBGEx1_000779 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H06 compound treatment 75428.5714 -659000.0 -3.04 75296.2963 -576000.0 -3.05 -4.3079 -1.0 ICBGEx1_000780 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H07 compound treatment 542491.3793 -192000.0 -0.88 444367.7419 -207000.0 -1.1 -1.4007 -0.9942 ICBGEx1_000781 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H08 compound treatment 424004.6948 -310000.0 -1.43 439381.3953 -212000.0 -1.12 -1.8058 -0.9929 ICBGEx1_000782 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H09 compound treatment 364627.907 -369000.0 -1.7 516876.7773 -134000.0 -0.71 -1.7087 -0.9252 ICBGEx1_000783 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H10 compound treatment 187298.2456 -547000.0 -2.52 362478.8732 -289000.0 -1.53 -2.8661 -0.9715 ICBGEx1_000784 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H11 mock treatment 673280.9365 -60800.0 -0.28 558300.7813 -93000.0 -0.49 -0.5469 -0.9642 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H12 mock treatment 678634.5382 -55400.0 -0.26 640554.3478 -10700.0 -0.06 -0.2209 -0.8437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H13 mock treatment 646463.8783 -87600.0 -0.4 643758.0071 -7510.0 -0.04 -0.3138 -0.7731 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H14 mock treatment 615418.8034 -119000.0 -0.55 668183.391 16900.0 0.09 -0.3234 -0.5834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H15 mock treatment 934721.2714 201000.0 0.93 865409.8765 214000.0 1.14 1.4575 0.9948 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H16 mock treatment 491157.8947 -243000.0 -1.12 541658.4615 -110000.0 -0.58 -1.2032 -0.9533 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H17 mock treatment 825139.759 91100.0 0.42 833061.9048 182000.0 0.96 0.9788 0.9307 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H18 mock treatment 604010.3448 -130000.0 -0.6 499962.2642 -151000.0 -0.8 -0.9916 -0.9897 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H19 mock treatment 612622.3776 -121000.0 -0.56 548939.7163 -102000.0 -0.54 -0.7798 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H20 mock treatment 575720.7792 -158000.0 -0.73 558292.4901 -93000.0 -0.49 -0.865 -0.9817 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H21 mock treatment 526412.3989 -208000.0 -0.96 587065.0685 -64200.0 -0.34 -0.9179 -0.9031 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H22 mock treatment 578208.9136 -156000.0 -0.72 524929.3286 -126000.0 -0.67 -0.9821 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H23 mock treatment 623899.0228 -110000.0 -0.51 591003.3784 -60300.0 -0.32 -0.5853 -0.9751 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 H24 mock treatment 508769.5473 -225000.0 -1.04 523967.9715 -127000.0 -0.68 -1.2121 -0.9782 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I01 compound treatment 398214.2857 -336000.0 -1.55 398107.9545 -253000.0 -1.34 -2.0446 -0.9975 ICBGEx1_000785 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I02 compound treatment 612412.844 -122000.0 -0.56 657663.2124 6400.0 0.03 -0.3727 -0.6631 ICBGEx1_000786 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I03 compound treatment 533353.8462 -201000.0 -0.93 489097.2222 -162000.0 -0.86 -1.2627 -0.9993 ICBGEx1_000787 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I04 compound treatment 408313.9535 -326000.0 -1.5 354961.5385 -296000.0 -1.57 -2.1735 -0.9997 ICBGEx1_000788 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I05 compound treatment 613339.9015 -121000.0 -0.56 663593.4579 12300.0 0.07 -0.3474 -0.6198 ICBGEx1_000789 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I06 compound treatment 519031.9149 -215000.0 -0.99 606502.6178 -44800.0 -0.24 -0.8691 -0.8523 ICBGEx1_000790 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I07 compound treatment 572209.8765 -162000.0 -0.75 615585.1064 -35700.0 -0.19 -0.6616 -0.8592 ICBGEx1_000791 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I08 compound treatment 532176.4706 -202000.0 -0.93 596621.3018 -54600.0 -0.29 -0.8633 -0.8853 ICBGEx1_000792 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I09 compound treatment 539916.0305 -194000.0 -0.9 618440.7895 -32800.0 -0.17 -0.7562 -0.8291 ICBGEx1_000793 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I10 compound treatment 436075.1174 -298000.0 -1.37 628321.4286 -22900.0 -0.12 -1.0578 -0.7667 ICBGEx1_000794 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I11 mock treatment 694151.0791 -39900.0 -0.18 761803.2258 111000.0 0.59 0.2844 0.4628 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I12 mock treatment 634530.303 -99500.0 -0.46 692795.302 41500.0 0.22 -0.1688 -0.3316 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I13 mock treatment 691278.4314 -42800.0 -0.2 702277.2277 51000.0 0.27 0.0518 0.1547 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I14 mock treatment 566427.9476 -168000.0 -0.77 677679.6117 26400.0 0.14 -0.4476 -0.5697 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I15 mock treatment 687508.5324 -46600.0 -0.21 602621.6216 -48600.0 -0.26 -0.3343 -0.9958 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I16 mock treatment 612215.6134 -122000.0 -0.56 631299.6845 -20000.0 -0.11 -0.4722 -0.8258 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I17 mock treatment 546415.873 -188000.0 -0.87 662838.9058 11600.0 0.06 -0.5685 -0.6553 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I18 mock treatment 687218.9349 -46800.0 -0.22 594833.8109 -56400.0 -0.3 -0.3644 -0.9872 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I19 mock treatment 634444.8276 -99600.0 -0.46 603664.2066 -47600.0 -0.25 -0.5034 -0.9603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I20 mock treatment 607133.7386 -127000.0 -0.59 609070.2341 -42200.0 -0.22 -0.5722 -0.913 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I21 mock treatment 771116.3522 37100.0 0.17 677121.0191 25900.0 0.14 0.2178 0.9941 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I22 mock treatment 624872.0539 -109000.0 -0.5 639802.8169 -11500.0 -0.06 -0.3991 -0.7868 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I23 mock treatment 656150.0 -77900.0 -0.36 554916.9675 -96300.0 -0.51 -0.6154 -0.9851 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 I24 mock treatment 598603.3755 -135000.0 -0.62 526130.9524 -125000.0 -0.66 -0.911 -0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J01 compound treatment 647819.8198 -86200.0 -0.4 776658.0311 125000.0 0.67 0.189 0.2439 ICBGEx1_000795 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J02 compound treatment 260323.5294 -474000.0 -2.18 262772.1519 -388000.0 -2.06 -3.0019 -0.9996 ICBGEx1_000796 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J03 compound treatment 748605.3812 14500.0 0.07 672692.9134 21400.0 0.11 0.1278 0.9683 ICBGEx1_000797 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J04 compound treatment 149277.7778 -585000.0 -2.7 52686.5672 -599000.0 -3.17 -4.1519 -0.9967 ICBGEx1_000798 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J05 compound treatment 606372.449 -128000.0 -0.59 632052.356 -19200.0 -0.1 -0.4885 -0.8173 ICBGEx1_000799 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J06 compound treatment 568931.25 -165000.0 -0.76 608260.8696 -43000.0 -0.23 -0.6998 -0.8803 ICBGEx1_000800 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J07 compound treatment 702766.6667 -31300.0 -0.14 586840.4669 -64400.0 -0.34 -0.3437 -0.9265 ICBGEx1_000801 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J08 compound treatment 37464.2857 -697000.0 -3.21 67169.8113 -584000.0 -3.1 -4.4622 -0.9998 ICBGEx1_000802 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J09 compound treatment 543260.8696 -191000.0 -0.88 593630.0 -57600.0 -0.31 -0.8384 -0.9 ICBGEx1_000803 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J10 mock treatment 767551.2821 33500.0 0.15 614385.906 -36900.0 -0.2 -0.0291 -0.1169 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J11 mock treatment 813649.4465 79600.0 0.37 828203.8835 177000.0 0.94 0.9231 0.9161 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J12 mock treatment 736457.3171 2390.0 0.01 782601.1905 131000.0 0.7 0.5004 0.7182 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J13 mock treatment 598518.6567 -136000.0 -0.63 531200.0 -120000.0 -0.64 -0.8923 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J14 mock treatment 633212.2449 -101000.0 -0.47 583282.6087 -68000.0 -0.36 -0.5838 -0.9921 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J15 mock treatment 664895.8333 -69200.0 -0.32 642641.8919 -8620.0 -0.05 -0.2579 -0.8003 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J16 mock treatment 550801.9169 -183000.0 -0.85 549981.9495 -101000.0 -0.54 -0.9775 -0.9761 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J17 mock treatment 658071.8954 -76000.0 -0.35 666029.703 14800.0 0.08 -0.1924 -0.5359 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J18 mock treatment 590718.3099 -143000.0 -0.66 581827.5862 -69400.0 -0.37 -0.7279 -0.9619 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J19 mock treatment 600283.0769 -134000.0 -0.62 585792.7928 -65500.0 -0.35 -0.6818 -0.963 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J20 mock treatment 570509.7493 -164000.0 -0.75 525970.3264 -125000.0 -0.66 -1.0033 -0.998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J21 mock treatment 773626.943 39600.0 0.18 626666.6667 -24600.0 -0.13 0.0367 0.1638 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J22 mock treatment 744168.5083 10100.0 0.05 707155.1155 55900.0 0.3 0.2426 0.8083 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J23 mock treatment 656266.4756 -77800.0 -0.36 575338.8704 -75900.0 -0.4 -0.5385 -0.9983 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 J24 mock treatment 558854.0146 -175000.0 -0.81 519904.5802 -131000.0 -0.7 -1.064 -0.9973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K01 compound treatment 411782.8947 -322000.0 -1.49 483662.9213 -168000.0 -0.89 -1.6795 -0.9698 ICBGEx1_000804 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K02 compound treatment 539500.0 -195000.0 -0.9 682135.0211 30900.0 0.16 -0.5187 -0.5687 ICBGEx1_000805 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K03 compound treatment 746595.4545 12500.0 0.06 689142.1569 37900.0 0.2 0.1829 0.875 ICBGEx1_000806 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K04 compound treatment 624787.037 -109000.0 -0.5 640818.8976 -10400.0 -0.06 -0.3955 -0.7802 ICBGEx1_000807 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K05 compound treatment 508592.3567 -225000.0 -1.04 614539.8773 -36700.0 -0.19 -0.873 -0.8252 ICBGEx1_000808 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K06 compound treatment 511449.1018 -223000.0 -1.03 516443.8503 -135000.0 -0.72 -1.2316 -0.9844 ICBGEx1_000809 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K07 compound treatment 795428.5714 61400.0 0.28 813868.6869 163000.0 0.86 0.8099 0.8923 ICBGEx1_000810 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K08 compound treatment 674566.8016 -59500.0 -0.27 620557.7889 -30700.0 -0.16 -0.3092 -0.969 ICBGEx1_000811 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K09 mock treatment 965688.1443 232000.0 1.07 1083788.945 433000.0 2.29 2.3775 0.9395 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K10 mock treatment 675226.9231 -58800.0 -0.27 620716.9811 -30500.0 -0.16 -0.3064 -0.9696 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K11 mock treatment 911987.3737 178000.0 0.82 1027888.626 377000.0 2.0 1.9927 0.9227 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K12 mock treatment 645469.3878 -88600.0 -0.41 659985.1852 8720.0 0.05 -0.2562 -0.6231 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K13 mock treatment 616697.417 -117000.0 -0.54 703832.8358 52600.0 0.28 -0.1856 -0.3048 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K14 mock treatment 931140.7035 197000.0 0.91 968725.4902 317000.0 1.68 1.8333 0.9581 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K15 mock treatment 622825.9494 -111000.0 -0.51 582638.2979 -68600.0 -0.36 -0.6201 -0.9859 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K16 mock treatment 725407.4074 -8660.0 -0.04 616380.9524 -34900.0 -0.19 -0.1591 -0.8403 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K17 mock treatment 578865.0307 -155000.0 -0.72 665645.9016 14400.0 0.08 -0.4522 -0.6282 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K18 mock treatment 596752.8958 -137000.0 -0.63 627958.3333 -23300.0 -0.12 -0.5352 -0.8295 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K19 mock treatment 583211.8056 -151000.0 -0.7 564692.053 -86600.0 -0.46 -0.8166 -0.9797 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K20 mock treatment 565115.8301 -169000.0 -0.78 617487.5445 -33800.0 -0.18 -0.6776 -0.8476 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K21 mock treatment 585149.8471 -149000.0 -0.69 630074.7664 -21200.0 -0.11 -0.5651 -0.812 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K22 mock treatment 692743.9024 -41300.0 -0.19 639357.3668 -11900.0 -0.06 -0.1794 -0.8937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K23 mock treatment 774612.3779 40500.0 0.19 619915.1515 -31400.0 -0.17 0.0146 0.0585 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 K24 mock treatment 684889.3281 -49200.0 -0.23 555906.6148 -95400.0 -0.51 -0.518 -0.9345 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L01 compound treatment 659103.2258 -75000.0 -0.35 641422.0183 -9840.0 -0.05 -0.2814 -0.8048 ICBGEx1_000812 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L02 compound treatment 545146.2264 -189000.0 -0.87 557121.2121 -94100.0 -0.5 -0.9691 -0.9651 ICBGEx1_000813 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L03 compound treatment 537027.3224 -197000.0 -0.91 536541.4634 -115000.0 -0.61 -1.0728 -0.981 ICBGEx1_000814 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L04 compound treatment 487701.2195 -246000.0 -1.14 643754.0107 -7510.0 -0.04 -0.8315 -0.7315 ICBGEx1_000815 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L05 compound treatment 622786.802 -111000.0 -0.51 705542.0561 54300.0 0.29 -0.1593 -0.2707 ICBGEx1_000816 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L06 compound treatment 552336.0996 -182000.0 -0.84 587489.5833 -63800.0 -0.34 -0.8318 -0.9204 ICBGEx1_000817 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L07 compound treatment 565614.4578 -168000.0 -0.78 509992.0 -141000.0 -0.75 -1.0792 -0.9998 ICBGEx1_000818 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L08 compound treatment 651500.0 -82600.0 -0.38 704947.9167 53700.0 0.28 -0.0679 -0.1428 ICBGEx1_000819 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L09 mock treatment 766564.3154 32500.0 0.15 799911.1842 149000.0 0.79 0.6635 0.8267 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L10 mock treatment 763570.8155 29500.0 0.14 717758.8933 66500.0 0.35 0.3456 0.9142 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L11 mock treatment 799617.3285 65600.0 0.3 788326.7717 137000.0 0.73 0.7278 0.9244 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L12 mock treatment 716404.8583 -17700.0 -0.08 686044.0 34800.0 0.18 0.0728 0.3613 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L13 mock treatment 701435.1145 -32600.0 -0.15 615206.8966 -36100.0 -0.19 -0.2416 -0.993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L14 mock treatment 754905.7239 20800.0 0.1 793173.7705 142000.0 0.75 0.6002 0.791 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L15 mock treatment 733733.7884 -331.0 0.0 579590.4059 -71700.0 -0.38 -0.2699 -0.7099 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L16 mock treatment 636627.3063 -97400.0 -0.45 582335.7664 -68900.0 -0.37 -0.5763 -0.9948 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L17 mock treatment 671651.5679 -62400.0 -0.29 662142.8571 10900.0 0.06 -0.1627 -0.5544 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L18 mock treatment 634841.2698 -99200.0 -0.46 602241.7219 -49000.0 -0.26 -0.5074 -0.9641 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L19 mock treatment 947330.7692 213000.0 0.98 835403.794 184000.0 0.98 1.386 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L20 mock treatment 1051760.0 318000.0 1.47 1037034.568 386000.0 2.05 2.4828 0.9866 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L21 mock treatment 654305.4755 -79800.0 -0.37 674913.1653 23600.0 0.13 -0.1714 -0.4411 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L22 mock treatment 615992.1671 -118000.0 -0.54 540962.3824 -110000.0 -0.59 -0.7987 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L23 mock treatment 844324.3902 110000.0 0.51 614708.9783 -36600.0 -0.19 0.2224 0.4088 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 L24 mock treatment 689706.8404 -44400.0 -0.2 549315.9722 -102000.0 -0.54 -0.527 -0.9116 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M01 compound treatment 344139.1304 -390000.0 -1.8 341800.0 -309000.0 -1.64 -2.4322 -0.999 ICBGEx1_000820 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M02 compound treatment 829619.0476 95600.0 0.44 753018.9394 102000.0 0.54 0.6932 0.9949 ICBGEx1_000821 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M03 compound treatment 465023.6967 -269000.0 -1.24 603935.0 -47300.0 -0.25 -1.0548 -0.8333 ICBGEx1_000822 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M04 compound treatment 604482.7586 -130000.0 -0.6 636043.6893 -15200.0 -0.08 -0.4796 -0.7954 ICBGEx1_000823 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M05 compound treatment 683045.9184 -51000.0 -0.24 584446.281 -66800.0 -0.35 -0.417 -0.9802 ICBGEx1_000824 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M06 compound treatment 487072.9927 -247000.0 -1.14 502373.2394 -149000.0 -0.79 -1.3638 -0.984 ICBGEx1_000825 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M07 compound treatment 458711.2676 -275000.0 -1.27 406377.4834 -245000.0 -1.3 -1.8164 -0.9999 ICBGEx1_000826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M08 compound treatment 632358.8235 -102000.0 -0.47 552816.4557 -98500.0 -0.52 -0.7009 -0.9986 ICBGEx1_000827 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M09 mock treatment 883612.0907 150000.0 0.69 659518.2482 8250.0 0.04 0.5186 0.7505 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M10 mock treatment 692004.1322 -42100.0 -0.19 623982.8326 -27300.0 -0.14 -0.2395 -0.9896 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M11 mock treatment 640257.3529 -93800.0 -0.43 1086582.31 435000.0 2.31 1.3267 0.5648 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M12 mock treatment 655606.2176 -78500.0 -0.36 522389.3443 -129000.0 -0.68 -0.7392 -0.9558 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M13 mock treatment 599413.2231 -135000.0 -0.62 678444.0678 27200.0 0.14 -0.3372 -0.5289 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M14 mock treatment 584096.1538 -150000.0 -0.69 518265.0177 -133000.0 -0.71 -0.9879 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M15 mock treatment 611885.9935 -122000.0 -0.56 627030.888 -24200.0 -0.13 -0.4893 -0.8467 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M16 mock treatment 614884.058 -119000.0 -0.55 553739.4366 -97500.0 -0.52 -0.7544 -0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M17 mock treatment 557983.6601 -176000.0 -0.81 594626.6234 -56600.0 -0.3 -0.7866 -0.9085 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M18 mock treatment 511902.439 -222000.0 -1.02 520331.0345 -131000.0 -0.69 -1.2155 -0.9821 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M19 mock treatment 574010.101 -160000.0 -0.74 642049.505 -9220.0 -0.05 -0.5565 -0.7523 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M20 mock treatment 871841.4376 138000.0 0.64 546510.7914 -105000.0 -0.56 0.0564 0.0668 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M21 mock treatment 672366.8831 -61700.0 -0.28 563771.8631 -87500.0 -0.46 -0.5293 -0.9724 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M22 mock treatment 775666.6667 41600.0 0.19 571607.362 -79700.0 -0.42 -0.1631 -0.3515 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M23 mock treatment 667056.338 -67000.0 -0.31 499750.0 -152000.0 -0.8 -0.7868 -0.9138 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 M24 mock treatment 887125.0 153000.0 0.71 493060.9319 -158000.0 -0.84 -0.0942 -0.0859 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N01 compound treatment 583960.199 -150000.0 -0.69 459572.1393 -192000.0 -1.02 -1.2084 -0.9824 ICBGEx1_000828 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N02 compound treatment 427863.354 -306000.0 -1.41 561082.4176 -90200.0 -0.48 -1.3367 -0.8966 ICBGEx1_000829 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N03 compound treatment 830224.0 96200.0 0.44 757765.5502 106000.0 0.56 0.713 0.9928 ICBGEx1_000830 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N04 compound treatment 675278.1457 -58800.0 -0.27 657378.5714 6110.0 0.03 -0.1688 -0.6181 ICBGEx1_000831 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N05 compound treatment 536130.4348 -198000.0 -0.91 599558.8235 -51700.0 -0.27 -0.8394 -0.8807 ICBGEx1_000832 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N06 compound treatment 631109.1954 -103000.0 -0.47 628589.1892 -22700.0 -0.12 -0.4208 -0.8591 ICBGEx1_000833 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N07 compound treatment 267533.3333 -467000.0 -2.15 226243.9024 -425000.0 -2.25 -3.1154 -0.9997 ICBGEx1_000834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N08 compound treatment 445289.8551 -289000.0 -1.33 414101.4493 -237000.0 -1.26 -1.8312 -0.9996 ICBGEx1_000835 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N09 mock treatment 1143687.817 410000.0 1.89 1066307.692 415000.0 2.2 2.8924 0.9971 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N10 mock treatment 1124720.988 391000.0 1.8 1140039.604 489000.0 2.59 3.107 0.9842 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N11 mock treatment 720058.1395 -14000.0 -0.06 695156.6265 43900.0 0.23 0.1189 0.4923 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N12 mock treatment 643714.9321 -90300.0 -0.42 528136.5462 -123000.0 -0.65 -0.7564 -0.9764 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N13 mock treatment 581916.6667 -152000.0 -0.7 546674.5283 -105000.0 -0.55 -0.8884 -0.9932 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N14 mock treatment 596921.875 -137000.0 -0.63 651280.6324 14.1 0.0 -0.4472 -0.707 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N15 mock treatment 1033430.412 299000.0 1.38 950388.8889 299000.0 1.59 2.0981 0.9976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N16 mock treatment 625667.8967 -108000.0 -0.5 711184.5018 59900.0 0.32 -0.1288 -0.2174 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N17 mock treatment 698829.5455 -35200.0 -0.16 587352.6971 -63900.0 -0.34 -0.3546 -0.9433 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N18 mock treatment 587697.2112 -146000.0 -0.67 621564.5756 -29700.0 -0.16 -0.5887 -0.8493 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N19 mock treatment 651788.9273 -82300.0 -0.38 526870.1299 -124000.0 -0.66 -0.7348 -0.9655 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N20 mock treatment 847612.9032 114000.0 0.52 870665.8879 219000.0 1.16 1.1931 0.935 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N21 mock treatment 678883.9286 -55200.0 -0.25 484918.0328 -166000.0 -0.88 -0.8038 -0.8754 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N22 mock treatment 538421.9409 -196000.0 -0.9 556438.5965 -94800.0 -0.5 -0.9936 -0.9619 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N23 mock treatment 950263.1579 216000.0 1.0 494465.9091 -157000.0 -0.83 0.1169 0.0901 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 N24 mock treatment 534660.7774 -199000.0 -0.92 499816.4251 -151000.0 -0.8 -1.2183 -0.9977 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O01 compound treatment 464432.7485 -270000.0 -1.24 439061.7978 -212000.0 -1.13 -1.6751 -0.9988 ICBGEx1_000836 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O02 compound treatment 598652.968 -135000.0 -0.62 741359.0909 90100.0 0.48 -0.1037 -0.1318 ICBGEx1_000837 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O03 compound treatment 623676.7677 -110000.0 -0.51 641159.4828 -10100.0 -0.05 -0.3979 -0.7773 ICBGEx1_000838 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O04 compound treatment 478631.9444 -255000.0 -1.18 437516.3043 -214000.0 -1.13 -1.6346 -0.9998 ICBGEx1_000839 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O05 compound treatment 811324.1758 77300.0 0.36 716809.0452 65500.0 0.35 0.4978 0.9999 ICBGEx1_000840 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O06 compound treatment 501962.963 -232000.0 -1.07 486929.5775 -164000.0 -0.87 -1.3732 -0.9948 ICBGEx1_000841 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O07 compound treatment 549943.3962 -184000.0 -0.85 624077.2947 -27200.0 -0.14 -0.7024 -0.8155 ICBGEx1_000842 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O08 compound treatment 640098.7654 -94000.0 -0.43 547408.2569 -104000.0 -0.55 -0.6959 -0.9929 ICBGEx1_000843 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O09 mock treatment 955196.1326 221000.0 1.02 971214.2857 320000.0 1.7 1.9211 0.9703 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O10 mock treatment 645228.0702 -88800.0 -0.41 566211.3821 -85100.0 -0.45 -0.6087 -0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O11 mock treatment 953741.4248 220000.0 1.01 1116664.894 465000.0 2.47 2.4618 0.9226 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O12 mock treatment 851986.8421 118000.0 0.54 1080285.34 429000.0 2.28 1.9936 0.8521 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O13 mock treatment 918697.9167 185000.0 0.85 566555.5556 -84700.0 -0.45 0.2844 0.2954 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O14 mock treatment 909855.2279 176000.0 0.81 1071204.852 420000.0 2.23 2.1482 0.9063 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O15 mock treatment 997339.2405 263000.0 1.21 946157.4803 295000.0 1.56 1.9645 0.9922 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O16 mock treatment 856060.9137 122000.0 0.56 497059.322 -154000.0 -0.82 -0.1805 -0.1819 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O17 mock treatment 990388.601 256000.0 1.18 1083579.487 432000.0 2.29 2.4572 0.9525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O18 mock treatment 853728.9003 120000.0 0.55 771991.0913 121000.0 0.64 0.843 0.9973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O19 mock treatment 854092.3077 120000.0 0.55 1061740.741 410000.0 2.18 1.9309 0.8595 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O20 mock treatment 880787.8788 147000.0 0.68 898375.6219 247000.0 1.31 1.4052 0.9527 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O21 mock treatment 916637.2549 183000.0 0.84 874897.8102 224000.0 1.19 1.4341 0.9859 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O22 mock treatment 806188.1443 72100.0 0.33 585592.1053 -65700.0 -0.35 -0.0111 -0.0231 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O23 mock treatment 463970.339 -270000.0 -1.25 577727.5281 -73500.0 -0.39 -1.1566 -0.8861 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 O24 mock treatment 820017.199 86000.0 0.4 508009.7087 -143000.0 -0.76 -0.257 -0.2999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P01 compound treatment 649604.5455 -84500.0 -0.39 688485.0 37200.0 0.2 -0.1358 -0.3111 ICBGEx1_000844 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P02 compound treatment 487229.5082 -247000.0 -1.14 467520.2703 -184000.0 -0.97 -1.494 -0.997 ICBGEx1_000845 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P03 compound treatment 634981.3953 -99100.0 -0.46 643862.9032 -7400.0 -0.04 -0.3509 -0.7651 ICBGEx1_000846 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P04 compound treatment 576367.9245 -158000.0 -0.73 444156.8627 -207000.0 -1.1 -1.291 -0.9799 ICBGEx1_000847 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P05 compound treatment 293514.8515 -441000.0 -2.03 294208.7912 -357000.0 -1.89 -2.7757 -0.9994 ICBGEx1_000848 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P06 compound treatment 527927.4194 -206000.0 -0.95 541033.0579 -110000.0 -0.58 -1.0856 -0.9727 ICBGEx1_000849 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P07 compound treatment 274894.7368 -459000.0 -2.12 315931.8182 -335000.0 -1.78 -2.755 -0.9962 ICBGEx1_000850 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P08 compound treatment 552655.6291 -181000.0 -0.84 434116.129 -217000.0 -1.15 -1.406 -0.9877 ICBGEx1_000851 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P09 mock treatment 548258.9641 -186000.0 -0.86 564400.7634 -86900.0 -0.46 -0.9317 -0.9577 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P10 mock treatment 995184.2105 261000.0 1.2 931049.1803 280000.0 1.48 1.9008 0.9946 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P11 mock treatment 968649.2147 235000.0 1.08 856614.9871 205000.0 1.09 1.5351 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P12 mock treatment 961425.5875 227000.0 1.05 889089.4737 238000.0 1.26 1.6334 0.9958 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P13 mock treatment 905703.125 172000.0 0.79 864652.6316 213000.0 1.13 1.36 0.9847 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P14 mock treatment 993899.4845 260000.0 1.2 976800.578 326000.0 1.73 2.0682 0.9841 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P15 mock treatment 805866.6667 71800.0 0.33 825376.2626 174000.0 0.92 0.8871 0.9043 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P16 mock treatment 873243.2432 139000.0 0.64 860388.8889 209000.0 1.11 1.2382 0.9662 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P17 mock treatment 838782.2967 105000.0 0.48 814858.1731 164000.0 0.87 0.955 0.9617 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P18 mock treatment 968505.7737 234000.0 1.08 855268.2353 204000.0 1.08 1.5296 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P19 mock treatment 887610.3286 154000.0 0.71 908950.5882 258000.0 1.37 1.4671 0.9531 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P20 mock treatment 723914.9425 -10100.0 -0.05 1037218.527 386000.0 2.05 1.4144 0.6908 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P21 mock treatment 742107.7694 8040.0 0.04 858139.9083 207000.0 1.1 0.8021 0.7306 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P22 mock treatment 912779.3765 179000.0 0.82 747873.0512 96600.0 0.51 0.9451 0.9739 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P23 mock treatment 712150.8121 -21900.0 -0.1 393678.5714 -258000.0 -1.37 -1.0375 -0.7573 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1455 P24 mock treatment 781049.8812 47000.0 0.22 505481.4815 -146000.0 -0.77 -0.3935 -0.4901 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A01 compound treatment 621747.7477 60200.0 0.28 570915.2542 27500.0 0.15 0.2995 0.9547 1463 SMP1_000001 COc1ccc(cc1)c2cc(=O)c3c(O)cc(O)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A02 compound treatment 607764.3979 46300.0 0.21 519373.3333 -24100.0 -0.13 0.0606 0.2437 3414725 SMP1_000002 NC(C1CC(=NO1)Cl)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A03 compound treatment 678871.134 117000.0 0.54 610209.4017 66800.0 0.35 0.6331 0.9789 3414698 SMP1_000003 CCC1(O)CC(OC2CC(C(OC3CC(O)C(OC4CCC(=O)C(C)O4)C(C)O3)C(C)O2)N(C)C)c5c(O)c6C(=O)c7c(O)cccc7C(=O)c6cc5C1C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A04 compound treatment 660346.4912 98800.0 0.46 551757.5758 8320.0 0.04 0.3535 0.772 3198847 SMP1_000004 CCN1C[C@@]2(COC)C3[C@@H](OC)[C@H]4[C@@H]1[C@@]3(C5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)C5[C@]4(OC(=O)C)[C@@H](O)C6OC)C(C[C@H]2O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A05 compound treatment 619661.7647 58100.0 0.27 581336.4929 37900.0 0.2 0.3318 0.9899 329 SMP1_000005 CC(C)C1NC(=O)C(NC(=O)c2ccc(C)c3oc4c(C)c(=O)c(N)c(C(=O)NC5C(C)OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C6CCCN6C(=O)C(NC5=O)C(C)C)c4nc23)C(C)OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C7CCCN7C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A06 compound treatment 271612.4402 -290000.0 -1.34 302579.1855 -241000.0 -1.28 -1.8487 -0.9997 3414705 SMP1_000006 CCCCCC(CC(=O)NO)C(=O)NC(C(C)C)C(=O)N1CCCC1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A07 compound treatment 733792.4528 172000.0 0.79 524272.7273 -19200.0 -0.1 0.4899 0.6117 839 SMP1_000007 Nc1nc2n(COCCO)cnc2c(=O)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A08 compound treatment 661671.0526 100000.0 0.46 524064.9351 -19400.0 -0.1 0.254 0.5367 1000141 SMP1_000008 OC[C@H]1O[C@@H](Oc2cc3ccc(=O)oc3cc2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A09 compound treatment 578363.2479 16900.0 0.08 571132.4786 27700.0 0.15 0.1588 0.9557 756 SMP1_000009 CCCCCCc1ccc(O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A10 compound treatment 541509.7276 -20000.0 -0.09 561780.1047 18300.0 0.1 0.0036 0.0267 907119 SMP1_000010 CC1C2Cc3ccc(O)cc3C1(C)CCN2CC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A11 compound treatment 621918.0328 60400.0 0.28 612789.2377 69400.0 0.37 0.4571 0.9906 3074205 SMP1_000011 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C2c3cccc(O)c3C(=O)c4c(O)cc(CO)cc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A12 compound treatment 656968.1275 95500.0 0.44 538621.8487 -4810.0 -0.03 0.2932 0.665 1606 SMP1_000012 NS(=O)(=O)c1cc2c(NC(CSCC=C)NS2(=O)=O)cc1Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A13 compound treatment 654352.6971 92800.0 0.43 673163.4615 130000.0 0.69 0.7893 0.9739 209 SMP1_000013 CCC(C)C1NC(=O)CNC(=O)C2Cc3c([nH]c4cc(O)ccc34)S(=O)CC(NC(=O)CNC1=O)C(=O)NC(CC(=O)N)C(=O)N5CC(O)CC5C(=O)NC(C(C)C(O)CO)C(=O)N2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A14 compound treatment 604304.5267 42800.0 0.2 511680.0 -31800.0 -0.17 0.0205 0.0788 1000229 SMP1_000014 Nc1c(Br)cc(Br)cc1CN[C@H]2CC[C@H](O)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A15 compound treatment 658251.2563 96700.0 0.45 475653.6797 -67800.0 -0.36 0.0612 0.1069 3198849 SMP1_000015 NCCC(O)C(=O)N[C@@H]1C[C@H](N)C(O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A16 compound treatment 571188.5246 9680.0 0.04 486329.0598 -57100.0 -0.3 -0.1826 -0.5965 3074259 SMP1_000016 Nc1cc(Cl)c(NC2=NCCN2)c(Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A17 compound treatment 668178.5714 107000.0 0.49 507206.1069 -36200.0 -0.19 0.212 0.4014 1469 SMP1_000017 CCC1(CCC(=O)NC1=O)c2ccc(N)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A18 compound treatment 627138.6555 65600.0 0.3 523004.6512 -20400.0 -0.11 0.1374 0.4274 3074401 SMP1_000018 CN(C)CCCO[C@H]1[C@H](O[C@@H]2OC(C)(C)O[C@H]12)[C@H](O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A19 compound treatment 503031.0078 -58500.0 -0.27 454850.9615 -88600.0 -0.47 -0.5229 -0.9653 880 SMP1_000019 CC1(C)S[C@@H]2[C@H](NC(=O)C(N)c3ccc(O)cc3)C(=O)N2[C@H]1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A20 compound treatment 544995.7806 -16500.0 -0.08 499486.9565 -43900.0 -0.23 -0.2187 -0.8918 2141034 SMP1_000020 NC(CCCNN=CN[C@@H](CC(=O)O)C(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A21 compound treatment 540012.7119 -21500.0 -0.1 587881.8565 44400.0 0.24 0.0966 0.3777 3074462 SMP1_000021 NCC(O)c1ccc(O)c(O)c1.OC(C(O)C(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A22 mock treatment 633067.6329 71600.0 0.33 535036.5854 -8400.0 -0.04 0.2018 0.6062 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A23 mock treatment 570179.4872 8670.0 0.04 604197.2477 60800.0 0.32 0.2562 0.7888 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 A24 mock treatment 558675.4386 -2840.0 -0.01 506171.4286 -37300.0 -0.2 -0.149 -0.7523 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B01 compound treatment 861401.8692 300000.0 1.38 673173.4694 130000.0 0.69 1.4645 0.9481 3198851 SMP1_000022 OC[C@H]1O[C@@H]2[C@@H](Oc3nc(=N)ccn23)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B02 compound treatment 723009.2166 161000.0 0.74 610009.8522 66600.0 0.35 0.7763 0.9419 2117676 SMP1_000023 COc1ccc(C[C@@H]2NC[C@@H](O)[C@@H]2OC(=O)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B03 compound treatment 674014.5631 113000.0 0.52 700050.2513 157000.0 0.83 0.9542 0.9743 2141035 SMP1_000024 Cn1cncc1CC(NC(=O)CCN)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B04 compound treatment 758073.913 197000.0 0.91 758227.5132 215000.0 1.14 1.4466 0.9936 154 SMP1_000025 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@H]3C[C@@H]4C[C@@]32CC[C@]4(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B05 compound treatment 695107.1429 134000.0 0.62 632828.0543 89400.0 0.47 0.7709 0.9916 2141036 SMP1_000026 CCC/C=C/C=C/C(=O)O[C@H]1\C(=C\C(=O)OC)\C[C@H]2C[C@@H](OC(=O)C[C@H](O)C[C@@H]3C[C@H](O)C(C)(C)[C@](O)(C[C@@H]4C/C(=C/C(=O)OC)/C[C@@H](O4)/C=C/C(C)(C)[C@]1(O)O2)O3)[C@@H](C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B06 compound treatment 565453.6082 3940.0 0.02 680421.8009 137000.0 0.73 0.5266 0.7246 899 SMP1_000027 CN1CCc2cccc-3c2[C@H]1Cc4ccc(O)c(O)c43 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B07 compound treatment 544762.5571 -16700.0 -0.08 540652.968 -2780.0 -0.01 -0.065 -0.8272 3174242 SMP1_000028 OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B08 compound treatment 710410.4803 149000.0 0.69 634741.1168 91300.0 0.48 0.828 0.9854 3198852 SMP1_000029 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2ccc(=O)[nH]c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B09 compound treatment 606362.4454 44900.0 0.21 569920.0 26500.0 0.14 0.2456 0.9822 2060 SMP1_000030 CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B10 compound treatment 663878.2609 102000.0 0.47 608580.4878 65100.0 0.35 0.5781 0.9882 1000124 SMP1_000031 CN1C2CCC1CC(C2)OC(=O)C(CO)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B11 compound treatment 722985.9155 161000.0 0.74 591257.5758 47800.0 0.25 0.7059 0.8973 3074586 SMP1_000032 C[C@H]1[C@H]2[C@H](OC1=O)C3C(=CC(=O)C3=C(C)C[C@@H]2O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B12 compound treatment 711119.2661 150000.0 0.69 527723.0769 -15700.0 -0.08 0.4289 0.6172 3198853 SMP1_000033 COC(=O)[C@@]1(C)OC[C@]2([C@H]3[C@H]4OC[C@@]3([C@@H](C[C@@H]2OC(=O)/C(=C\C)/C)OC(=O)C)C(=O)OC)[C@@H]1[C@@](C)([C@@H]4O)[C@@]56OC6(C)C7C[C@H]5OC8OC=CC78O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B13 compound treatment 701679.2453 140000.0 0.65 628588.5417 85200.0 0.45 0.7764 0.9846 3198854 SMP1_000034 CC(=O)OC1C2=C(C)C(O)C3(C)CC4(O)C(OC(=O)c5ccccc5)C6C7(COC7C8(C)CC(O)C(C)(C1=O)C68C234)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B14 compound treatment 654570.7763 93100.0 0.43 472756.0976 -70700.0 -0.37 0.0384 0.0674 3198855 SMP1_000035 CCC(C)C(N)C1=NC(CS1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)C[C@H]2CCCCNC(=O)[C@H](CC(=O)N)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc3cnc[nH]3)NC(=O)[C@@H](Cc4ccccc4)NC(=O)[C@@H](NC(=O)[C@@H](CCCN)NC2=O)[C@@H](C)CC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B15 compound treatment 674824.0 113000.0 0.52 674132.1586 131000.0 0.69 0.8597 0.9903 678 SMP1_000036 NCC(CC(=O)O)c1ccc(Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B16 compound treatment 717728.6432 156000.0 0.72 569340.0 25900.0 0.14 0.6066 0.8271 1950 SMP1_000037 Oc1cc2oc(cc(=O)c2c(O)c1O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B17 compound treatment 728340.1639 167000.0 0.77 491614.4578 -51800.0 -0.27 0.3497 0.428 3074655 SMP1_000038 COC1C=CC=C(C)CC(C)C(O)C(C)C=C(C)C=C(OC)C(=O)OC1[C@@H](C)[C@@H](O)[C@H](C)[C@@]2(O)C[C@@H](O)[C@H](C)[C@H](O2)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B18 compound treatment 585735.1598 24200.0 0.11 678549.3562 135000.0 0.72 0.5857 0.8076 3074707 SMP1_000039 C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B19 compound treatment 578563.9098 17100.0 0.08 470025.7732 -73400.0 -0.39 -0.2197 -0.5531 900 SMP1_000040 CN1C(=C(O)c2sccc2S1(=O)=O)C(=O)Nc3ccccn3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B20 compound treatment 524502.2422 -37000.0 -0.17 504153.5088 -39300.0 -0.21 -0.268 -0.9951 3471542 SMP1_000041 CC(=C(CCOP(=O)(O)O)SC(=O)c1ccccc1)N(Cc2cnc(C)nc2N)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B21 compound treatment 532253.2751 -29300.0 -0.13 581921.2598 38500.0 0.2 0.0489 0.2 952 SMP1_000042 CC(C)(S)[C@@H](N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B22 mock treatment 597669.8565 36200.0 0.17 494946.9388 -48500.0 -0.26 -0.0639 -0.2086 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B23 mock treatment 640996.0159 79500.0 0.37 553665.1786 10200.0 0.05 0.2976 0.803 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 B24 mock treatment 682041.3223 121000.0 0.56 495463.4146 -48000.0 -0.25 0.2131 0.3486 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C01 compound treatment 654240.1961 92700.0 0.43 578820.5128 35400.0 0.19 0.4351 0.9317 3068885 SMP1_000043 C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C02 compound treatment 837081.448 276000.0 1.27 646146.5969 103000.0 0.54 1.2838 0.9285 2110 SMP1_000044 C[C@@H]1C[C@@H]2[C@H]([C@@H]3C=C(CO)[C@@H](O)[C@]4(O)[C@@H](O)C(=C[C@@]14C3=O)C)C2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C03 compound treatment 724060.3015 163000.0 0.75 543022.3464 -412.0 0.0 0.5285 0.705 1602 SMP1_000045 COc1ccc(cc1)c2coc3cc(O)cc(O)c3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C04 compound treatment 764524.4444 203000.0 0.94 644587.8788 101000.0 0.54 1.0414 0.9651 1000140 SMP1_000046 CC[C@@H]1OC(OC(C(NC(=O)c2nc(nc(N)c2C)C(CC(=O)N)NCC(N)C(=O)N)C(=O)NC(C)C(O)C(C)C(=O)NC(C(C)O)C(=O)NCCc3nc(cs3)c4nc(cs4)C(=O)NCCCCNC(=N)N)c5c[nH]cn5)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](OC(=O)N)[C@@H]6O)[C@@H](C)[C@@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C05 compound treatment 644028.9855 82500.0 0.38 734174.3119 191000.0 1.01 0.9845 0.9108 1737132 SMP1_000047 COc1cc-2c(CC3N(C)CCc4cc(O)c(OC)c2c34)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C06 compound treatment 728762.3762 167000.0 0.77 660296.6507 117000.0 0.62 0.9837 0.9941 3176860 SMP1_000048 C[C@H]1CCC/C=C/C2C[C@H](O)C[C@@]2(O)C/C=C/C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C07 compound treatment 644212.963 82700.0 0.38 653008.6207 110000.0 0.58 0.6806 0.9791 404 SMP1_000049 CCCCNc1cc(cc(c1Oc2ccccc2)S(=O)(=O)N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C08 compound treatment 633210.2564 71700.0 0.33 608184.9711 64800.0 0.34 0.4766 0.9998 2069232 SMP1_000050 NCCC(O)C(=O)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C09 compound treatment 713429.1667 152000.0 0.7 589324.4444 45900.0 0.24 0.6675 0.9 1055735 SMP1_000051 OC(=O)c1cc2ccccc2c(N=Nc3c(O)cc(c4ccccc34)S(=O)(=O)O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C10 compound treatment 598228.3951 36700.0 0.17 506582.2785 -36900.0 -0.2 -0.0185 -0.0715 3198857 SMP1_000052 CC(O)C1(C)CCC(O1)C2(C)CCC(CC(O)C(C)C(O)C(C)/C=C/CC(C)CC(C)C(=O)CC(=O)C(C)CC(C)CC(C)CCC(=O)O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C11 compound treatment 681949.0741 120000.0 0.56 652352.2013 109000.0 0.58 0.8012 0.9998 3198858 SMP1_000053 COC[C@@H]([C@H](O)[C@H](O)C(=O)NCC[C@H](C)c1nc(C=CC[C@@H]2O[C@]3(C[C@@H](O)[C@@H]2C)O[C@H]([C@H](C[C@H](O)[C@H](C)[C@H](O)[C@H](C)C=C(C)C(=CC=CC(=CC#N)C)C)OC)[C@H](OP(=O)(O)O)C3(C)C)co1)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C12 compound treatment 76951.2195 -485000.0 -2.23 68690.4762 -475000.0 -2.52 -3.3606 -0.9982 1014 SMP1_000054 CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)C(=NOCOCCOC)[C@H](C)[C@@H](O)[C@]1(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C13 compound treatment 742875.5981 181000.0 0.84 623248.8889 79800.0 0.42 0.8908 0.9502 2431 SMP1_000055 CCN(CC)CCNC(=O)c1ccc(N)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C14 compound treatment 632149.3776 70600.0 0.33 607826.9231 64400.0 0.34 0.4718 0.9997 861 SMP1_000056 C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C15 compound treatment 589631.7829 28100.0 0.13 580219.3548 36800.0 0.2 0.2297 0.9803 1000171 SMP1_000057 C[C@@](Cc1ccc(O)c(O)c1)(NN)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C16 compound treatment 638681.0345 77200.0 0.36 643912.3711 100000.0 0.53 0.6285 0.9807 3198859 SMP1_000058 Cc1c(C(=O)O)c(O)cc2C(=O)c3c(O)c(O)c([C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C17 compound treatment 497220.0 -64300.0 -0.3 603913.0435 60500.0 0.32 0.0172 0.0393 379 SMP1_000059 O[C@H]1CCN2C[C@H](O)[C@@H](O)[C@H](O)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C18 compound treatment 668876.5432 107000.0 0.5 613780.083 70300.0 0.37 0.6139 0.9903 1733214 SMP1_000060 Oc1ccc(cc1)C2CC(=O)c3c(O)cc(O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C19 compound treatment 627473.6842 66000.0 0.3 568459.3301 25000.0 0.13 0.309 0.9309 3187753 SMP1_000061 C[C@H]1C[C@H]2[C@@H]3CC[C@H](C(=O)C)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]4(C)CCC(=O)C=C14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C20 compound treatment 627699.5516 66200.0 0.31 535873.3624 -7560.0 -0.04 0.1875 0.609 994 SMP1_000062 N[C@@H](CCONC(=N)N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C21 compound treatment 680759.1623 119000.0 0.55 672625.641 129000.0 0.69 0.8734 0.9941 349 SMP1_000063 COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)c4ccco4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C22 mock treatment 642035.5731 80500.0 0.37 643955.5556 101000.0 0.53 0.6396 0.9844 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C23 mock treatment 553592.4171 -7920.0 -0.04 568508.4034 25100.0 0.13 0.0682 0.4946 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 C24 mock treatment 662008.1967 100000.0 0.46 576582.6446 33100.0 0.18 0.452 0.9119 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D01 compound treatment 667339.7129 106000.0 0.49 645109.4891 102000.0 0.54 0.7264 0.9988 1000071 SMP1_000064 C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D02 compound treatment 755105.2632 194000.0 0.89 611141.3613 67700.0 0.36 0.8852 0.9199 1160 SMP1_000065 OC[C@@H](NC(=O)C(Cl)Cl)[C@H](O)c1ccc(cc1)[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D03 compound treatment 705403.1414 144000.0 0.66 708455.9585 165000.0 0.88 1.0881 0.9907 3074003 SMP1_000066 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D04 compound treatment 68958.3333 -493000.0 -2.27 70744.6809 -473000.0 -2.51 -3.379 -0.9988 3198950 SMP1_000067 CN(C)[C@H]1[C@@H]2CC3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)C(=O)c4c(O)ccc(Cl)c4[C@@]3(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D05 compound treatment 629874.5247 68400.0 0.32 611415.0943 68000.0 0.36 0.4779 0.9978 2838 SMP1_000068 CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)CCC3=C)/CCC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D06 compound treatment 578119.8347 16600.0 0.08 726345.0 183000.0 0.97 0.7402 0.7606 3198951 SMP1_000069 CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D07 compound treatment 546990.9091 -14500.0 -0.07 750907.767 207000.0 1.1 0.7308 0.6629 1225 SMP1_000070 Oc1cc(O)c2c(=O)cc(oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D08 compound treatment 579669.4915 18200.0 0.08 629631.3131 86200.0 0.46 0.3825 0.8229 1268 SMP1_000071 CN1C(=C(O)c2ccccc2S1(=O)=O)C(=O)Nc3cc(C)on3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D09 compound treatment 595994.9495 34500.0 0.16 673720.4301 130000.0 0.69 0.6011 0.8477 1010377 SMP1_000072 Oc1ccc2C3c4cc(O)c(O)cc4CC3(O)COc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D10 compound treatment 710418.1034 149000.0 0.69 758815.3153 215000.0 1.14 1.2934 0.9703 1999 SMP1_000073 Oc1c(I)cc(Cl)c2cccnc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D11 compound treatment 679072.1154 118000.0 0.54 691013.6054 148000.0 0.78 0.9368 0.9839 359 SMP1_000074 FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NCC2CCCCN2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D12 compound treatment 506607.5269 -54900.0 -0.25 574239.2344 30800.0 0.16 -0.0635 -0.2107 2141037 SMP1_000075 O[C@H](COc1cccc(Cl)c1)/C=C/[C@@H]2[C@@H](O)C[C@@H](O)[C@H]2C/C=C\CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D13 compound treatment 646776.7442 85300.0 0.39 584893.617 41500.0 0.22 0.4335 0.9623 1001919 SMP1_000076 CN[C@H]1CCc2cc(OC)c(OC)c(OC)c2-c3ccc(OC)c(=O)cc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D14 compound treatment 713470.3704 152000.0 0.7 661537.7358 118000.0 0.63 0.9385 0.9984 3177244 SMP1_000077 CC[C@H](C)C(=O)O[C@H]1CCC=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D15 compound treatment 512481.0127 -49000.0 -0.23 642575.0 99100.0 0.53 0.2119 0.3703 3198953 SMP1_000078 C[C@@H]1O[C@@H](OC2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@H](CCC5(O)[C@@H]4CCC3(O)C2)C6=CC(=O)OC6)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D16 compound treatment 525359.8131 -36200.0 -0.17 570718.3908 27300.0 0.14 -0.0156 -0.0705 3054850 SMP1_000079 C[C@@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]2CC[C@@H]1C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D17 compound treatment 634888.412 73400.0 0.34 563004.386 19600.0 0.1 0.3127 0.8834 450 SMP1_000080 COC(=O)[C@@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D18 compound treatment 705297.7778 144000.0 0.66 536947.0588 -6490.0 -0.03 0.4445 0.6695 2141038 SMP1_000081 C[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)C23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D19 compound treatment 675239.1304 114000.0 0.52 616053.2787 72600.0 0.39 0.6432 0.9885 2081006 SMP1_000082 COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D20 compound treatment 574804.3478 13300.0 0.06 501358.209 -42100.0 -0.22 -0.1145 -0.4946 3074156 SMP1_000083 CC1=C(N2[C@H](SC1)[C@H](NC(=O)C(N)c3ccc(O)cc3)C2=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D21 compound treatment 646447.4886 84900.0 0.39 572663.3166 29200.0 0.16 0.3866 0.9177 3382 SMP1_000084 Cc1c(CCO)sc[n+]1Cc2cnc(C)nc2N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D22 mock treatment 601642.5532 40100.0 0.19 552955.9471 9520.0 0.05 0.1666 0.8683 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D23 mock treatment 586581.2274 25100.0 0.12 519202.4291 -24200.0 -0.13 -0.0091 -0.0528 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 D24 mock treatment 548855.0186 -12700.0 -0.06 533603.3755 -9830.0 -0.05 -0.0781 -0.9984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E01 compound treatment 591101.4493 29600.0 0.14 540865.9218 -2570.0 -0.01 0.0869 0.6334 3198954 SMP1_000085 CC[C@H](C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E02 compound treatment 666980.7692 105000.0 0.49 777695.4023 234000.0 1.24 1.2225 0.9162 2141039 SMP1_000086 CO[C@H]1C[C@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)C6=CC(=O)OC6)O[C@H](C)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E03 compound treatment 107818.1818 -454000.0 -2.09 116134.6154 -427000.0 -2.27 -3.082 -0.9992 3198955 SMP1_000087 CC1C2C(Cc3ccccc3)NC(=O)C42OC(=O)C=CC(=O)CCCC(C)CC=CC4C(O)C1=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E04 compound treatment 777704.0816 216000.0 1.0 698720.8122 155000.0 0.82 1.2874 0.9955 3414684 SMP1_000088 CC1C2C(Cc3ccccc3)NC(=O)C42OC(=O)C=CC(O)CCCC(C)CC=CC4C(O)C1=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E05 compound treatment 735530.303 174000.0 0.8 552258.216 8820.0 0.05 0.6006 0.7471 592 SMP1_000089 Oc1ccc(cc1)c2coc3cc(O)ccc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E06 compound treatment 727744.0758 166000.0 0.77 536399.061 -7040.0 -0.04 0.5157 0.6719 3198956 SMP1_000090 CC1(C)CC[C@H](O)[C@@]2(C)[C@H]1[C@H](O)[C@H](O)[C@@]3(C)O[C@](C)(CC(=O)C32)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E07 compound treatment 81418.6046 -480000.0 -2.21 87195.122 -456000.0 -2.42 -3.2767 -0.999 1451 SMP1_000091 CN(C)[C@H]1[C@@H]2C[C@@H]3[C@H](O)c4c(Cl)ccc(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E08 compound treatment 581387.6652 19900.0 0.09 581531.8182 38100.0 0.2 0.2077 0.9361 2081077 SMP1_000092 C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E09 compound treatment 549427.8351 -12100.0 -0.06 584128.5714 40700.0 0.22 0.1132 0.5079 832268 SMP1_000093 NC(=N)c1ccc(cc1)c2cc3ccc(cc3[nH]2)C(=N)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E10 compound treatment 623130.2521 61600.0 0.28 593359.116 49900.0 0.26 0.3882 0.9994 2080198 SMP1_000094 CC(=O)C1=C(O)C2C3C(Cc4cccc5[nH]cc3c45)C(C)(C)N2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E11 compound treatment 681063.8298 120000.0 0.55 776575.419 233000.0 1.24 1.2642 0.9338 2141040 SMP1_000095 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3cc(Cl)c(Cl)cc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E12 compound treatment 704588.6792 143000.0 0.66 740142.8571 197000.0 1.04 1.2043 0.9756 3074726 SMP1_000096 C[C@H]1O[C@H](C[C@H](O)[C@@H]1O)O[C@@H]2[C@@H](C)O[C@H](C[C@@H]2O)O[C@@H]3[C@@H](C)O[C@H](C[C@@H]3O)O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]7(C)[C@H](CC[C@]67O)C8=CC(=O)OC8)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E13 compound treatment 601228.1369 39700.0 0.18 609081.25 65600.0 0.35 0.3757 0.955 3198957 SMP1_000097 C[C@H]1OC(C[C@H](O)[C@@H]1O)O[C@@H]2[C@@H](C)OC(C[C@@H]2O)O[C@@H]3[C@@H](C)OC(C[C@@H]3O)O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5C[C@@H](O)[C@]7(C)[C@H](CC[C@]67O)C8=CC(=O)OC8)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E14 compound treatment 363171.875 -198000.0 -0.91 528633.5404 -14800.0 -0.08 -0.7023 -0.765 2080186 SMP1_000098 CC=CCC=CCCC(=O)C1OC1C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E15 compound treatment 470396.3636 -91100.0 -0.42 569525.8216 26100.0 0.14 -0.1993 -0.4504 3074733 SMP1_000099 Nc1nc(=O)c2N=C(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)CNc2[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E16 compound treatment 429185.567 -132000.0 -0.61 598965.9091 55500.0 0.29 -0.2232 -0.3294 3472295 SMP1_000100 COc1c(O)cc2C(=O)OC3C(O)C(O)C(CO)OC3c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E17 compound treatment 468124.0 -93400.0 -0.43 668587.0647 125000.0 0.66 0.1649 0.2083 2141041 SMP1_000101 CCCCCCCCCCCCC/C=C/C(O)C(N)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E18 compound treatment 578193.4156 16700.0 0.08 631372.973 87900.0 0.47 0.3842 0.8128 3074792 SMP1_000102 CC(C)[C@@H](C)C=C[C@@H](C)[C@H]1CC[C@H]2C(=CC=C3C[C@H](O)CC[C@@H]3C)CCC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E19 compound treatment 518129.8077 -43400.0 -0.2 616487.8049 73100.0 0.39 0.1325 0.3039 2141042 SMP1_000103 OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](O[C@@H](C#N)c3ccccc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E20 compound treatment 719341.0853 158000.0 0.73 638466.0633 95000.0 0.5 0.8711 0.9839 3198959 SMP1_000104 CO/N=C(/C(=O)N[C@H]1C2SCC(=C(N2C1=O)C(=O)O)CSc3nc(=O)c(O)nn3C)\c4csc(N)n4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E21 compound treatment 528111.1111 -33400.0 -0.15 600427.3128 57000.0 0.3 0.1048 0.309 3198960 SMP1_000105 CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E22 mock treatment 519943.128 -41600.0 -0.19 627045.6621 83600.0 0.44 0.178 0.3685 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E23 mock treatment 585616.2791 24100.0 0.11 566188.3408 22800.0 0.12 0.1639 0.9992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 E24 mock treatment 597749.0909 36200.0 0.17 515004.6729 -28400.0 -0.15 0.0115 0.0513 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F01 compound treatment 701953.0516 140000.0 0.65 601809.5238 58400.0 0.31 0.6769 0.9429 1000279 SMP1_000106 COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F02 compound treatment 58857.1429 -503000.0 -2.32 76093.0233 -467000.0 -2.48 -3.3919 -0.9994 980 SMP1_000107 C[C@@H]1[C@H]2[C@H](O)[C@H]3[C@H](N(C)C)C(=C(C(=O)N)C(=O)[C@@]3(O)C(=C2C(=O)c4c(O)cccc14)O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F03 compound treatment 734635.468 173000.0 0.8 587819.6721 44400.0 0.24 0.731 0.8782 697 SMP1_000108 Cn1c(=O)n(C)c2ncn(CC(O)CO)c2c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F04 compound treatment 642266.3317 80800.0 0.37 665820.7547 122000.0 0.65 0.7223 0.9652 1001936 SMP1_000109 C[C@H]([C@H](O)CCC(C)(C)O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F05 compound treatment 647837.3206 86300.0 0.4 642440.8602 99000.0 0.53 0.6528 0.9907 3074864 SMP1_000110 CC(C)[C@@]12O[C@H]2[C@@H]3O[C@]34[C@]5(O[C@H]5CC6C7=C(CC[C@@]64C)C(=O)OC7)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F06 compound treatment 656877.1186 95400.0 0.44 750058.8235 207000.0 1.1 1.0859 0.9196 598 SMP1_000111 Oc1cc2c(=O)oc3c(O)c(O)cc4c(=O)oc(c1O)c2c43 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F07 compound treatment 639930.6122 78400.0 0.36 555981.0427 12500.0 0.07 0.3028 0.8234 3198961 SMP1_000112 CC[C@@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]4NCCc5cc(OC)c(OC)cc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F08 compound treatment 419450.0 -142000.0 -0.66 546510.2041 3080.0 0.02 -0.4517 -0.6893 1048 SMP1_000113 CCn1cc(C(=O)O)c(=O)c2cc(F)c(nc12)N3CCNCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F09 compound treatment 538080.8081 -23400.0 -0.11 568055.9441 24600.0 0.13 0.0159 0.094 907310 SMP1_000114 O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F10 compound treatment 368326.3158 -193000.0 -0.89 632257.485 88800.0 0.47 -0.2968 -0.2945 1001923 SMP1_000115 O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F11 compound treatment 417925.4237 -144000.0 -0.66 587087.2093 43700.0 0.23 -0.3045 -0.4341 2141043 SMP1_000116 NC(=C(C#N)C#N)C(=Cc1ccc2[nH]ccc2c1)C#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F12 compound treatment 405088.0503 -156000.0 -0.72 622076.1421 78600.0 0.42 -0.2151 -0.2582 3074929 SMP1_000117 CC(C)[C@@H](C)C=C[C@@H](C)[C@H]1CCC2C(=CC=C3C[C@@H](O)CCC3=C)CCC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F13 compound treatment 424681.388 -137000.0 -0.63 558840.796 15400.0 0.08 -0.3884 -0.6104 2965 SMP1_000118 C[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F14 compound treatment 16907.5144 -545000.0 -2.51 62209.3023 -481000.0 -2.55 -3.5807 -1.0 935 SMP1_000119 CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F15 compound treatment 462985.5072 -98500.0 -0.45 565313.3047 21900.0 0.12 -0.2392 -0.5101 1532 SMP1_000120 OC[C@H]1O[C@H](Oc2cc3ccc(=O)oc3cc2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F16 compound treatment 471451.1785 -90100.0 -0.42 606520.9581 63100.0 0.33 -0.0571 -0.107 386 SMP1_000121 C[C@@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]2CC[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F17 compound treatment 360984.375 -201000.0 -0.92 575396.8254 32000.0 0.17 -0.534 -0.568 3188281 SMP1_000122 C[C@@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]2C[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F18 compound treatment 559182.8358 -2330.0 -0.01 736698.4925 193000.0 1.03 0.7172 0.6997 3060043 SMP1_000123 C[C@@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F19 compound treatment 520032.9218 -41500.0 -0.19 475359.0604 -68100.0 -0.36 -0.3906 -0.9559 3073959 SMP1_000124 COc1cc(cc(OC)c1O)C2C3C(COC3=O)C(O[C@H]4O[C@@H]5COC(C)O[C@H]5[C@H](O)[C@H]4O)c6cc7OCOc7cc26 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F20 compound treatment 429773.913 -132000.0 -0.61 373364.0777 -170000.0 -0.9 -1.0674 -0.9815 757 SMP1_000125 OC(=O)c1cn(C2CC2)c3cc(N4CCNCC4)c(F)cc3c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F21 compound treatment 429916.6667 -132000.0 -0.61 501710.1449 -41700.0 -0.22 -0.5856 -0.9066 3198963 SMP1_000126 C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]23C)O[C@]61CC[C@H](C)CN6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F22 mock treatment 644028.0374 82500.0 0.38 589722.5131 46300.0 0.25 0.4427 0.9775 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F23 mock treatment 533490.0398 -28000.0 -0.13 571839.0244 28400.0 0.15 0.0152 0.0764 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 F24 mock treatment 583669.6035 22200.0 0.1 570740.9326 27300.0 0.14 0.1747 0.9854 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G01 compound treatment 653281.6901 91800.0 0.42 494920.7317 -48500.0 -0.26 0.1173 0.2368 3187752 SMP1_000127 C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G02 compound treatment 773342.3423 212000.0 0.98 664517.4129 121000.0 0.64 1.1449 0.9793 424 SMP1_000128 CC(=O)O[C@H]1[C@@H](O)[C@H]2C(C)(C)CC[C@H](O)[C@]2(C)[C@@]3(O)C(=O)C[C@@](C)(O[C@]13C)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G03 compound treatment 588857.8199 27300.0 0.13 597218.0095 53800.0 0.29 0.2909 0.9326 1188 SMP1_000129 NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccco2)cc1Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G04 compound treatment 447255.0336 -114000.0 -0.53 318798.0769 -225000.0 -1.19 -1.2151 -0.9327 3198964 SMP1_000130 C[C@@H]1[C@H](O)CC[C@@]2(C)C1CC[C@H]3[C@H]2[C@@H](O)CC4/C(=C(\CCC=C(C)C)/C(=O)O)/[C@H](C[C@@]43C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G05 compound treatment 645109.589 83600.0 0.39 560475.6098 17000.0 0.09 0.3365 0.8498 1202 SMP1_000131 COc1ccc2CN(C)CC[C@]34C=C[C@H](O)C[C@@H]4Oc1c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G06 compound treatment 579176.1905 17700.0 0.08 528835.2273 -14600.0 -0.08 0.0028 0.0253 3419531 SMP1_000132 COC1CC(C)CC2=C(OC)C(=O)C=C(NC(=O)C(=CC=CC(OC)C(OC(=O)N)C(=CC(C)C1O)C)C)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G07 compound treatment 465233.463 -96300.0 -0.44 549535.9116 6100.0 0.03 -0.2911 -0.6538 425 SMP1_000133 Oc1ccc(cc1)c2coc3cc(O)cc(O)c3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G08 compound treatment 410784.3866 -151000.0 -0.7 520668.8312 -22800.0 -0.12 -0.5769 -0.8177 1028 SMP1_000134 Oc1ccc(cc1)C(=C2C=CC(=O)C=C2)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G09 compound treatment 443211.8959 -118000.0 -0.55 532173.1844 -11300.0 -0.06 -0.428 -0.7799 962 SMP1_000135 CCC1(C(=O)NCNC1=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G10 compound treatment 416456.8345 -145000.0 -0.67 520475.1773 -23000.0 -0.12 -0.5591 -0.8223 2060138 SMP1_000136 C[C@]1([C@H]2[C@H](C(=O)O)[C@]3(CC(=C)[C@@]4(O)C3)[C@@H](CC4)[C@]52OC1=O)[C@@H](O)C=C5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G11 compound treatment 440921.5686 -121000.0 -0.56 604436.1233 61000.0 0.32 -0.1644 -0.2556 2141044 SMP1_000137 C[C@@H]1C(=O)OC2[C@@H](O)[C@]34[C@H]5C[C@@H](C(C)(C)C)C46[C@@H](O)C(=O)OC6O[C@@]3(C(=O)O5)[C@@]12O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G12 compound treatment 425868.1672 -136000.0 -0.63 542041.958 -1390.0 -0.01 -0.4475 -0.7154 2141045 SMP1_000138 C[C@@H]1C(=O)O[C@H]2[C@@H](O)C34[C@@H]5OC(=O)[C@]4(OC6OC(=O)[C@H](O)C63[C@@H]([C@@H]5O)C(C)(C)C)[C@@]12O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G13 compound treatment 397168.3849 -164000.0 -0.76 509853.2609 -33600.0 -0.18 -0.6619 -0.8501 3074092 SMP1_000139 C[C@@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@@]43C)[C@]2(O)C[C@H](O)[C@@H]1C5=CC(=O)OC5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G14 compound treatment 271431.3725 -290000.0 -1.34 551294.8718 7860.0 0.04 -0.9164 -0.6847 936 SMP1_000140 OCC(O)COC(=O)c1ccccc1Nc2ccnc3cc(Cl)ccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G15 compound treatment 27963.964 -534000.0 -2.46 70756.0976 -473000.0 -2.51 -3.5126 -1.0 2080095 SMP1_000141 CN1C(=O)C23CC4=CC=CC(O)C4N3C(=O)C1(CO)SS2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G16 compound treatment 331783.871 -230000.0 -1.06 484843.5374 -58600.0 -0.31 -0.9689 -0.8775 1000325 SMP1_000142 C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)C6=CC(=O)OC6)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G17 compound treatment 361516.4474 -200000.0 -0.92 566337.8995 22900.0 0.12 -0.5663 -0.6087 3074163 SMP1_000143 CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]3(C)C2C(=O)C=C4[C@H]5C[C@](C)(CC[C@]5(C)CC[C@]43C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G18 compound treatment 449569.3431 -112000.0 -0.52 507161.7021 -36300.0 -0.19 -0.5011 -0.9095 76 SMP1_000144 CC1(C)[C@@H](O)C[C@@H]2[C@]1(O)[C@H](O)C[C@@]3(C[C@@](C)(O)C4CC[C@H]3[C@@]2(C)O)[C@@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G19 compound treatment 460159.292 -101000.0 -0.47 502718.8755 -40700.0 -0.22 -0.4832 -0.9385 1578 SMP1_000145 CC1=NCCc2c1[nH]c3cc(O)ccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G20 compound treatment 492695.4545 -68800.0 -0.32 534408.2569 -9030.0 -0.05 -0.2583 -0.8047 818206 SMP1_000146 N[C@@H](CCCNC(=O)N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G21 compound treatment 588523.2068 27000.0 0.12 526573.0337 -16900.0 -0.09 0.0248 0.162 1061 SMP1_000147 Nc1nc(N)c2nc(c(N)nc2n1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G22 mock treatment 522495.3704 -39000.0 -0.18 516907.6087 -26500.0 -0.14 -0.2267 -0.9926 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G23 mock treatment 563844.0 2330.0 0.01 525528.4974 -17900.0 -0.09 -0.0595 -0.623 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 G24 mock treatment 471370.3704 -90100.0 -0.42 503039.3258 -40400.0 -0.21 -0.4454 -0.9525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H01 compound treatment 588233.5025 26700.0 0.12 558702.1277 15300.0 0.08 0.1444 0.9793 1610 SMP1_000148 COc1ccc(cc1O)[C@@H]2CC(=O)c3c(O)cc(O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H02 compound treatment 692990.3846 131000.0 0.61 569566.0377 26100.0 0.14 0.5267 0.8469 3075213 SMP1_000149 COc1ccc(cc1O)[C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H03 compound treatment 581101.6043 19600.0 0.09 639443.9252 96000.0 0.51 0.424 0.8198 1651081 SMP1_000150 COc1cc(O)c2c(=O)c(coc2c1)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H04 compound treatment 753973.3333 192000.0 0.89 795310.1852 252000.0 1.34 1.5723 0.9803 465 SMP1_000151 NCCc1c[nH]cn1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H05 compound treatment 676861.9247 115000.0 0.53 530446.3277 -13000.0 -0.07 0.3274 0.6104 2141046 SMP1_000152 CC(=O)N(CC(O)CO)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H06 compound treatment 549042.3729 -12500.0 -0.06 663040.724 120000.0 0.63 0.4079 0.6404 3075214 SMP1_000153 C/C=C\1/[C@@H]2Cc3[nH]c(=O)ccc3[C@@]1(N)CC(=C2)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H07 compound treatment 343095.7096 -218000.0 -1.01 599861.8785 56400.0 0.3 -0.5006 -0.4764 1105 SMP1_000154 CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H08 compound treatment 460690.1408 -101000.0 -0.46 587438.7097 44000.0 0.23 -0.1637 -0.3147 3198966 SMP1_000155 CN1=Cc2cc3OCOc3cc2CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H09 compound treatment 508531.0078 -53000.0 -0.24 566123.3766 22700.0 0.12 -0.0877 -0.3219 2080102 SMP1_000156 C[C@@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]2CC[C@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H10 compound treatment 510020.339 -51500.0 -0.24 531723.7569 -11700.0 -0.06 -0.2118 -0.863 3198967 SMP1_000157 CC[C@@H]1CN2CC[C@@H]1C[C@H]2[C@H](O)c3ccnc4ccc(OC)cc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H11 compound treatment 71267.8571 -490000.0 -2.26 190365.3846 -353000.0 -1.87 -2.9228 -0.9956 3199059 SMP1_000158 CC[C@H](C1OC([C@@H](C)[C@H](O)[C@H](C)C(=O)[C@H](CC)C2O[C@@]3(O[C@@]4(CC[C@](C)(O4)C5CC[C@@H](O)[C@H](C)O5)[C@H](O)C=C3)[C@H](C)C[C@@H]2C)[C@@H](C)C[C@@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H12 compound treatment 322868.2432 -239000.0 -1.1 604351.7241 60900.0 0.32 -0.5497 -0.4793 1055159 SMP1_000159 NC(CC(=O)c1cccc(O)c1N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H13 compound treatment 289221.519 -272000.0 -1.26 500843.1373 -42600.0 -0.23 -1.0477 -0.8211 2141047 SMP1_000160 OCC1COCCOCCOCCOCCOCCO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H14 compound treatment 254406.5282 -307000.0 -1.42 476323.6994 -67100.0 -0.36 -1.2531 -0.8581 2141048 SMP1_000161 CCC(=C(c1ccc(O)cc1)c2ccc(OCCN(C)C)cc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H15 compound treatment 385083.3333 -176000.0 -0.81 522214.2857 -21200.0 -0.11 -0.6549 -0.7973 718 SMP1_000162 Cn1c(=O)n(C)c2ncn(CCO)c2c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H16 compound treatment 444265.5172 -117000.0 -0.54 518148.3516 -25300.0 -0.13 -0.4772 -0.8565 3199060 SMP1_000163 CN[C@H]1C[C@@H](N)[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@@H]3O[C@@]4(O[C@@H]32)O[C@H]([C@H](N)CO)[C@H](O)[C@H](O)[C@H]4O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H17 compound treatment 434144.9814 -127000.0 -0.59 591483.5681 48000.0 0.25 -0.2351 -0.3672 3075215 SMP1_000164 C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H18 compound treatment 418460.9665 -143000.0 -0.66 523529.703 -19900.0 -0.11 -0.5411 -0.81 2141049 SMP1_000165 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(=O)[nH]cnc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H19 compound treatment 585120.332 23600.0 0.11 536058.5774 -7380.0 -0.04 0.0493 0.4263 2141050 SMP1_000166 O[C@@H]1COC2[C@H](O)COC12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H20 compound treatment 489367.4419 -72100.0 -0.33 440977.7778 -102000.0 -0.54 -0.6195 -0.9723 760 SMP1_000167 N[C@@H]1CONC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H21 mock treatment 476114.4279 -85400.0 -0.39 521337.8995 -22100.0 -0.12 -0.3613 -0.8794 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H22 mock treatment 498666.6667 -62800.0 -0.29 496297.9798 -47100.0 -0.25 -0.3817 -0.9973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H23 mock treatment 527242.3077 -34300.0 -0.16 482481.8653 -61000.0 -0.32 -0.3404 -0.9458 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 H24 mock treatment 512549.3562 -49000.0 -0.23 568178.3439 24700.0 0.13 -0.0669 -0.256 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I01 compound treatment 578630.137 17100.0 0.08 546579.5455 3150.0 0.02 0.0676 0.838 422 SMP1_000168 Oc1cccc2C(=O)C=CC(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I02 compound treatment 609128.2051 47600.0 0.22 680900.5525 137000.0 0.73 0.6708 0.881 1476 SMP1_000169 CNCCCC1(CCC2c3ccccc31)c4ccccc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I03 compound treatment 635963.7306 74500.0 0.34 699758.2938 156000.0 0.83 0.8291 0.9238 3172730 SMP1_000170 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(NCc4ccco4)ncnc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I04 compound treatment 578165.0485 16700.0 0.08 564347.3684 20900.0 0.11 0.1327 0.9839 1506 SMP1_000171 OCc1cc(=O)c(O)co1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I05 compound treatment 716087.7193 155000.0 0.71 659672.8972 116000.0 0.62 0.94 0.9974 949 SMP1_000172 OC(=O)c1cc(O)c2ccccc2n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I06 compound treatment 749468.0851 188000.0 0.87 664668.4211 121000.0 0.64 1.0676 0.9892 439 SMP1_000173 CC(C)[C@H](O)[C@]1(NC(=O)[C@H](C)[C@@H]1O)C(=O)SC[C@H](NC(=O)C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I07 compound treatment 391582.7338 -170000.0 -0.78 508618.0905 -34800.0 -0.18 -0.6847 -0.8504 3199061 SMP1_000174 OC[C@H]1OC(O)(CO)[C@@H](O)[C@@H]1O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I08 compound treatment 536816.7939 -24700.0 -0.11 579636.3636 36200.0 0.19 0.0552 0.2475 2117250 SMP1_000175 CC1OC(CC(O)C1OC2CC(O)C(OC3CC(OC(=O)C)C(OC4OC(CO)C(O)C(O)C4O)C(C)O3)C(C)O2)OC5CCC6(C)C(CCC7C6CC(O)C8(C)C(CCC78O)C9=CC(=O)OC9)C5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I09 compound treatment 524783.3333 -36700.0 -0.17 646633.0935 103000.0 0.55 0.2673 0.4665 1589 SMP1_000176 CC(C)CC(NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)C(N)Cc2ccc(O)cc2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I10 compound treatment 459559.4406 -102000.0 -0.47 572415.4589 29000.0 0.15 -0.2238 -0.4524 2141051 SMP1_000177 O[C@H]1CO[C@@H]2[C@H](O)CO[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I11 compound treatment 279268.4564 -282000.0 -1.3 392055.1724 -151000.0 -0.8 -1.4881 -0.9731 1000220 SMP1_000178 CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@@H](C)O)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I12 compound treatment 459133.9286 -102000.0 -0.47 529699.3865 -13700.0 -0.07 -0.3854 -0.8067 1000323 SMP1_000179 N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I13 compound treatment 363971.51 -198000.0 -0.91 665365.8537 122000.0 0.65 -0.1869 -0.1673 1009367 SMP1_000180 OC1=CC2=C3c4ccc(O)c(O)c4OCC3(O)CC2=CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I14 compound treatment 298312.0805 -263000.0 -1.21 572851.4286 29400.0 0.16 -0.7479 -0.6112 2141052 SMP1_000181 CN1[C@H](CC(O)c2ccccc2)CCC[C@@H]1CC(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I15 compound treatment 308087.6133 -253000.0 -1.17 559860.1036 16400.0 0.09 -0.7648 -0.6526 3199063 SMP1_000182 CCCCC[C@@H](O)C1C(O)CC(O)CC(O)CC(O)CC(O)CC(O)CC(O)C(=CC=CC=CC=CC=CC(O)C(C)OC1=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I16 compound treatment 366131.5789 -195000.0 -0.9 610783.9196 67300.0 0.36 -0.3845 -0.3967 3199064 SMP1_000183 COc1ccc(cc1O)c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I17 compound treatment 362093.633 -199000.0 -0.92 598662.4473 55200.0 0.29 -0.4432 -0.4591 2139 SMP1_000184 O[C@H]1C=C2CCN3Cc4cc5OCOc5cc4[C@@H]([C@H]32)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I18 compound treatment 474003.4602 -87500.0 -0.4 531940.0 -11500.0 -0.06 -0.3285 -0.8048 1134 SMP1_000185 CN1C[C@H](CO)C=C2[C@H]1Cc3c[nH]c4cccc2c34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I19 compound treatment 689091.9118 128000.0 0.59 613023.9234 69600.0 0.37 0.677 0.9748 2141053 SMP1_000186 OC[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I20 compound treatment 609080.0 47600.0 0.22 543564.8148 131.0 0.0 0.1556 0.7093 2141054 SMP1_000187 C[C@@H](O)[C@@H](N)c1ccc(O)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I21 mock treatment 559016.1943 -2500.0 -0.01 529160.7143 -14300.0 -0.08 -0.0617 -0.8053 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I22 mock treatment 571189.0756 9680.0 0.04 696826.2712 153000.0 0.81 0.6069 0.7448 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I23 mock treatment 645241.7062 83700.0 0.39 578230.7692 34800.0 0.18 0.4035 0.9429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 I24 mock treatment 561979.8387 468.0 0.0 541220.1258 -2210.0 -0.01 -0.0068 -0.5676 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J01 compound treatment 635140.7767 73600.0 0.34 546148.9362 2710.0 0.01 0.2503 0.7364 2141055 SMP1_000188 OC[C@H]1O[C@@](CO)(O[C@@H]2OC(CO)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O[C@H]3OC(CO)[C@@H](O)[C@@H](O)[C@@H]3O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J02 compound treatment 576422.8856 14900.0 0.07 592668.6747 49200.0 0.26 0.2333 0.8639 683 SMP1_000189 Cc1ncc([N+](=O)[O-])n1CCO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J03 compound treatment 755053.9216 194000.0 0.89 710862.6374 167000.0 0.89 1.2591 1.0 3075222 SMP1_000190 CC1C[C@H](C)C(=O)C(C1)[C@@H](O)CC2CC(=O)NC(=O)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J04 compound treatment 62000.0 -500000.0 -2.3 69159.0909 -474000.0 -2.52 -3.4076 -0.999 1077 SMP1_000191 CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(ccc(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J05 compound treatment 703070.4225 142000.0 0.65 578786.4583 35400.0 0.19 0.5942 0.8748 82 SMP1_000192 Nc1cc(nc(N)[n+]1[O-])N2CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J06 compound treatment 479267.4897 -82200.0 -0.38 631140.3509 87700.0 0.47 0.0607 0.1012 3199066 SMP1_000193 CCCCC(C)(O)C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J07 compound treatment 389762.963 -172000.0 -0.79 622219.0476 78800.0 0.42 -0.2646 -0.2954 3075223 SMP1_000194 COC1=C[C@@]23CCCN3CCc4cc5OCOc5cc4[C@@H]2[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J08 compound treatment 507031.25 -54500.0 -0.25 632909.4828 89500.0 0.47 0.1579 0.2941 1528 SMP1_000195 NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J09 compound treatment 432332.2259 -129000.0 -0.6 721315.0685 178000.0 0.94 0.2459 0.2204 281 SMP1_000196 Ic1cccc2c(cccc12)S(=O)(=O)N3CCCNCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J10 compound treatment 588397.351 26900.0 0.12 532571.4286 -10900.0 -0.06 0.0469 0.3433 438 SMP1_000197 CCOC(=O)C1=C(C)NC(=S)NC1c2cccc(O)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J11 compound treatment 519280.7018 -42200.0 -0.19 706292.3077 163000.0 0.86 0.4731 0.5343 3187756 SMP1_000198 CC[C@]1(CC[C@@H](O1)[C@]2(C)CC[C@]3(C[C@H](O)[C@@H](C)[C@H](O3)[C@@H](C)[C@@H](OC)C(C)C(=O)O)O2)[C@@H]4O[C@H](C[C@@H]4C)[C@H]5O[C@@](O)(CO)[C@H](C)C[C@@H]5C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J12 compound treatment 307828.7462 -254000.0 -1.17 641336.6834 97900.0 0.52 -0.4601 -0.3594 1538 SMP1_000199 Oc1ccc(c(O)c1)c2oc3cc(O)cc(O)c3c(=O)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J13 compound treatment 288775.3846 -273000.0 -1.26 560700.4219 17300.0 0.09 -0.8246 -0.6539 1000139 SMP1_000200 CO[C@]1(NC(=O)C(C(=O)O)c2ccc(O)cc2)[C@H]3OCC(=C(N3C1=O)C(=O)O)CSc4nnnn4C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J14 compound treatment 405051.9878 -156000.0 -0.72 553674.7573 10200.0 0.05 -0.4718 -0.652 2178 SMP1_000201 NCc1cc(O)no1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J15 compound treatment 387621.7765 -174000.0 -0.8 548107.5269 4670.0 0.02 -0.5495 -0.6849 1060170 SMP1_000202 COc1c(C)c2COC(=O)c2c(O)c1CC=C(C)CCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J16 compound treatment 468159.0214 -93400.0 -0.43 517367.0213 -26100.0 -0.14 -0.4022 -0.8895 1055 SMP1_000203 CC(C)(C)NCC(O)COc1cccc2C[C@@H](O)[C@@H](O)Cc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J17 compound treatment 464292.4528 -97200.0 -0.45 549914.1631 6480.0 0.03 -0.2927 -0.651 3177283 SMP1_000204 O[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1C2(CCN3CC6CCC6)c54 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J18 compound treatment 498238.9706 -63300.0 -0.29 585469.0265 42000.0 0.22 -0.0487 -0.1326 929 SMP1_000205 Oc1ccc2C[C@H]3N(CC=C)CC[C@]4([C@H]5Oc1c24)[C@@]3(O)CCC5=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J19 compound treatment 442453.4884 -119000.0 -0.55 639124.4444 95700.0 0.51 -0.0294 -0.0393 3189051 SMP1_000206 Oc1ccc2C[C@H]3N(CC4CC4)CC[C@]5([C@H]6Oc1c25)[C@@]3(O)CCC6=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J20 compound treatment 528111.1111 -33400.0 -0.15 537124.0 -6310.0 -0.03 -0.1326 -0.8411 2141056 SMP1_000207 COC(=O)[C@H](N)Cc1ccc(O)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J21 mock treatment 549814.346 -11700.0 -0.05 563637.4269 20200.0 0.11 0.0376 0.3136 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J22 mock treatment 537143.4263 -24400.0 -0.11 597112.8405 53700.0 0.28 0.1219 0.3981 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J23 mock treatment 488238.6831 -73300.0 -0.34 570631.068 27200.0 0.14 -0.1369 -0.3727 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 J24 mock treatment 469453.7445 -92100.0 -0.42 495929.4118 -47500.0 -0.25 -0.4784 -0.969 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K01 compound treatment 605842.3645 44300.0 0.2 530231.9588 -13200.0 -0.07 0.095 0.4398 3199068 SMP1_000208 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc3cc(O)c4C(=O)CC(Oc4c3)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K02 compound treatment 697212.4352 136000.0 0.63 714575.0 171000.0 0.91 1.0844 0.9835 3075224 SMP1_000209 COc1ccc(cc1O)[C@@H]2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K03 compound treatment 766721.4612 205000.0 0.95 656495.1456 113000.0 0.6 1.0932 0.9758 3173760 SMP1_000210 COc1cc2CCN(C)[C@@H]3Cc4cccc(Oc5ccc(C[C@@H]6N(C)CCc7cc(OC)c(Oc(c1OC)c32)cc67)c(O)c5)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K04 compound treatment 652852.7132 91300.0 0.42 417718.894 -126000.0 -0.67 -0.1736 -0.2202 1092 SMP1_000211 CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K05 compound treatment 871180.9524 310000.0 1.43 702844.5596 159000.0 0.85 1.6077 0.9687 1010814 SMP1_000212 CC(=CCCC(=CCO)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K06 compound treatment 715607.4766 154000.0 0.71 757028.5714 214000.0 1.13 1.3036 0.9748 3199069 SMP1_000213 CO[C@@H]1C[C@@H](C[C@H]2CC[C@H](C)[C@@H](O2)[C@H](C)C(=O)O)O[C@]3(O[C@@](C)(C[C@H]3C)[C@H]4CC[C@](C)(O4)[C@@H]5O[C@H](C[C@@H]5C)[C@H]6O[C@@](O)(CO)[C@H](C)C[C@@H]6C)[C@@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K07 compound treatment 586790.8745 25300.0 0.12 587605.7143 44200.0 0.23 0.2481 0.9481 2141057 SMP1_000214 CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1Oc2ccc(cc2)[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K08 compound treatment 579251.8519 17700.0 0.08 587185.1852 43800.0 0.23 0.2219 0.902 3075226 SMP1_000215 CC(C)c1c(O)ccc2c1CC[C@H]3C(C)(C)CCC[C@@]32C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K09 compound treatment 631280.4428 69800.0 0.32 652723.0769 109000.0 0.58 0.6374 0.9614 747 SMP1_000216 CCn1cc(C(=O)O)c(=O)c2cc(F)c(cc12)N3CCNCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K10 compound treatment 479031.8021 -82500.0 -0.38 594796.7033 51400.0 0.27 -0.0763 -0.1631 3180381 SMP1_000217 O[C@@H]1[C@@H](O)[C@H](O)[C@H]2[C@@H](NC(=O)c3c(O)c4OCOc4cc23)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K11 compound treatment 539675.3247 -21800.0 -0.1 634417.5258 91000.0 0.48 0.27 0.5478 770 SMP1_000218 CC(CCc1ccccc1)NC(C)C(O)c2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K12 compound treatment 403706.9486 -158000.0 -0.73 731127.0492 188000.0 1.0 0.1894 0.1535 3199070 SMP1_000219 C[C@H]1O[C@@H](OC/2CC3OC(O)(CC(O)C3C(=O)O)CC(O)C(O)CCC(O)CC(O)CC(O)CC(=O)OC(C)C(C)C(O)C(C)/C=C/C=C/CC\C=C\C=C\C=C\C=C2)[C@@H](O)[C@@H](N)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K13 compound treatment 430912.5 -131000.0 -0.6 708551.8672 165000.0 0.88 0.1934 0.182 3075227 SMP1_000220 CC1Cc2c(Cl)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K14 compound treatment 520614.8649 -40900.0 -0.19 570415.4589 27000.0 0.14 -0.0322 -0.1359 893 SMP1_000221 NCC(O)c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K15 compound treatment 382448.8449 -179000.0 -0.83 567048.3871 23600.0 0.13 -0.4953 -0.5931 3199071 SMP1_000222 C[C@@H](C[C@H](O)[C@H]1C[C@@H]2CC[C@@]3(CC[C@@H](O3)/C=C/[C@@H](C)[C@@H]4CC(=C[C@@]5(O[C@H](C[C@@](C)(O)C(=O)O)CC[C@H]5O)O4)C)O[C@H]2[C@H](O)C1=C)[C@H]6O[C@@]7(CCCCO7)CC[C@H]6C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K16 compound treatment 260592.437 -301000.0 -1.39 337122.807 -206000.0 -1.09 -1.755 -0.9931 3199072 SMP1_000223 CO[C@H]1C[C@H](O[C@H]2[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@@H](C)C[C@@]4(CO4)C(=O)[C@H](C)[C@H](O)[C@@H](C)[C@@H](C)OC(=O)[C@@H]2C)O[C@@H](C)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K17 compound treatment 670383.1418 109000.0 0.5 599975.4098 56500.0 0.3 0.5671 0.9697 1001980 SMP1_000224 CCCCCCCC/C=C/CCCCCCCC(=O)OCC(CO)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K18 compound treatment 643772.0588 82300.0 0.38 730911.8943 187000.0 0.99 0.9714 0.9127 3075228 SMP1_000225 CCC/1CCC2OC3(CC[C@@H](C)C(C[C@H](C)O)O3)[C@H](C)C(OC(=O)/C=C/[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@H](C)C(=O)[C@@](C)(O)[C@H](O)[C@@H](C)C\C=C\C=C1)[C@H]2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K19 compound treatment 558012.5523 -3500.0 -0.02 581276.9231 37800.0 0.2 0.1305 0.6482 2141058 SMP1_000226 CCCCCc1cc(O)cc(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K20 compound treatment 602510.4603 41000.0 0.19 610704.5455 67300.0 0.36 0.386 0.9559 1001920 SMP1_000227 CNC[C@H](O)c1ccc(O)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K21 mock treatment 587975.3086 26500.0 0.12 594736.2637 51300.0 0.27 0.2787 0.9346 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K22 mock treatment 599478.4689 38000.0 0.18 596921.875 53500.0 0.28 0.3244 0.9731 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K23 mock treatment 588180.9045 26700.0 0.12 596408.1633 53000.0 0.28 0.2856 0.9313 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 K24 mock treatment 528979.1667 -32500.0 -0.15 532632.0755 -10800.0 -0.06 -0.1466 -0.9128 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L01 compound treatment 854887.8505 293000.0 1.35 744634.1463 201000.0 1.07 1.7113 0.9931 1000045 SMP1_000228 CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)C4[C@@]5(CO[C@@H]5C[C@H](O)[C@@]4(C)C1=O)OC(=O)C)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c6ccccc6)c7ccccc7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L02 compound treatment 750431.2796 189000.0 0.87 673758.427 130000.0 0.69 1.1048 0.9934 2141059 SMP1_000229 OC[C@H]1O[C@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@]2(O)CO)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L03 compound treatment 629280.9524 67800.0 0.31 756917.0732 213000.0 1.13 1.0217 0.8698 1066 SMP1_000230 OC1OCC=C2OC(=O)C=C12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L04 compound treatment 668810.0 107000.0 0.49 732797.7528 189000.0 1.0 1.0601 0.9468 652 SMP1_000231 COc1c(O)cc(O)c2c(=O)c(coc12)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L05 compound treatment 693268.6567 132000.0 0.61 768753.4247 225000.0 1.2 1.2747 0.9508 3199074 SMP1_000232 CC(=C)[C@H]1O[C@H]2CC[C@]3(C)[C@]4(C)C(CC[C@@]3(O)[C@@]52O[C@@H]5[C@H]1O)[C@@H]6OC(C)(C)[C@H]7C[C@@H]8C(=C)Cc9c(Cl)cc%10[nH]c4c6c%10c9[C@@]87O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L06 compound treatment 628568.0751 67100.0 0.31 699834.9515 156000.0 0.83 0.8052 0.9096 3470993 SMP1_000233 COC1C(O)C(C)OC(OC2CCC3(C=O)C(CCC4C3CCC5(C)C(CCC45O)C6=CC(=O)OC6)C2)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L07 compound treatment 625899.5984 64400.0 0.3 663362.6943 120000.0 0.64 0.6598 0.9398 907471 SMP1_000234 CC(O)C1NC(=O)C(C)NC(=O)C(CC(C)(O)CO)NC(=O)C2Cc3c(SCC(NC1=O)C(=O)N4CC(O)CC4C(=O)NC(C)C(=O)N2)[nH]c5ccccc35 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L08 compound treatment 497783.7838 -63700.0 -0.29 729012.8755 186000.0 0.98 0.4882 0.4752 1511 SMP1_000235 Oc1ccc(cc1)C2(OC(=O)c3ccccc32)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L09 compound treatment 541616.7883 -19900.0 -0.09 713207.5472 170000.0 0.9 0.5719 0.6318 3046406 SMP1_000236 Cc1ccc(cc1)N(CC2=NCCN2)c3cccc(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L10 compound treatment 470678.7004 -90800.0 -0.42 732014.0845 189000.0 1.0 0.4111 0.3791 924 SMP1_000237 NC(=N)NC(=N)Nc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L11 compound treatment 461461.8182 -100000.0 -0.46 654873.8739 111000.0 0.59 0.0917 0.1223 647 SMP1_000238 Oc1ccc(CCC(=O)c2c(O)cc(O)cc2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L12 compound treatment 510769.2308 -50700.0 -0.23 741965.5172 199000.0 1.05 0.5791 0.5369 1355 SMP1_000239 CC(C)(O)[C@@H]1[C@H]2OC(=O)[C@@H]1[C@]3(O)C[C@H]4O[C@]45C(=O)O[C@H]2[C@@]53C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L13 compound treatment 624660.6498 63100.0 0.29 689841.1215 146000.0 0.78 0.755 0.9104 3199166 SMP1_000240 C[C@H]1O[C@@H](O[C@@H]2C[C@@H]3O[C@@](O)(C[C@H](O)[C@H]3C(=O)O)C[C@@H](O)C[C@H]4O[C@@H]4C=CC(=O)O[C@H](C)CC=CC=CC=CC=C2)[C@@H](O)[C@@H](N)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L14 compound treatment 489196.4912 -72300.0 -0.33 632845.7944 89400.0 0.47 0.0995 0.1717 2117626 SMP1_000241 Fc1ccc(cc1)C(CCCN2CCC(CC2)n3c(=O)[nH]c4ccccc34)c5ccc(F)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L15 compound treatment 441118.8525 -120000.0 -0.56 584000.0 40600.0 0.22 -0.2405 -0.4038 1258 SMP1_000242 CCn1cc(C(=O)O)c(=O)c2cnc(nc12)N3CCNCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L16 compound treatment 426503.9063 -135000.0 -0.62 549989.7436 6560.0 0.03 -0.4157 -0.6666 1001531 SMP1_000243 COc1cc(cc(OC)c1OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@@H](O)c4cc5OCOc5cc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L17 compound treatment 456104.0892 -105000.0 -0.49 557224.8804 13800.0 0.07 -0.292 -0.594 3199167 SMP1_000244 CC(C)CC1NC(=O)C(Cc2ccccc2)NC(=O)C(CCN)NC(=O)C(CCNC(=O)C(NC(=O)C(CCN)NC(=O)C(CCN)NC1=O)C(C)O)NC(=O)C(CCN)NC(=O)C(N)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L18 compound treatment 623504.386 62000.0 0.29 695496.063 152000.0 0.81 0.7725 0.9027 3075229 SMP1_000245 OC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)C=Cc2ccc(O)c(O)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L19 compound treatment 566595.9596 5080.0 0.02 610076.5306 66600.0 0.35 0.2665 0.7524 3075230 SMP1_000246 CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L20 compound treatment 571549.1803 10000.0 0.05 597154.9296 53700.0 0.28 0.2342 0.8113 740 SMP1_000247 N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L21 mock treatment 595138.3929 33600.0 0.16 542775.1004 -659.0 0.0 0.1072 0.691 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L22 mock treatment 549034.6154 -12500.0 -0.06 661215.1394 118000.0 0.62 0.401 0.6393 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L23 mock treatment 690593.75 129000.0 0.6 538167.4641 -5270.0 -0.03 0.4012 0.6732 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 L24 mock treatment 578631.3725 17100.0 0.08 530064.2202 -13400.0 -0.07 0.0057 0.0535 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M01 compound treatment 221810.0 -340000.0 -1.57 144333.3333 -399000.0 -2.12 -2.6046 -0.989 3199168 SMP1_000248 CO[C@@H]([C@@H]1Cc2cc3cc(O[C@@H]4C[C@@H](O[C@@H]5C[C@@H](O)[C@@H](OC)[C@@H](C)O5)[C@H](OC(=O)C)[C@@H](C)O4)c(C)c(O)c3c(O)c2C(=O)[C@H]1O[C@H]6OC[C@@H](O[C@H]7OC[C@@H](O[C@H]8C[C@](C)(O)[C@@H](OC(=O)C)[C@H](C)O8)[C@H](O)[C@H]7C)[C@H](O)[C@H]6C)C(=O)[C@@H](O)[C@@H](C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M02 compound treatment 809034.4828 248000.0 1.14 604989.9497 61600.0 0.33 1.038 0.8743 3075231 SMP1_000249 CCCCCCCCCCCCCC=CC(O)C(N)C(O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M03 compound treatment 687291.0798 126000.0 0.58 674134.3284 131000.0 0.69 0.9003 0.9961 3075232 SMP1_000250 COc1ccc(C[C@@H](N)C(=O)N[C@H]2[C@@H](O)[C@@H](O[C@@H]2CO)n3cnc4c(ncnc34)N(C)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M04 compound treatment 732734.2342 171000.0 0.79 746666.6667 203000.0 1.08 1.3206 0.9883 3075233 SMP1_000251 CC(C)[C@H](CO)Nc1nc(Nc2cccc(Cl)c2)c3ncn(C(C)C)c3n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M05 compound treatment 750089.6226 189000.0 0.87 773226.4151 230000.0 1.22 1.4768 0.9863 353 SMP1_000252 Oc1cc(O)c2c(=O)c(O)c(oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M06 compound treatment 630530.9735 69000.0 0.32 602855.7214 59400.0 0.32 0.4479 1.0 3199169 SMP1_000253 C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M07 compound treatment 689807.6923 128000.0 0.59 555775.0 12300.0 0.07 0.4646 0.7806 3199170 SMP1_000254 COc1ccc2nccc([C@@H](O)[C@@H]3CC4CCN3C[C@H]4C=C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M08 compound treatment 829146.2451 268000.0 1.23 548750.0 5320.0 0.03 0.8927 0.7231 3199171 SMP1_000255 CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)C=C(C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)C=CC=CC=C(C)[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N4CCCC[C@H]4C(=O)O2)OC)CC[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M09 compound treatment 559858.4071 -1650.0 -0.01 579522.0884 36100.0 0.19 0.13 0.6784 1011756 SMP1_000256 Oc1ccc2nc3ccc(=O)cc3oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M10 compound treatment 608245.7627 46700.0 0.22 631472.6368 88000.0 0.47 0.4826 0.9383 1652119 SMP1_000257 Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M11 compound treatment 603617.0213 42100.0 0.19 681666.6667 138000.0 0.73 0.6557 0.8646 2141060 SMP1_000258 CC(=CCO)C=CC=C(C)C=CC1=C(C)CCCC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M12 compound treatment 591544.6429 30000.0 0.14 581228.0702 37800.0 0.2 0.2397 0.9837 3199172 SMP1_000259 C/C=C/1\C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@H]32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M13 compound treatment 722175.7813 161000.0 0.74 678386.7925 135000.0 0.72 1.0301 0.9999 3075417 SMP1_000260 COc1ccc(C=Cc2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M14 compound treatment 650583.6735 89100.0 0.41 560677.2487 17200.0 0.09 0.3551 0.8439 1380 SMP1_000261 NC(=O)c1ncn(n1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M15 compound treatment 458528.2051 -103000.0 -0.47 559806.7227 16400.0 0.09 -0.2744 -0.5684 2141061 SMP1_000262 Cc1cc2nc3c(=O)[nH]c(=O)nc3n(C[C@@H](O)[C@@H](O)[C@@H](O)CO)c2cc1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M16 compound treatment 529990.5213 -31500.0 -0.15 550502.6455 7070.0 0.04 -0.0763 -0.5081 2551 SMP1_000263 COc1cc(NC(C)CCCN)c2ncccc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M17 compound treatment 62772.7273 -499000.0 -2.3 94875.0 -449000.0 -2.38 -3.3087 -0.9999 3199174 SMP1_000264 COC1C=COC2(C)Oc3c(C2=O)c4c(O)c(C=NN5CCN(C)CC5)c(NC(=O)C(=CC=CC(C)C(O)C(C)C(O)C(C)C(C1C)C(=O)OC)C)c(O)c4c(O)c3C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M18 compound treatment 549787.3303 -11700.0 -0.05 532672.8111 -10800.0 -0.06 -0.0786 -0.9996 2141062 SMP1_000265 CC[C@@H](C)[C@H]1NC(=O)[C@@H](NC(=O)[C@H](C)[C@H](O)C(C)C)[C@@H](C)OC(=O)C2COC(=O)CNC(=O)/C=C/[C@](O)(CCl)[C@@H](C)Oc3ccc(cc3)[C@H](NC1=O)C(=O)N(C)[C@@H](Cc4ccccc4)C(=O)N[C@H]([C@@H](C)O)C(=O)N2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M19 compound treatment 523325.3012 -38200.0 -0.18 612938.326 69500.0 0.37 0.1362 0.3333 291 SMP1_000266 CC[C@H](CO)Nc1nc(NCc2ccccc2)c3ncn(C(C)C)c3n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M20 compound treatment 588508.4746 27000.0 0.12 606511.2108 63100.0 0.33 0.3246 0.9093 2141063 SMP1_000267 N[C@@H](CCCNC=NNO)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M21 mock treatment 548459.4595 -13100.0 -0.06 506811.7155 -36600.0 -0.19 -0.1799 -0.8847 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M22 mock treatment 532432.3308 -29100.0 -0.13 524458.6777 -19000.0 -0.1 -0.166 -0.99 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M23 mock treatment 598192.7711 36700.0 0.17 562904.5643 19500.0 0.1 0.1926 0.972 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 M24 mock treatment 507269.2308 -54200.0 -0.25 450402.0619 -93000.0 -0.49 -0.5258 -0.9504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N01 compound treatment 553972.5275 -7540.0 -0.03 617412.0879 74000.0 0.39 0.2529 0.6419 1523 SMP1_000268 CC(C)(C)NCC(O)c1ccc(O)c(CO)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N02 compound treatment 596476.9231 35000.0 0.16 654047.619 111000.0 0.59 0.5289 0.8692 3471131 SMP1_000269 CCC(C1CCC(C)C(O1)C(C)C(O)C(C)C(=O)C(CC)C2OC3(OC4(CCC(C)(O4)C5CCC(O)(CC)C(C)O5)C(O)C=C3)C(C)CC2C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N03 compound treatment 797449.7817 236000.0 1.09 653151.3514 110000.0 0.58 1.1809 0.957 3075421 SMP1_000270 CN1[C@H]2C[C@@H](C[C@@H]1[C@H]3O[C@H]32)OC(=O)[C@H](CO)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N04 compound treatment 834785.3881 273000.0 1.26 777227.4882 234000.0 1.24 1.768 1.0 3199176 SMP1_000271 OC[C@H]1O[C@@H](Oc2cccc3[C@@H]([C@@H]4c5cccc(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)c5C(=O)c7c(O)cc(cc47)C(=O)O)c8cc(cc(O)c8C(=O)c23)C(=O)O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N05 compound treatment 714945.2736 153000.0 0.71 636197.0443 92800.0 0.49 0.8482 0.9842 429 SMP1_000272 NCCc1c[nH]c2ccc(O)cc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N06 compound treatment 883941.1765 322000.0 1.49 652768.5185 109000.0 0.58 1.4615 0.9157 2141064 SMP1_000273 COC1=C[C@@H]2[C@@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N07 compound treatment 763351.2397 202000.0 0.93 588479.3814 45000.0 0.24 0.8271 0.8607 3069775 SMP1_000274 CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N08 compound treatment 649107.7586 87600.0 0.4 717966.9811 175000.0 0.93 0.9402 0.9309 3199177 SMP1_000275 C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]23C)O[C@@]61CC[C@@H](C)CO6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N09 compound treatment 584807.8818 23300.0 0.11 670469.0722 127000.0 0.67 0.5524 0.8096 795 SMP1_000276 CN[C@@H]1[C@H](O)[C@H](NC)[C@H]2O[C@]3(O)[C@@H](O[C@H](C)CC3=O)O[C@@H]2[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N10 compound treatment 725058.5938 164000.0 0.75 617166.6667 73700.0 0.39 0.8098 0.9532 2141065 SMP1_000277 CCCCCCCCCCCCCC=C[C@@H](O)[C@@H](N)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N11 compound treatment 144882.3529 -417000.0 -1.92 144085.1064 -399000.0 -2.12 -2.8563 -0.9988 688 SMP1_000278 CO[C@H]1[C@H](O)CC(=O)O[C@@H](C)CC=CC=C[C@H](O[C@H]2CC[C@@H]([C@@H](C)O2)N(C)C)[C@H](C)C[C@H](CC=O)[C@@H]1O[C@@H]3O[C@H](C)[C@@H](O[C@H]4C[C@@](C)(O)[C@H](O)[C@H](C)O4)[C@@H]([C@H]3O)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N12 compound treatment 626086.758 64600.0 0.3 599189.1892 55800.0 0.3 0.4197 1.0 3075481 SMP1_000279 CN[C@H]1C[C@H]2O[C@@](C)([C@H]1OC)n3c4ccccc4c5c6CNC(=O)c6c7c8ccccc8n2c7c35 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N13 compound treatment 738203.6199 177000.0 0.81 763663.4146 220000.0 1.17 1.4021 0.9845 3075482 SMP1_000280 CC[C@H](C=C[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N14 compound treatment 645119.2661 83600.0 0.39 775296.1165 232000.0 1.23 1.1422 0.8863 324 SMP1_000281 Cn1cnc2c(NCc3ccccc3)nc(NCCO)nc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N15 compound treatment 679981.3084 118000.0 0.55 640485.0 97100.0 0.51 0.7503 0.9996 1149 SMP1_000282 CN(N=O)C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N16 compound treatment 639767.7725 78300.0 0.36 661789.4737 118000.0 0.63 0.6991 0.9654 1241 SMP1_000283 NC(=N)NS(=O)(=O)c1ccc(N)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N17 compound treatment 602675.9259 41200.0 0.19 523071.4286 -20400.0 -0.11 0.0579 0.2649 799 SMP1_000284 Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N18 compound treatment 573156.25 11600.0 0.05 528476.6355 -15000.0 -0.08 -0.0181 -0.1892 3199269 SMP1_000285 C[C@H](O)[C@H](O)[C@H]1CNc2[nH]c(N)nc(=O)c2N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N19 compound treatment 697334.8837 136000.0 0.63 634278.6885 90800.0 0.48 0.7836 0.9916 197 SMP1_000286 O[C@@H]1CN2CCC[C@@H](O)[C@@H]2[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N20 compound treatment 521063.4146 -40400.0 -0.19 648446.1538 105000.0 0.56 0.2619 0.446 999 SMP1_000287 CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCNC(C)C3)c(F)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N21 mock treatment 542866.6667 -18600.0 -0.09 519869.5652 -23600.0 -0.12 -0.1492 -0.9833 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N22 mock treatment 554692.6606 -6820.0 -0.03 527267.4897 -16200.0 -0.09 -0.0829 -0.9073 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N23 mock treatment 571068.4211 9560.0 0.04 483554.1667 -59900.0 -0.32 -0.1934 -0.6032 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 N24 mock treatment 617126.9841 55600.0 0.26 581863.8298 38400.0 0.2 0.3255 0.9935 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O01 compound treatment 62326.087 -499000.0 -2.3 64977.2727 -478000.0 -2.54 -3.4223 -0.9988 3199270 SMP1_000288 CN(C)[C@H]1[C@@H]2CC3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)C(=O)c4c(O)cccc4[C@@]3(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O02 compound treatment 683724.7706 122000.0 0.56 616669.7248 73200.0 0.39 0.6732 0.9835 2141066 SMP1_000289 CC[C@H]1O[C@@H]2O[C@@H](/C=C/C=C/C=C/c3oc(=O)cc(OC)c3C)[C@H](O)[C@]2(C)[C@@]1(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O03 compound treatment 715743.5897 154000.0 0.71 585076.555 41600.0 0.22 0.6591 0.885 2141067 SMP1_000290 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)cc3oc4cc(O)c(O)cc4c(=O)c3c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O04 compound treatment 668273.1278 107000.0 0.49 666779.8165 123000.0 0.65 0.8107 0.9902 856 SMP1_000291 Cn1c(=O)n(C)c2nc[nH]c2c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O05 compound treatment 685219.3878 124000.0 0.57 597291.2621 53900.0 0.29 0.6054 0.9489 1000110 SMP1_000292 CO[C@H]1[C@@H](C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)c6cc(OC)c(OC)c(OC)c6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O06 compound treatment 670283.105 109000.0 0.5 604550.2646 61100.0 0.32 0.5839 0.9777 3075485 SMP1_000293 O=c1cc[nH]c(=S)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O07 compound treatment 588671.4976 27200.0 0.13 643468.6192 100000.0 0.53 0.4637 0.8506 312 SMP1_000294 CCCCC[C@H](O)/C=C/[C@H]1OC(O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O08 compound treatment 713768.8679 152000.0 0.7 589664.7727 46200.0 0.25 0.6699 0.9007 3199272 SMP1_000295 C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC(=O)[C@]23C)O[C@@]61CCC(C)CO6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O09 compound treatment 459703.7037 -102000.0 -0.47 398800.0 -145000.0 -0.77 -0.8744 -0.9722 1813 SMP1_000296 N[C@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O10 compound treatment 600380.9524 38900.0 0.18 597135.0 53700.0 0.28 0.3282 0.9751 3075541 SMP1_000297 O=C1CNC2(CCN(CCc3ccccc3)CC2)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O11 compound treatment 630518.6916 69000.0 0.32 634941.704 91500.0 0.49 0.5682 0.9791 909 SMP1_000298 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O12 compound treatment 646863.2479 85400.0 0.39 628066.6667 84600.0 0.45 0.5957 0.9979 2141068 SMP1_000299 OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O13 compound treatment 595548.5437 34000.0 0.16 546219.1011 2780.0 0.01 0.1214 0.7702 1002008 SMP1_000300 C[C@@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]2C[C@@H](O)[C@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O14 compound treatment 644791.4894 83300.0 0.38 597063.6364 53600.0 0.28 0.4727 0.9891 3075542 SMP1_000301 Nc1nc(N)c(nc1Cl)C(=O)NC(=N)NCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O15 compound treatment 692674.5283 131000.0 0.6 560966.0194 17500.0 0.09 0.4935 0.8063 3199275 SMP1_000302 C[C@H]1O[C@@H](O[C@@H]2C[C@@H]3O[C@@](O)(C[C@H](O)[C@H]3C(=O)O)C[C@@H](O)C[C@@H](O)[C@H](O)CC[C@@H](O)C[C@@H](O)CC(=O)O[C@@H](C)[C@H](C)[C@H](O)[C@@H](C)C=CC=CC=CC=CC=CC=CC=C2)[C@@H](O)[C@@H](N)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O16 compound treatment 490387.2549 -71100.0 -0.33 543960.199 526.0 0.0 -0.23 -0.7011 3075543 SMP1_000303 C[C@H](C=C(C)C=CC(=O)NO)C(=O)c1ccc(cc1)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O17 compound treatment 559229.3578 -2280.0 -0.01 576400.0 33000.0 0.17 0.1162 0.6633 1075 SMP1_000304 CCN(Cc1ccncc1)C(=O)C(CO)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O18 compound treatment 575134.6154 13600.0 0.06 532269.0355 -11200.0 -0.06 0.0025 0.0295 1040 SMP1_000305 CC(C)CC1NC(=O)C(CCCN)NC(=O)C(NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CCC(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(Cc3ccccc3)NC(=O)C(Cc4ccccc4)NC(=O)C5CCCN5C(=O)C(Cc6ccccc6)NC1=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O19 compound treatment 360415.3846 -201000.0 -0.93 576383.8384 32900.0 0.17 -0.5322 -0.5639 3199276 SMP1_000306 CC(C)CCCCCCCCCCC/C=C/C(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CC(O)[C@H]2O[C@H]([C@H](O)[C@@H]2O)n3ccc(=O)[nH]c3=O)O[C@H]1O[C@@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4NC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O20 compound treatment 453657.6577 -108000.0 -0.5 468544.6009 -74900.0 -0.4 -0.6326 -0.9938 1000019 SMP1_000307 CO[C@@]12[C@H]3N[C@H]3CN2C4=C([C@H]1COC(=O)N)C(=O)C(=C(C)C4=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O21 mock treatment 592443.1373 30900.0 0.14 542402.5424 -1030.0 -0.01 0.097 0.6795 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O22 mock treatment 529040.4858 -32500.0 -0.15 529944.4444 -13500.0 -0.07 -0.1565 -0.9429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O23 mock treatment 548461.2069 -13100.0 -0.06 579590.4762 36200.0 0.19 0.093 0.4629 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 O24 mock treatment 504627.907 -56900.0 -0.26 505423.4234 -38000.0 -0.2 -0.3281 -0.9915 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P01 compound treatment 571548.5437 10000.0 0.05 546537.3134 3100.0 0.02 0.0444 0.9032 2141069 SMP1_000308 CC(=O)C1=C(O)[C@]2(C)C(=CC1=O)Oc3c2c(O)c(C)c(O)c3C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P02 compound treatment 576761.9048 15300.0 0.07 584464.455 41000.0 0.22 0.2036 0.8903 3075548 SMP1_000309 C[C@@H]1CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2[C@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P03 compound treatment 60042.5532 -501000.0 -2.31 55122.449 -488000.0 -2.59 -3.4667 -0.9984 3199277 SMP1_000310 CCCC(NC)C(=O)NC1C(O)c2ccc(Oc3cc4cc(Oc5ccc(cc5Cl)C(O)C6NC(=O)C(NC(=O)C4NC(=O)C(CC(=O)N)NC1=O)c7ccc(O)c(c7)-c8c(O)cc(O)cc8C(NC6=O)C(=O)O)c3OC9OC(CO)C(O)C(O)C9OC%10CC(C)(N)C(O)C(C)O%10)c(Cl)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P04 compound treatment 564397.9592 2890.0 0.01 650928.2051 107000.0 0.57 0.4126 0.7234 3075550 SMP1_000311 COc1ccc(cc1OC)C(=O)O[C@H]2CC[C@@]3(C)C4CC[C@@H]5C3(CC6(O)[C@@H]7CN8C[C@@H](C)CC[C@H]8[C@@](C)(O)C7(O)[C@@H](O)CC56O)O[C@@]42O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P05 compound treatment 551582.0106 -9930.0 -0.05 596374.2331 52900.0 0.28 0.1662 0.5841 1000109 SMP1_000312 Nc1ncnc2n(cnc12)[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P06 compound treatment 645657.4074 84100.0 0.39 640187.1921 96800.0 0.51 0.6373 0.9905 3177546 SMP1_000313 CCC1(O)CC2CN(C1)CCc3c([nH]c4ccccc34)[C@@](C2)(C(=O)OC)c5cc6c(cc5OC)N(C)C7[C@@]86CCN9CC=C[C@](CC)([C@H]98)[C@@H](OC(=O)C)[C@]7(O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P07 compound treatment 531065.3266 -30400.0 -0.14 540978.836 -2460.0 -0.01 -0.1085 -0.7694 3069234 SMP1_000314 CC[C@]1(CCCN2CCc3c4[C@@H]21)C[C@](O)(C(=O)OC)n4c5ccccc35 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P08 compound treatment 541053.6585 -20500.0 -0.09 521115.0 -22300.0 -0.12 -0.1504 -0.9937 3177541 SMP1_000315 CCC1(O)CC2CN(C1)CCc3c([nH]c4ccccc34)[C@@](C2)(C(=O)OC)c5cc6c(cc5OC)N(C=O)C7[C@@]86CCN9CC=C[C@](CC)([C@H]98)[C@@H](OC(=O)C)[C@]7(O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P09 compound treatment 551873.2394 -9640.0 -0.04 535412.037 -8020.0 -0.04 -0.0615 -0.9998 1000116 SMP1_000316 CC(=O)CC(c1ccccc1)c2c(O)c3ccccc3oc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P10 compound treatment 562666.6667 1150.0 0.01 565669.6429 22200.0 0.12 0.0872 0.7383 3199278 SMP1_000317 C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)C[C@@H](O)CC1(C)C)/C=C/C=C(\C)/C=C/[C@H]2C(=C[C@H](O)CC2(C)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P11 compound treatment 511556.701 -50000.0 -0.23 663150.0 120000.0 0.63 0.2861 0.4235 2141070 SMP1_000318 C[C@H](CCC=C(C)C)c1ccc(C)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P12 compound treatment 636390.5579 74900.0 0.35 548184.8341 4750.0 0.03 0.262 0.7567 1076 SMP1_000319 Cc1cccc(C)c1NC2=NCCCS2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P13 compound treatment 559476.4151 -2040.0 -0.01 527365.5914 -16100.0 -0.09 -0.0669 -0.7803 3000363 SMP1_000320 COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P14 compound treatment 593397.3214 31900.0 0.15 573237.3737 29800.0 0.16 0.2158 0.9993 3068881 SMP1_000321 CCCOc1ccccc1c2nc(=O)c3[nH]nnc3[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P15 compound treatment 571508.0214 10000.0 0.05 564611.1111 21200.0 0.11 0.112 0.9226 1002031 SMP1_000322 C[C@H]1CCCC(=O)CCCC=Cc2cc(O)cc(O)c2C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P16 compound treatment 528698.1132 -32800.0 -0.15 525378.5047 -18100.0 -0.1 -0.1747 -0.9756 3173242 SMP1_000323 Nc1nc2cc(Cl)ccc2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P17 compound treatment 676194.6903 115000.0 0.53 548898.6784 5460.0 0.03 0.3945 0.7447 2076 SMP1_000324 CCCCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(CC(C)CC(O)CCCCC(O)CC(O)C(C)N)OC(=O)CC(CC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P18 compound treatment 482686.6359 -78800.0 -0.36 493530.303 -49900.0 -0.26 -0.4442 -0.9879 3075553 SMP1_000325 O[C@@H]1Cc2c(O)cc(O)cc2O[C@H]1c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P19 compound treatment 573339.0558 11800.0 0.05 543034.4828 -400.0 0.0 0.0371 0.6791 1002002 SMP1_000326 O[C@@H]1CC(=C[C@@H](O)[C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P20 compound treatment 542027.3973 -19500.0 -0.09 479450.6438 -64000.0 -0.34 -0.3035 -0.8645 2141071 SMP1_000327 Nc1nc(=O)c2nc(cnc2[nH]1)[C@H](O)[C@H](O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P21 mock treatment 503271.4286 -58200.0 -0.27 481255.7252 -62200.0 -0.33 -0.4231 -0.9948 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P22 mock treatment 501186.6667 -60300.0 -0.28 442217.8988 -101000.0 -0.54 -0.5763 -0.9532 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P23 mock treatment 449505.102 -112000.0 -0.52 467009.2593 -76400.0 -0.41 -0.6519 -0.9928 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.1461 P24 mock treatment 491318.3673 -70200.0 -0.32 466500.0 -76900.0 -0.41 -0.5174 -0.9934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A01 compound treatment 556000.0 26300.0 0.12 488233.3333 5030.0 0.03 0.1047 0.8424 1205993 ChemDiv3_000001 Cc1cc(c(O)c(c1)C(C)(C)C)n2nc3ccc(Cl)cc3n2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A02 compound treatment 638401.6064 109000.0 0.5 508160.4278 25000.0 0.13 0.4482 0.8642 1044707 ChemDiv3_000002 OC(=O)c1ccccc1C(=O)c2ccc(cc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A03 compound treatment 555952.9412 26300.0 0.12 539886.6397 56700.0 0.3 0.2983 0.9202 1699093 ChemDiv3_000003 Cc1ccc(Nc2ccc3ncnc4-c5ccccc5C(=O)c2c43)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A04 compound treatment 649052.4345 119000.0 0.55 592260.7143 109000.0 0.58 0.7983 0.9997 3117569 ChemDiv3_000004 Clc1c(sc2ccccc12)C(=O)Nc3ccc(Cl)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A05 compound treatment 651778.2805 122000.0 0.56 405762.963 -77400.0 -0.41 0.1078 0.1546 1561677 ChemDiv3_000005 CCOC(=O)c1c(O)nc2c3ccccc3oc2c1c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A06 compound treatment 578427.9835 48800.0 0.22 522418.1185 39200.0 0.21 0.3061 0.9992 3117570 ChemDiv3_000006 CN(C)C(=O)C[n+]1ccc(/C=N/O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A07 compound treatment 775404.5455 246000.0 1.13 540712.5984 57500.0 0.31 1.017 0.8666 1166193 ChemDiv3_000007 CCCC1CCC(CC1)c2ccc(cc2)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A08 compound treatment 631298.7552 102000.0 0.47 505245.4874 22000.0 0.12 0.4141 0.8572 3019825 ChemDiv3_000008 C(c1ccccc1)[n+]2ccc(cc2)c3nc4ccccc4s3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A09 compound treatment 564863.8743 35200.0 0.16 155857.1429 -327000.0 -1.74 -1.1129 -0.6382 1640201 ChemDiv3_000009 CCCc1ccc(OC(=O)c2ccc(O)cc2Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A10 compound treatment 655000.0 125000.0 0.58 584435.2332 101000.0 0.54 0.7884 0.9993 1305993 ChemDiv3_000010 Cc1sc(N)nc1C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A11 compound treatment 606677.13 77000.0 0.36 543516.8067 60300.0 0.32 0.4773 0.9986 3019826 ChemDiv3_000011 CCN1C(=O)/C(=C/C=C\2/Sc3ccccc3N2CC)/SC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A12 compound treatment 779175.7813 250000.0 1.15 608549.8282 125000.0 0.66 1.2837 0.966 1005107 ChemDiv3_000012 CC(C)(C)C(=O)C[n+]1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A13 compound treatment 651800.0 122000.0 0.56 556304.0 73100.0 0.39 0.6724 0.9834 1917998 ChemDiv3_000013 CN(C)c1ccc(cc1)c2n(C)c3ccccc3[n+]2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A14 compound treatment 586339.3665 56700.0 0.26 478210.5263 -4990.0 -0.03 0.1661 0.6322 3117571 ChemDiv3_000014 O/N=C/c1cc[n+](C/C=C\c2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A15 compound treatment 624261.4108 94600.0 0.44 578086.0656 94900.0 0.5 0.6643 0.9975 1511477 ChemDiv3_000015 Cc1ccc(cc1)S(=O)(=O)c2ccc(cc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A16 compound treatment 654511.2108 125000.0 0.58 587838.5827 105000.0 0.55 0.7995 0.9998 1463254 ChemDiv3_000016 C(CN1CCOCC1)Oc2ccc3ccccc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A17 compound treatment 769194.4444 240000.0 1.1 531985.782 48800.0 0.26 0.964 0.8497 1289110 ChemDiv3_000017 N#CC(=c1ccc(=C(C#N)c2ccc(cc2)N3CCCC3)cc1)C#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A18 compound treatment 654816.0377 125000.0 0.58 483213.5231 11.1 0.0 0.4081 0.7072 1594677 ChemDiv3_000018 CC(C)CN(CC(C)C)Cn1c(=O)oc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A19 compound treatment 669846.5347 140000.0 0.65 444093.4959 -39100.0 -0.21 0.3104 0.4572 1914297 ChemDiv3_000019 COc1ccc(/C=N/n2cnnc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A20 compound treatment 588735.5072 59100.0 0.27 383030.303 -100000.0 -0.53 -0.1831 -0.3066 1550111 ChemDiv3_000020 CC(C)C1CCC(C)C(C(O)c2ccc(cc2)c3ccccc3)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A21 compound treatment 501996.1538 -27700.0 -0.13 490856.1644 7650.0 0.04 -0.0615 -0.4595 3019827 ChemDiv3_000021 CN(C)c1ccc(/C=C/C=C/c2cc[n+](C)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A22 compound treatment 545864.4068 16200.0 0.07 505544.8505 22300.0 0.12 0.1366 0.9752 1470588 ChemDiv3_000022 Fc1ccccc1C(=O)Oc2cccc(OC(=O)c3ccccc3F)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A23 mock treatment 561009.5238 31300.0 0.14 499733.6066 16500.0 0.09 0.1642 0.9713 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 A24 mock treatment 556040.293 26400.0 0.12 475873.6059 -7330.0 -0.04 0.0585 0.4583 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B01 compound treatment 672179.6117 143000.0 0.66 533755.6391 50600.0 0.27 0.6543 0.9218 3117572 ChemDiv3_000023 COc1ccc(/C=N/c2ccc(OCC(O)CN3C(C)CCCC3C)cc2)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B02 compound treatment 782533.6323 253000.0 1.17 607053.0973 124000.0 0.66 1.2891 0.9631 1476169 ChemDiv3_000024 CC(C)(C)NC(=O)C1(CC2CC3C1)CC(C2)CC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B03 compound treatment 739440.8163 210000.0 0.97 611629.9559 128000.0 0.68 1.1657 0.9853 1164812 ChemDiv3_000025 O(c1ccccc1)c2cccc(Oc3ccccc3)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B04 compound treatment 722762.5 193000.0 0.89 583673.8197 100000.0 0.53 1.0065 0.9699 3019828 ChemDiv3_000026 Brc1ccc(/C=N/C2CCCCC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B05 compound treatment 517691.2752 -12000.0 -0.06 274649.0066 -209000.0 -1.11 -0.8212 -0.7415 2083946 ChemDiv3_000027 O=C(/C=C/c1ccccc1)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B06 compound treatment 652738.4615 123000.0 0.57 607889.3281 125000.0 0.66 0.869 0.9971 3117574 ChemDiv3_000028 CC1(CC2(C)CC3(C)C1)CC(C/N=C/c4ccc(O)cc4)(C2)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B07 compound treatment 629971.4286 100000.0 0.46 680949.0196 198000.0 1.05 1.0687 0.9323 1666537 ChemDiv3_000029 COC(=O)NCC1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B08 compound treatment 605915.8249 76200.0 0.35 538787.5458 55600.0 0.29 0.4571 0.9962 1021487 ChemDiv3_000030 C1CN(CCN1c2ccccn2)c3ccccn3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B09 compound treatment 631803.2129 102000.0 0.47 521613.5458 38400.0 0.2 0.4771 0.9297 3019829 ChemDiv3_000031 COc1ccc(/C=N/c2ccc(C)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B10 compound treatment 829916.3498 300000.0 1.38 599226.1484 116000.0 0.62 1.4142 0.9333 1699181 ChemDiv3_000032 Cc1c(NC(=O)c2ccccc2)c(=O)n(c3ccccc3)n1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B11 compound treatment 592683.2061 63000.0 0.29 576320.2847 93100.0 0.49 0.5547 0.968 3019830 ChemDiv3_000033 CC(C)Cc1ccc(cc1)C(C)C(=O)NC(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B12 compound treatment 631075.3138 101000.0 0.47 574828.7938 91600.0 0.49 0.6743 0.9998 3117575 ChemDiv3_000034 COc1ccc(/C=C/2\CC/C(=C\c3ccc(C)cc3)/C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B13 compound treatment 544082.6087 14400.0 0.07 506061.6438 22900.0 0.12 0.1327 0.96 1119180 ChemDiv3_000035 CNC(=O)c1ccc(Oc2ccc(cc2)C(=O)NC)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B14 compound treatment 509971.8876 -19700.0 -0.09 398059.5238 -85100.0 -0.45 -0.3836 -0.8327 1616129 ChemDiv3_000036 CC(=O)Nc1cccc(Oc2ccc3C(=O)N(C(=O)c3c2)c4ccc(Oc5ccc(C)c(C)c5)cc4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B15 compound treatment 526916.996 -2750.0 -0.01 521284.585 38100.0 0.2 0.1339 0.6614 1336672 ChemDiv3_000037 O=C(Nc1cc(=O)c2ccccc2o1)OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B16 compound treatment 487011.194 -42700.0 -0.2 538319.3277 55100.0 0.29 0.0676 0.1919 3117576 ChemDiv3_000038 CC[n+]1ccc(C)c2cc(ccc12)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B17 compound treatment 524468.1648 -5200.0 -0.02 305323.1441 -178000.0 -0.94 -0.6841 -0.7248 3019831 ChemDiv3_000039 NNC(=S)NC1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B18 compound treatment 680805.668 151000.0 0.7 624161.8257 141000.0 0.75 1.0215 0.9994 1270265 ChemDiv3_000040 Clc1ccc(cc1)S(=O)(=O)n2cnc3ccccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B19 compound treatment 642337.3494 113000.0 0.52 515599.3266 32400.0 0.17 0.4889 0.8934 3117577 ChemDiv3_000041 Cc1cc(nc2ccc3ccccc3c12)c4ccc5ccccc5n4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B20 compound treatment 492570.0326 -37100.0 -0.17 522609.4891 39400.0 0.21 0.0268 0.0993 1591919 ChemDiv3_000042 CNc1ccc(cc1)S(=O)(=O)c2ccc(NC)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B21 compound treatment 397988.8268 -132000.0 -0.61 337012.4224 -146000.0 -0.78 -0.9777 -0.9927 3117578 ChemDiv3_000043 O=C(C1=C(C(=O)c2ccccc2C1=O)c3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B22 compound treatment 413272.7273 -116000.0 -0.54 401833.3333 -81400.0 -0.43 -0.6847 -0.9942 1583295 ChemDiv3_000044 Brc1ccc(OC(=O)c2cccnc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B23 mock treatment 592218.75 62600.0 0.29 489890.1099 6690.0 0.04 0.2291 0.7881 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 B24 mock treatment 572986.711 43300.0 0.2 496853.7415 13700.0 0.07 0.1925 0.9057 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C01 compound treatment 709495.1923 180000.0 0.83 512232.7273 29000.0 0.15 0.6953 0.8243 3019835 ChemDiv3_000045 Cc1ccn(CN2CCN(Cn3ccc(C)n3)C2=S)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C02 compound treatment 589066.4063 59400.0 0.27 386706.7669 -96500.0 -0.51 -0.1682 -0.2898 1183514 ChemDiv3_000046 CC(=O)Oc1ccc(C(=O)c2ccccc2)c(OC(=O)C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C03 compound treatment 759637.1681 230000.0 1.06 479899.5633 -3300.0 -0.02 0.7375 0.6953 1699403 ChemDiv3_000047 O=C(NC1(CCC(=O)O1)C(=O)OCc2ccccc2)OCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C04 compound treatment 753442.5532 224000.0 1.03 612823.7548 130000.0 0.69 1.2159 0.9805 3019836 ChemDiv3_000048 COc1ccc(NC(=S)C)cc1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C05 compound treatment 639653.0612 110000.0 0.51 582906.383 99700.0 0.53 0.7326 0.9998 3019837 ChemDiv3_000049 Clc1ccc(OC(=O)c2ccc(Br)cc2)c(Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C06 compound treatment 572084.2491 42400.0 0.2 617066.6667 134000.0 0.71 0.6404 0.8695 3117579 ChemDiv3_000050 CC(C)N(C(C)C)C(=O)C[n+]1ccc(/C=N/O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C07 compound treatment 589335.7664 59700.0 0.28 600767.2727 118000.0 0.62 0.6355 0.9324 1112119 ChemDiv3_000051 CC(=O)Oc1ccc(cc1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C08 compound treatment 602400.6969 72700.0 0.34 571393.3054 88200.0 0.47 0.5679 0.9867 1921020 ChemDiv3_000052 CC[n+]1cccc(c1)c2nc3ccccc3s2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C09 compound treatment 106622.2222 -423000.0 -1.95 90186.0465 -393000.0 -2.08 -2.8535 -0.9995 1233273 ChemDiv3_000053 CCN1CCN(CC1)c2ccc(Nc3ccnc4cc5ccccc5cc34)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C10 compound treatment 671016.5289 141000.0 0.65 546274.5763 63100.0 0.33 0.6975 0.952 3019838 ChemDiv3_000054 NC(=O)N1CCc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C11 compound treatment 391474.2857 -138000.0 -0.64 212151.1628 -271000.0 -1.44 -1.4672 -0.933 1021994 ChemDiv3_000055 Oc1ccc(cc1)C2(CCCCC2)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C12 compound treatment 600012.4481 70300.0 0.32 626736.2205 144000.0 0.76 0.7677 0.9277 3019839 ChemDiv3_000056 CC(C)(C)OC(=O)C[n+]1cccc(c1)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C13 compound treatment 625872.0 96200.0 0.44 602121.3235 119000.0 0.63 0.7597 0.9852 3117584 ChemDiv3_000057 O=C1CN(C(=O)N1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C14 compound treatment 666773.5043 137000.0 0.63 573301.4706 90100.0 0.48 0.785 0.9905 3019840 ChemDiv3_000058 O/N=C/c1cc[n+](CC(=O)N2CCCCC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C15 compound treatment 625656.5217 96000.0 0.44 549625.498 66400.0 0.35 0.5621 0.9936 1320550 ChemDiv3_000059 COC(=O)CCS(=O)(=O)c1cccc2c(cccc12)S(=O)(=O)CCC(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C16 compound treatment 591481.0606 61800.0 0.29 487053.8117 3850.0 0.02 0.216 0.7558 1778026 ChemDiv3_000060 OCc1c(CO)[n+]([O-])c2ccccc2[n+]1[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C17 compound treatment 489070.8333 -40600.0 -0.19 530068.3453 46900.0 0.25 0.0434 0.1394 3019841 ChemDiv3_000061 Cc1ccc(cc1)C(=O)C2C(=O)c3ccccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C18 compound treatment 612627.2727 83000.0 0.38 523901.7857 40700.0 0.22 0.4232 0.9633 1353751 ChemDiv3_000062 Clc1cccc(NCn2c(=O)oc3ccccc23)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C19 compound treatment 632372.9508 103000.0 0.47 622143.3447 139000.0 0.74 0.856 0.9772 1912422 ChemDiv3_000063 CCc1ccc(/N=C/c2c[nH]c3ccccc23)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C20 compound treatment 576098.4252 46400.0 0.21 482228.5714 -974.0 -0.01 0.1478 0.6898 1318161 ChemDiv3_000064 C(N1CCOCCN(Cc2ccccc2)CCOCC1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C21 compound treatment 579120.0 49500.0 0.23 559333.3333 76100.0 0.4 0.4468 0.9634 1038768 ChemDiv3_000065 CCN(CC)c1ccc2c(C)cc(=O)oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C22 compound treatment 542413.4276 12700.0 0.06 456156.25 -27000.0 -0.14 -0.0599 -0.3862 3019842 ChemDiv3_000066 O=C(Oc1ccc(cc1)c2ccccc2)c3cccs3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C23 mock treatment 575478.1022 45800.0 0.21 424579.1855 -58600.0 -0.31 -0.0705 -0.1875 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 C24 mock treatment 634813.4328 105000.0 0.48 481283.4646 -1920.0 -0.01 0.3357 0.6921 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D01 compound treatment 566757.1429 37100.0 0.17 537517.5439 54300.0 0.29 0.3247 0.969 3117585 ChemDiv3_000067 C(Sc1nnnn1c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D02 compound treatment 707319.6721 178000.0 0.82 638586.3636 155000.0 0.82 1.1621 1.0 3117586 ChemDiv3_000068 CC(C)(C)C(/C=C/c1ccc(Cl)cc1Cl)n2nnnc2C(C)(C)N3CCOCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D03 compound treatment 665919.4313 136000.0 0.63 674894.5313 192000.0 1.02 1.1632 0.9732 1053376 ChemDiv3_000069 OC(=O)C1C(C(C1c2ccccc2)C(=O)O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D04 compound treatment 690783.1325 161000.0 0.74 459099.5475 -24100.0 -0.13 0.435 0.577 3117587 ChemDiv3_000070 O=C(/C=C/N1C(=O)c2ccccc2C1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D05 compound treatment 531109.0909 1440.0 0.01 163703.125 -319000.0 -1.69 -1.1936 -0.7043 3019843 ChemDiv3_000071 c1cncc(c1)c2cccnc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D06 compound treatment 734478.8136 205000.0 0.94 624587.5 141000.0 0.75 1.1981 0.9935 1343691 ChemDiv3_000072 CCN(C)CC1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D07 compound treatment 657511.3122 128000.0 0.59 714012.1457 231000.0 1.22 1.2825 0.9439 1187732 ChemDiv3_000073 COC(=O)NC1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D08 compound treatment 110843.1373 -419000.0 -1.93 238644.7368 -245000.0 -1.3 -2.283 -0.9812 1355186 ChemDiv3_000074 Nc1ccc(Sc2ccc3ccccc3c2Cl)c(Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D09 compound treatment 686627.1186 157000.0 0.72 621012.0968 138000.0 0.73 1.0287 1.0 1016949 ChemDiv3_000075 NC(=N)NC(=N)NCc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D10 compound treatment 685007.5758 155000.0 0.72 567033.0033 83800.0 0.44 0.821 0.9737 1392304 ChemDiv3_000076 Clc1ccc(cc1)c2nnc(o2)C3CCC(CC3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D11 compound treatment 646445.4976 117000.0 0.54 517733.3333 34500.0 0.18 0.5103 0.8971 1388409 ChemDiv3_000077 S=c1sc2ccccc2n1CN3CCN(Cc4ccccc4)CC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D12 compound treatment 568542.8571 38900.0 0.18 707471.0425 224000.0 1.19 0.9679 0.8046 3117588 ChemDiv3_000078 COc1ccc(/C=C/2\CC/C(=C\c3ccc(Cl)cc3)/C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D13 compound treatment 161593.75 -368000.0 -1.7 120338.4615 -363000.0 -1.92 -2.5612 -0.998 1025986 ChemDiv3_000079 Cc1ccccc1NC(=O)c2cc3ccccc3cc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D14 compound treatment 591839.2157 62200.0 0.29 529362.8692 46200.0 0.24 0.3759 0.9969 1513086 ChemDiv3_000080 O=C(COc1ccc2ccccc2c1)NS(=O)(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D15 compound treatment 473773.2794 -55900.0 -0.26 474702.0408 -8500.0 -0.05 -0.2141 -0.8184 1550944 ChemDiv3_000081 O=C(N1CC(CC1=O)c2ccccc2)c3cccnc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D16 compound treatment 535680.4124 6010.0 0.03 496870.0787 13700.0 0.07 0.0709 0.913 1432699 ChemDiv3_000082 CCOC(=O)c1cccc(n1)C(=O)Nc2nc3ccc(OC)cc3s2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D17 compound treatment 566547.1698 36900.0 0.17 618365.7718 135000.0 0.72 0.6272 0.8512 1601789 ChemDiv3_000083 Cc1ccc(NC(=O)CC2(CC3CC4CC(C3)C2)C4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D18 compound treatment 508013.3929 -21700.0 -0.1 506093.9597 22900.0 0.12 0.0152 0.0969 3019844 ChemDiv3_000084 CC(C)OC(=O)n1c(=S)oc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D19 compound treatment 506606.4982 -23100.0 -0.11 591717.8423 109000.0 0.58 0.3318 0.5669 1581559 ChemDiv3_000085 O=C(Oc1ccc(OC(=O)c2ccccc2)cc1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D20 compound treatment 401709.6774 -128000.0 -0.59 334924.9012 -148000.0 -0.79 -0.9734 -0.99 3117589 ChemDiv3_000086 O=S(=O)(/C=C/c1ccccc1)N2C=Cc3ccccc3C2c4c[nH]c5ccccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D21 compound treatment 528359.8326 -1310.0 -0.01 485712.1212 2510.0 0.01 0.0051 0.3521 1529969 ChemDiv3_000087 Nc1nnc(s1)C(=O)c2ccccc2N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D22 compound treatment 356611.2853 -173000.0 -0.8 361872.4832 -121000.0 -0.64 -1.0194 -0.9943 1119404 ChemDiv3_000088 CCCC1CCC(CC1)c2ccc(OC(=O)c3cccnc3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D23 mock treatment 480217.7122 -49500.0 -0.23 475496.0317 -7710.0 -0.04 -0.1902 -0.8208 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 D24 mock treatment 527940.0 -1730.0 -0.01 477472.028 -5730.0 -0.03 -0.0271 -0.8633 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E01 compound treatment 619592.9204 89900.0 0.41 493000.0 9800.0 0.05 0.33 0.7895 3019845 ChemDiv3_000089 C1OC(OCC2OC(OC12)c3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E02 compound treatment 414569.3431 -115000.0 -0.53 335000.0 -148000.0 -0.79 -0.9312 -0.9817 1616713 ChemDiv3_000090 CCCOc1ccc(N)cc1N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E03 compound treatment 642868.2927 113000.0 0.52 594537.8486 111000.0 0.59 0.7867 0.9981 3117590 ChemDiv3_000091 COc1ccc(cc1OC)C(=O)CN2Cc3ccccc3C2=N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E04 compound treatment 699518.3486 170000.0 0.78 567708.8123 84500.0 0.45 0.8708 0.9649 3019846 ChemDiv3_000092 COc1ccc(NC(=O)C)cc1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E05 compound treatment 615441.3146 85800.0 0.4 603404.9587 120000.0 0.64 0.7305 0.9736 3019847 ChemDiv3_000093 Nc1nc(cc[n+]1[O-])c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E06 compound treatment 558226.8519 28600.0 0.13 593837.6384 111000.0 0.59 0.5081 0.8448 3117591 ChemDiv3_000094 O/N=C/c1cc[n+](CC(=O)NC2CCCCC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E07 compound treatment 579593.0233 49900.0 0.23 651393.2203 168000.0 0.89 0.7936 0.8614 1701731 ChemDiv3_000095 CCc1ccc(cc1)C(=O)Oc2ccc(C#N)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E08 compound treatment 511704.1199 -18000.0 -0.08 491885.8131 8680.0 0.05 -0.026 -0.2744 1069596 ChemDiv3_000096 COC(=O)N1C(C=Cc2ccccc12)C#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E09 compound treatment 516764.7059 -12900.0 -0.06 420092.511 -63100.0 -0.33 -0.2788 -0.82 3019848 ChemDiv3_000097 N/N=C/c1ccc(cc1)S(=O)(=O)c2ccc(Cl)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E10 compound treatment 656719.8444 127000.0 0.59 689322.449 206000.0 1.09 1.1874 0.9573 3117592 ChemDiv3_000098 CN1CCN(CC1)C(=O)/C=C(/C)\C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E11 compound treatment 507520.2952 -22100.0 -0.1 433585.8586 -49600.0 -0.26 -0.2583 -0.915 1026004 ChemDiv3_000099 COc1ccc2ccccc2c1c3c(OC)ccc4ccccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E12 compound treatment 522710.2041 -6960.0 -0.03 533849.2647 50600.0 0.27 0.1673 0.6182 3019849 ChemDiv3_000100 CC(C)(C)C(=O)C[n+]1cccc(c1)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E13 compound treatment 689906.015 160000.0 0.74 645187.5 162000.0 0.86 1.13 0.9972 1049039 ChemDiv3_000101 CC(=O)N(Nc1ccccc1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E14 compound treatment 521077.2201 -8590.0 -0.04 593392.4528 110000.0 0.58 0.3853 0.6577 3117593 ChemDiv3_000102 O/N=C/c1ccc[n+](CC(=O)NC2(CC3CC4CC(C3)C2)C4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E15 compound treatment 558497.8166 28800.0 0.13 616181.8182 133000.0 0.71 0.5927 0.8259 3019850 ChemDiv3_000103 CSc1ccc(cc1)c2ccc(SC)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E16 compound treatment 349234.9727 -180000.0 -0.83 396022.7273 -87200.0 -0.46 -0.9153 -0.9616 3019851 ChemDiv3_000104 Nc1ccc(cc1)S(=O)(=O)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E17 compound treatment 495536.4807 -34100.0 -0.16 562303.5714 79100.0 0.42 0.1854 0.4137 1913805 ChemDiv3_000105 CC(C)(C)OC(=O)Nc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E18 compound treatment 528600.0 -1070.0 0.0 515017.7936 31800.0 0.17 0.1158 0.6862 1334112 ChemDiv3_000106 Cc1ccc(NCn2c(=O)oc3ccccc23)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E19 compound treatment 600514.9254 70800.0 0.33 522442.1053 39200.0 0.21 0.3782 0.9763 1464160 ChemDiv3_000107 OCCNC(=O)c1cc2ccccc2oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E20 compound treatment 520121.9512 -9550.0 -0.04 552044.9438 68800.0 0.37 0.2271 0.6174 1484925 ChemDiv3_000108 CC(NS(=O)(=O)c1ccc(C)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E21 compound treatment 438777.7778 -90900.0 -0.42 507008.4388 23800.0 0.13 -0.2071 -0.4731 3117594 ChemDiv3_000109 [O-][S+]1NN([S+]([O-])NN1c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E22 compound treatment 461656.25 -68000.0 -0.31 477490.2724 -5710.0 -0.03 -0.2432 -0.7718 1033254 ChemDiv3_000110 COc1cc(NCCCC(C)N)c2ncccc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E23 mock treatment 581404.8583 51700.0 0.24 500180.5054 17000.0 0.09 0.2324 0.9112 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 E24 mock treatment 550574.9129 20900.0 0.1 527971.1934 44800.0 0.24 0.2361 0.9212 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F01 compound treatment 595651.2821 66000.0 0.3 549547.8723 66300.0 0.35 0.464 0.9974 1915982 ChemDiv3_000111 O=C1NC(=O)/C(=C/c2ccccc2)/C(=O)N1Cc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F02 compound treatment 549475.5245 19800.0 0.09 447539.0071 -35700.0 -0.19 -0.0692 -0.3293 1272580 ChemDiv3_000112 CC(=C)CN1c2ccccc2Sc3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F03 compound treatment 470443.9024 -59200.0 -0.27 388649.5726 -94600.0 -0.5 -0.5477 -0.9592 1220799 ChemDiv3_000113 Cc1ccc(Nc2ccc3noc4-c5ccccc5C(=O)c2c43)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F04 compound treatment 764746.6063 235000.0 1.08 626494.2085 143000.0 0.76 1.304 0.9849 1191611 ChemDiv3_000114 O=c1oc2ccccc2c(Nc3ccccc3)c1CN4CCCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F05 compound treatment 673668.2028 144000.0 0.66 602403.8462 119000.0 0.63 0.9166 0.9997 1052238 ChemDiv3_000115 COc1ccc(C=C2C(=O)NC(=O)NC2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F06 compound treatment 659275.5556 130000.0 0.6 620652.8926 137000.0 0.73 0.9381 0.9951 1363766 ChemDiv3_000116 Cc1cccc(c1)N(CC(=O)O)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F07 compound treatment 423645.7143 -106000.0 -0.49 405930.5556 -77300.0 -0.41 -0.6355 -0.9962 1561715 ChemDiv3_000117 O=C(Nc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4)c5cccs5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F08 compound treatment 455867.8414 -73800.0 -0.34 506181.5287 23000.0 0.12 -0.1545 -0.4273 1160251 ChemDiv3_000118 CCCC1CCC(CC1)c2ccc(OC(=O)c3ccco3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F09 compound treatment 458243.3862 -71400.0 -0.33 420206.0302 -63000.0 -0.33 -0.4692 -1.0 1185575 ChemDiv3_000119 Cc1cc(F)ccc1S(=O)(=O)NCC2CC3CCC2C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F10 compound treatment 636419.7531 107000.0 0.49 576755.7252 93600.0 0.5 0.699 1.0 1298807 ChemDiv3_000120 OCC(O)C1OC(Nc2ccc(Cl)cc2)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F11 compound treatment 644176.2452 115000.0 0.53 587735.1916 105000.0 0.55 0.7655 0.9997 1454827 ChemDiv3_000121 CC(C)(c1ccccc1)c2cc(CN3CCOCC3)c(O)c(CN4CCOCC4)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F12 compound treatment 484150.0 -45500.0 -0.21 578299.6633 95100.0 0.5 0.2082 0.3811 1403981 ChemDiv3_000122 COc1ccc2oc(=O)c(cc2c1)c3cnc(C)s3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F13 compound treatment 569874.552 40200.0 0.19 666364.3123 183000.0 0.97 0.8181 0.8271 3117595 ChemDiv3_000123 O/N=C(\C(=O)c1ccccc1Cl)/n2cncn2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F14 compound treatment 564405.5118 34700.0 0.16 515528.4553 32300.0 0.17 0.2345 0.9994 3117598 ChemDiv3_000124 CC1(C)COP(=S)(OC1)C(Nc2ccc(Cl)cc2)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F15 compound treatment 615138.0753 85500.0 0.39 574503.876 91300.0 0.48 0.6211 0.9948 1605115 ChemDiv3_000125 Oc1ccccc1c2nsnc2C(=O)N3CCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F16 compound treatment 546167.3307 16500.0 0.08 616454.902 133000.0 0.71 0.5536 0.7787 1419832 ChemDiv3_000126 O=C(Oc1ccc(cc1)S(=O)(=O)c2ccc(OC(=O)c3cccs3)cc2)c4cccs4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F17 compound treatment 79080.6452 -451000.0 -2.08 187220.1835 -296000.0 -1.57 -2.5794 -0.9904 1721700 ChemDiv3_000127 COc1cccc(c1)C2(CCCC2)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F18 compound treatment 529748.8584 80.7 0.0 600917.603 118000.0 0.62 0.4418 0.7075 1321397 ChemDiv3_000128 Nc1ncn(CC(O)CO)c2nc(Br)nc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F19 compound treatment 494887.3239 -34800.0 -0.16 534122.1374 50900.0 0.27 0.0776 0.2469 3019915 ChemDiv3_000129 COc1ccc(cc1)C(=O)C[n+]2ccc3n(C)nnc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F20 compound treatment 479362.1795 -50300.0 -0.23 501575.2896 18400.0 0.1 -0.0951 -0.3781 1406847 ChemDiv3_000130 CCCC1CCC(CC1)c2ccc(OC(=O)c3cccs3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F21 compound treatment 477545.4545 -52100.0 -0.24 517579.8611 34400.0 0.18 -0.041 -0.136 1504493 ChemDiv3_000131 CC(=O)N1C(NC(=S)N)C(=O)c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F22 compound treatment 409982.684 -120000.0 -0.55 477676.4706 -5530.0 -0.03 -0.411 -0.7436 1667131 ChemDiv3_000132 CCOc1ccc(OC(=O)c2cccnc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F23 mock treatment 530680.3279 1010.0 0.0 506907.3359 23700.0 0.13 0.0922 0.7329 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 F24 mock treatment 592111.1111 62400.0 0.29 509469.9248 26300.0 0.14 0.3021 0.9445 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G01 compound treatment 535469.5652 5800.0 0.03 421471.2644 -61700.0 -0.33 -0.2126 -0.6472 1210291 ChemDiv3_000133 CN(C)CCOC(=O)c1ccc2[nH]c3CCSCc3c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G02 compound treatment 603014.218 73300.0 0.34 480281.746 -2920.0 -0.02 0.2282 0.674 1432983 ChemDiv3_000134 O=C(CC1(CC2CC3CC(C2)C1)C3)N4CCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G03 compound treatment 540531.1203 10900.0 0.05 469261.5385 -13900.0 -0.07 -0.0169 -0.1888 3019916 ChemDiv3_000135 CC(Cc1ccccc1)[n+]2cc(N)on2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G04 compound treatment 392283.6364 -137000.0 -0.63 297979.4239 -185000.0 -0.98 -1.1427 -0.9775 1091968 ChemDiv3_000136 Nc1ccc(Br)cc1C(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G05 compound treatment 481047.0588 -48600.0 -0.22 320404.4944 -163000.0 -0.86 -0.7691 -0.8621 1446265 ChemDiv3_000137 CC(=O)Oc1ccc2ccc3ccc(OC(=O)C)c4ccc1c2c34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G06 compound treatment 552694.2149 23000.0 0.11 489675.0 6470.0 0.03 0.0994 0.8903 3019918 ChemDiv3_000138 O/N=C/c1ccc[n+](CC(=O)NCc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G07 compound treatment 502601.3986 -27100.0 -0.12 510302.9197 27100.0 0.14 0.0134 0.0703 3117599 ChemDiv3_000139 CC1CCC/C(=C/c2ccc(Cl)cc2)/C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G08 compound treatment 397349.5935 -132000.0 -0.61 354671.5328 -129000.0 -0.68 -0.9135 -0.9985 1662647 ChemDiv3_000140 CCOC(=O)NC(=S)Nc1ccc(NC(=O)c2cc(Cl)ccc2O)c(Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G09 compound treatment 534485.9438 4820.0 0.02 518615.6863 35400.0 0.19 0.1485 0.7853 1320817 ChemDiv3_000141 CCN(CC)C(=O)N1CCN(CCC#N)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G10 compound treatment 512214.2857 -17500.0 -0.08 509527.5862 26300.0 0.14 0.0418 0.2595 1913999 ChemDiv3_000142 CC(Cc1c[nH]c2ccccc12)NC(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G11 compound treatment 480130.719 -49500.0 -0.23 484170.347 968.0 0.01 -0.1579 -0.691 3117600 ChemDiv3_000143 S=c1nc(oc2CCCCc21)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G12 compound treatment 427020.6612 -103000.0 -0.47 467147.8599 -16100.0 -0.09 -0.3949 -0.8211 3019921 ChemDiv3_000144 CC(C)(C)C(=O)C[n+]1ccc(cc1)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G13 compound treatment 425163.8655 -105000.0 -0.48 443750.0 -39500.0 -0.21 -0.4887 -0.9302 1032623 ChemDiv3_000145 O=C(N(Nc1ccccc1)c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G14 compound treatment 478561.1511 -51100.0 -0.24 551271.3178 68100.0 0.36 0.0886 0.2056 3117601 ChemDiv3_000146 OC(=O)c1ccc(NC(=O)C[n+]2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G15 compound treatment 440501.9455 -89200.0 -0.41 473170.0 -10000.0 -0.05 -0.3284 -0.792 3117602 ChemDiv3_000147 CSc1ccc(Sc2ccc(SC)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G16 compound treatment 452454.8611 -77200.0 -0.36 499241.7219 16000.0 0.09 -0.1916 -0.5234 1075919 ChemDiv3_000148 Clc1ccc(OCC(=O)NCCc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G17 compound treatment 375957.7465 -154000.0 -0.71 410746.3235 -72500.0 -0.38 -0.773 -0.9586 1146554 ChemDiv3_000149 OCC1(C(=O)c2ccccc2C1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G18 compound treatment 798702.381 269000.0 1.24 843038.674 360000.0 1.91 2.2269 0.9782 1723737 ChemDiv3_000150 NC(=S)c1cc2ccccc2oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G19 compound treatment 410470.3557 -119000.0 -0.55 436613.8614 -46600.0 -0.25 -0.5634 -0.9349 1601550 ChemDiv3_000151 COc1ccc(C2C(=O)c3ccccc3C2=O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G20 compound treatment 477436.0 -52200.0 -0.24 489649.8054 6450.0 0.03 -0.1461 -0.6007 1302822 ChemDiv3_000152 Cc1ccc(cc1)S(=O)(=O)N2CCCC2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G21 compound treatment 311293.617 -218000.0 -1.01 348393.8224 -135000.0 -0.72 -1.2177 -0.9859 3019795 ChemDiv3_000153 S=C1NN=C(C(N1)c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G22 compound treatment 507802.1583 -21900.0 -0.1 480329.2683 -2870.0 -0.02 -0.0821 -0.8048 1416806 ChemDiv3_000154 Nc1ccc(cc1)C(=O)Nc2ccc(cc2N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G23 mock treatment 479796.9925 -49900.0 -0.23 453159.2593 -30000.0 -0.16 -0.2753 -0.9839 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 G24 mock treatment 496349.6241 -33300.0 -0.15 441465.2778 -41700.0 -0.22 -0.2652 -0.9841 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H01 compound treatment 687412.9353 158000.0 0.73 547323.7705 64100.0 0.34 0.7549 0.94 1123126 ChemDiv3_000155 C(CN1CCOCC1)Sc2nc3ccccc3[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H02 compound treatment 583897.0588 54200.0 0.25 466934.4262 -16300.0 -0.09 0.1158 0.4378 3019817 ChemDiv3_000156 CCOC(=O)c1c(C)c(C)sc1/N=C/c2ccc(cc2)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H03 compound treatment 592372.9508 62700.0 0.29 572609.8485 89400.0 0.47 0.5398 0.9719 3117603 ChemDiv3_000157 CCOC(=O)c1c(C)c(C)sc1/N=C/c2ccccc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H04 compound treatment 644358.3333 115000.0 0.53 531834.6457 48600.0 0.26 0.5564 0.9455 3019818 ChemDiv3_000158 COc1ccc(cc1)N(C(=O)/C=C/c2ccc(OC)c(OC)c2)C3=CC4CCC(C3)N4C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H05 compound treatment 482668.2028 -47000.0 -0.22 432624.4541 -50600.0 -0.27 -0.343 -0.9944 1020750 ChemDiv3_000159 NC(=O)c1ccc[n+](CC(=O)c2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H06 compound treatment 585827.8689 56200.0 0.26 525803.4188 42600.0 0.23 0.3429 0.9977 1221336 ChemDiv3_000160 Cc1ccc(OC(=O)c2ccccc2)c(c1)n3nc4ccccc4n3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H07 compound treatment 431774.8344 -97900.0 -0.45 451231.8841 -32000.0 -0.17 -0.4391 -0.9106 1171342 ChemDiv3_000161 COC(=O)NC(=S)Nc1ccc(Oc2ccc(Cl)cc2Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H08 compound treatment 522082.2511 -7590.0 -0.03 577276.2238 94100.0 0.5 0.3281 0.6559 1054931 ChemDiv3_000162 O=C(Oc1ccc(cc1)c2ccccc2)c3ccco3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H09 compound treatment 491632.8671 -38000.0 -0.18 559475.1773 76300.0 0.4 0.162 0.3675 1080023 ChemDiv3_000163 O=C1C2C3CC(C=C3)C2C(=O)N1c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H10 compound treatment 360655.6017 -169000.0 -0.78 475400.8264 -7800.0 -0.04 -0.5804 -0.7436 1270809 ChemDiv3_000164 Cc1ccccc1C(=O)N2N=C(CC2c3nc4ccccc4[nH]3)c5ccc(Br)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H11 compound treatment 517695.8525 -12000.0 -0.06 589088.7097 106000.0 0.56 0.3581 0.6345 1111851 ChemDiv3_000165 OCc1nc2cc3ccccc3cc2[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H12 compound treatment 485354.1667 -44300.0 -0.2 505364.8069 22200.0 0.12 -0.0614 -0.2604 3117604 ChemDiv3_000166 O=C1N(C(=O)c2cc(ccc12)c3ncc(o3)c4ccccc4)c5ncn[nH]5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H13 compound treatment 393457.1429 -136000.0 -0.63 411793.8931 -71400.0 -0.38 -0.712 -0.9707 3019820 ChemDiv3_000167 Oc1ccccc1/C=N/n2c3ccccc3c4ccccc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H14 compound treatment 500162.1622 -29500.0 -0.14 534022.7273 50800.0 0.27 0.0944 0.3126 3117605 ChemDiv3_000168 C/N=C(\C)/c1c(O)c2ccccc2oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H15 compound treatment 71122.449 -459000.0 -2.11 45647.0588 -438000.0 -2.32 -3.1363 -0.9989 1279829 ChemDiv3_000169 Oc1ccccc1C2CCCCC2c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H16 compound treatment 447176.0 -82500.0 -0.38 508584.6154 25400.0 0.13 -0.1738 -0.4307 1311336 ChemDiv3_000170 Nc1cccc(NC(=O)c2cccc(c2)S(=O)(=O)Nc3cccc(N)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H17 compound treatment 206491.5254 -323000.0 -1.49 181857.1429 -301000.0 -1.6 -2.184 -0.9994 1341633 ChemDiv3_000171 Cc1cc(C)c2ccc(NN)nc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H18 compound treatment 424333.3333 -105000.0 -0.49 485398.524 2200.0 0.01 -0.3353 -0.69 3117606 ChemDiv3_000172 CC(=O)Nc1c(C)nn(c1O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H19 compound treatment 73333.3333 -456000.0 -2.1 28897.4359 -454000.0 -2.41 -3.1919 -0.9977 3019822 ChemDiv3_000173 COc1ccc2nc(C)cc(S)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H20 compound treatment 460734.127 -68900.0 -0.32 538021.4286 54800.0 0.29 -0.0192 -0.0445 1016095 ChemDiv3_000174 COC(=O)c1cccc(n1)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H21 compound treatment 436226.8371 -93400.0 -0.43 469032.7273 -14200.0 -0.08 -0.3578 -0.8181 1229822 ChemDiv3_000175 CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2ccc(I)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H22 compound treatment 410864.6154 -119000.0 -0.55 474523.4657 -8680.0 -0.05 -0.42 -0.7638 1484239 ChemDiv3_000176 CC(C)OC(=O)c1cccc(n1)C(=O)Nc2ccc(NC(=O)C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H23 mock treatment 474077.9221 -55600.0 -0.26 427955.6452 -55200.0 -0.29 -0.3885 -0.9978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 H24 mock treatment 484525.0 -45100.0 -0.21 480027.5591 -3170.0 -0.02 -0.1591 -0.7618 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I01 compound treatment 539665.0943 10000.0 0.05 464662.3932 -18500.0 -0.1 -0.0369 -0.3401 1528297 ChemDiv3_000177 CCN(CC)C(=O)COc1ccc(C)nc1CC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I02 compound treatment 538660.1563 8990.0 0.04 528694.2446 45500.0 0.24 0.1999 0.8167 1726229 ChemDiv3_000178 O=C(NC1CCCCC1)NC2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I03 compound treatment 641108.7866 111000.0 0.51 512388.0 29200.0 0.15 0.4729 0.881 1695838 ChemDiv3_000179 OC(=O)c1ccc2C(=O)c3ccccc3S(=O)(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I04 compound treatment 532924.0506 3260.0 0.02 512122.807 28900.0 0.15 0.1191 0.7726 1706757 ChemDiv3_000180 CCCN(CCC)C(=O)Cn1ccc(=N)c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I05 compound treatment 471865.4545 -57800.0 -0.27 501393.6652 18200.0 0.1 -0.1203 -0.4242 3019863 ChemDiv3_000181 OC(=O)c1ccc(cc1)c2ccc(Br)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I06 compound treatment 607315.0685 77600.0 0.36 546300.0 63100.0 0.33 0.4898 0.9994 3117607 ChemDiv3_000182 C[N+](C)(CCOc1ccccc1)Cc2ccccc2.OC(=O)c1cc2ccccc2c(Br)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I07 compound treatment 642738.5892 113000.0 0.52 582689.1386 99500.0 0.53 0.7418 1.0 1103446 ChemDiv3_000183 OC(=O)C(Cc1ccccc1)NC=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I08 compound treatment 324823.2932 -205000.0 -0.94 333068.9655 -150000.0 -0.8 -1.2311 -0.9964 3019864 ChemDiv3_000184 NC(=S)/N=C/1\CCCCC1=C2CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I09 compound treatment 504856.5891 -24800.0 -0.11 622122.1374 139000.0 0.74 0.4401 0.5902 3117608 ChemDiv3_000185 Clc1ccc(cc1)S(=O)(=O)/N=C/2\SCCN2S(=O)(=O)c3ccc(Cl)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I10 compound treatment 526207.6923 -3460.0 -0.02 566299.2701 83100.0 0.44 0.3004 0.6811 3019865 ChemDiv3_000186 NC(=O)c1ccc[n+](CC(=O)N(CC=C)CC=C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I11 compound treatment 563397.5904 33700.0 0.16 627811.8081 145000.0 0.77 0.6523 0.8335 1008424 ChemDiv3_000187 Nc1ccc(Sc2ccc(N)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I12 compound treatment 461724.0143 -67900.0 -0.31 501183.7607 18000.0 0.1 -0.1541 -0.4706 3117609 ChemDiv3_000188 CC(C)(C)OC(=O)C[n+]1ccc(cc1)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I13 compound treatment 658081.0811 128000.0 0.59 508831.3253 25600.0 0.14 0.5149 0.8474 1590292 ChemDiv3_000189 Cc1ccc(cc1)C(=O)Oc2cc(C)cc(OC(=O)c3ccc(C)cc3)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I14 compound treatment 468697.6744 -61000.0 -0.28 565238.9381 82000.0 0.44 0.1089 0.2101 3019866 ChemDiv3_000190 Brc1ccc2[n+](C/C=C/c3ccccc3)cccc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I15 compound treatment 470334.4948 -59300.0 -0.27 577017.301 93800.0 0.5 0.1584 0.2789 2121292 ChemDiv3_000191 Clc1ccc(cc1Cl)S(=O)(=O)Cc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I16 compound treatment 562480.9689 32800.0 0.15 626216.6065 143000.0 0.76 0.6434 0.8318 1483300 ChemDiv3_000192 COc1ccc(Cl)c(NCCC(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I17 compound treatment 464251.6779 -65400.0 -0.3 484031.3725 829.0 0.0 -0.2102 -0.6967 1243544 ChemDiv3_000193 CCOc1ccc(cc1OC)C2(CC(=O)Nc3ccccc3)C(=O)c4ccccc4C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I18 compound treatment 476407.0796 -53300.0 -0.25 470044.3548 -13200.0 -0.07 -0.223 -0.8734 1632789 ChemDiv3_000194 O=C(Nc1cccc2ccccc12)c3cc4ccccc4oc3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I19 compound treatment 540419.8473 10800.0 0.05 544117.6471 60900.0 0.32 0.2635 0.8062 1020326 ChemDiv3_000195 CCOC(=O)C1=C(O)c2ccccc2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I20 compound treatment 522574.6269 -7090.0 -0.03 565104.6931 81900.0 0.43 0.284 0.652 1160580 ChemDiv3_000196 OC(=O)C(Cc1cnc[nH]1)N2C(=O)c3ccccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I21 compound treatment 701766.0377 172000.0 0.79 603667.8832 120000.0 0.64 1.013 0.9942 1223725 ChemDiv3_000197 OC(=O)CC1(CC2CC3C1)CC(CC(=O)O)(C2)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I22 compound treatment 463958.3333 -65700.0 -0.3 518823.0769 35600.0 0.19 -0.0807 -0.2259 3019868 ChemDiv3_000198 OC(=O)c1ccc(C(=O)O)c(c1)c2nc3ccccc3s2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I23 mock treatment 587926.7016 58300.0 0.27 514944.6494 31700.0 0.17 0.309 0.9747 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 I24 mock treatment 577982.0628 48300.0 0.22 493674.4186 10500.0 0.06 0.1968 0.8571 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J01 compound treatment 625873.1707 96200.0 0.44 503759.8566 20600.0 0.11 0.3908 0.8554 3117610 ChemDiv3_000199 N/N=C(\C(=O)O)/c1ccccc1N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J02 compound treatment 560587.3016 30900.0 0.14 467293.8596 -15900.0 -0.08 0.0412 0.2484 3019869 ChemDiv3_000200 O=C(C[n+]1ccc(C#N)cc1)c2ccc(NC(=O)c3ccccc3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J03 compound treatment 584689.3204 55000.0 0.25 440653.2663 -42500.0 -0.23 0.0198 0.0584 3117612 ChemDiv3_000201 O=C(/C=C/c1c[nH]c2ccccc12)N3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J04 compound treatment 738827.4336 209000.0 0.96 672555.0 189000.0 1.0 1.3922 0.9998 1170304 ChemDiv3_000202 OC(=O)CCNc1cc(Cl)ccc1Oc2ccc(Cl)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J05 compound treatment 729230.4527 200000.0 0.92 543397.6378 60200.0 0.32 0.8765 0.8998 3019870 ChemDiv3_000203 O=C(C[n+]1cccc(NC(=O)c2ccccc2)c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J06 compound treatment 602026.087 72400.0 0.33 559068.1818 75900.0 0.4 0.5205 0.9957 1618034 ChemDiv3_000204 COc1ccc(cc1)N2C(=O)C3CC=CC(C)C3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J07 compound treatment 660022.5225 130000.0 0.6 631016.4609 148000.0 0.78 0.9794 0.9914 3117613 ChemDiv3_000205 CCn1c(C)[n+](CC)c2cc(ccc12)S(=O)(=O)NC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J08 compound treatment 274442.623 -255000.0 -1.18 239220.339 -244000.0 -1.29 -1.7473 -0.9989 1082227 ChemDiv3_000206 C(CSc1nc2ccccc2[nH]1)Sc3nc4ccccc4[nH]3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J09 compound treatment 661854.251 132000.0 0.61 631855.1724 149000.0 0.79 0.9886 0.9919 3019871 ChemDiv3_000207 Cc1ccc(cc1C)C(=O)c2ccc(C)c(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J10 compound treatment 627196.0784 97500.0 0.45 593385.4545 110000.0 0.58 0.7313 0.9916 1921766 ChemDiv3_000208 CC(/N=C/c1ccccc1O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J11 compound treatment 575184.5018 45500.0 0.21 506819.3277 23600.0 0.13 0.237 0.9696 1340958 ChemDiv3_000209 CCN(CC)CCSc1nnc2c3ccccc3n(CC(=O)N)c2n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J12 compound treatment 483305.0193 -46400.0 -0.21 492996.2547 9790.0 0.05 -0.1145 -0.5202 1421356 ChemDiv3_000210 O=C(Nc1nc(cs1)c2ccccc2)c3ccc(cc3)S(=O)(=O)N4CCCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J13 compound treatment 611887.0968 82200.0 0.38 597986.8421 115000.0 0.61 0.6986 0.974 3019898 ChemDiv3_000211 Oc1ccccc1/C=N/c2cccc(\N=C\c3ccccc3O)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J14 compound treatment 536385.159 6720.0 0.03 605748.0916 123000.0 0.65 0.4815 0.74 3117614 ChemDiv3_000212 Clc1ccc2[nH]c(=O)nc(c3ccccc3)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J15 compound treatment 52436.3636 -477000.0 -2.2 55530.6122 -428000.0 -2.27 -3.1602 -0.9999 1122932 ChemDiv3_000213 Oc1cc(cc(c1)C2CCCCC2)C3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J16 compound treatment 581604.2403 51900.0 0.24 535414.2259 52200.0 0.28 0.3652 0.9974 3117615 ChemDiv3_000214 CC(=O)NC1=NN(C(=O)C)C(C)(CS(=O)(=O)c2ccc(C)cc2)S1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J17 compound treatment 369247.619 -160000.0 -0.74 429888.8889 -53300.0 -0.28 -0.7231 -0.913 1730515 ChemDiv3_000215 CNc1ccc2cccc(Oc3ccc4cccc(O)c4n3)c2n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J18 compound treatment 493681.1024 -36000.0 -0.17 545193.0502 62000.0 0.33 0.1151 0.3126 1591676 ChemDiv3_000216 Nc1cccc(NC(=O)CCC(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J19 compound treatment 499136.5314 -30500.0 -0.14 566176.2452 83000.0 0.44 0.2116 0.458 3117616 ChemDiv3_000217 CC1(C)CC(CC(C)(C)N1)/N=C/c2ccco2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J20 compound treatment 474078.1759 -55600.0 -0.26 508128.0 24900.0 0.13 -0.0878 -0.3044 1528923 ChemDiv3_000218 CC(C)OC(=O)c1cccc(n1)C(=O)OC(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J21 compound treatment 750858.156 221000.0 1.02 783188.9764 300000.0 1.59 1.8464 0.9769 1320476 ChemDiv3_000219 OC(=O)CC(N1C(=O)c2ccccc2C1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J22 compound treatment 377729.0076 -152000.0 -0.7 468557.0175 -14600.0 -0.08 -0.5504 -0.7807 1009844 ChemDiv3_000220 Nc1cc(ccc1O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J23 mock treatment 450629.9213 -79000.0 -0.36 522125.4237 38900.0 0.21 -0.1118 -0.2668 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 J24 mock treatment 534572.8477 4900.0 0.02 469810.9091 -13400.0 -0.07 -0.0342 -0.4592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K01 compound treatment 569153.8462 39500.0 0.18 531474.4526 48300.0 0.26 0.3098 0.9861 1273679 ChemDiv3_000221 CCN(CC)CCOc1ccc2nc(sc2c1)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K02 compound treatment 656516.2602 127000.0 0.58 546887.6404 63700.0 0.34 0.6525 0.9659 1202625 ChemDiv3_000222 OCCC1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K03 compound treatment 568626.3736 39000.0 0.18 552163.9344 69000.0 0.37 0.3857 0.9464 1450413 ChemDiv3_000223 CS(=O)(=O)CS(=O)(=O)C1=C(C2CCN1CC2)N3CCOCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K04 compound treatment 570787.8788 41100.0 0.19 583761.7329 101000.0 0.53 0.5112 0.9031 1353143 ChemDiv3_000224 CC(C)N(C(C)C)C(=O)Cn1ccc(=N)c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K05 compound treatment 523731.0924 -5940.0 -0.03 671664.2599 188000.0 1.0 0.6875 0.6875 3117617 ChemDiv3_000225 CCCCc1ccc(CC(=O)O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K06 compound treatment 532466.9261 2800.0 0.01 554425.4545 71200.0 0.38 0.2762 0.7308 3019901 ChemDiv3_000226 CC[n+]1cccc(c1)c2nc3ccccc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K07 compound treatment 630254.2373 101000.0 0.46 687521.4521 204000.0 1.08 1.0943 0.9283 1058991 ChemDiv3_000227 CCc1ccc(CC(=S)N2CCOCC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K08 compound treatment 571062.5 41400.0 0.19 531022.7273 47800.0 0.25 0.3143 0.9902 1049850 ChemDiv3_000228 C(N1CCN(CC1)c2ccccc2)N3CCN(CC3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K09 compound treatment 647845.1883 118000.0 0.54 581003.7879 97800.0 0.52 0.7522 0.9997 1529951 ChemDiv3_000229 COc1ccc2N(C)C(=O)C(C)(CC#N)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K10 compound treatment 510771.9298 -18900.0 -0.09 558379.9283 75200.0 0.4 0.2203 0.5398 3117618 ChemDiv3_000230 NC(=O)c1cc[n+](CC(=O)N(CC=C)CC=C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K11 compound treatment 500503.937 -29200.0 -0.13 481677.2487 -1530.0 -0.01 -0.1008 -0.7483 1049796 ChemDiv3_000231 C[n+]1ccc(cc1)c2cc[n+](C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K12 compound treatment 493266.6667 -36400.0 -0.17 507389.1051 24200.0 0.13 -0.028 -0.1325 3117619 ChemDiv3_000232 O/N=C/c1ccc[n+](C/C=C/c2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K13 compound treatment 563606.6946 33900.0 0.16 674826.7974 192000.0 1.02 0.8294 0.8065 1377603 ChemDiv3_000233 Cc1cccc(NC(=O)c2cccc(c2)C(=O)Nc3cccc(C)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K14 compound treatment 482212.3288 -47500.0 -0.22 536906.5041 53700.0 0.28 0.0467 0.1299 3117620 ChemDiv3_000234 NC(=O)NC(=O)C[n+]1ccc(/C=N/O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K15 compound treatment 580191.7808 50500.0 0.23 627750.0 145000.0 0.77 0.7069 0.8822 1086380 ChemDiv3_000235 Brc1ccc(cc1)S(=O)(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K16 compound treatment 527867.1875 -1800.0 -0.01 619640.4494 136000.0 0.72 0.5058 0.6989 3117621 ChemDiv3_000236 OC(=O)CN(CCc1ccccc1)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K17 compound treatment 373694.9153 -156000.0 -0.72 370875.8621 -112000.0 -0.6 -0.9299 -0.9956 1677145 ChemDiv3_000237 O=C1C(C(C2C(=O)c3ccccc3C2=O)c4ccccc4)C(=O)c5ccccc15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K18 compound treatment 486922.0339 -42700.0 -0.2 448316.9935 -34900.0 -0.19 -0.2702 -0.9995 1190677 ChemDiv3_000238 CCN(CC)c1ccc2cc(C(=O)Nc3ccccc3)c(=N)oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K19 compound treatment 495796.4912 -33900.0 -0.16 522292.6829 39100.0 0.21 0.0362 0.1393 3019902 ChemDiv3_000239 CCC(=O)c1ccc2cc(OC)ccc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K20 compound treatment 536376.0684 6710.0 0.03 604580.0 121000.0 0.64 0.4771 0.7402 1231229 ChemDiv3_000240 CCCCC(N1C(=O)c2ccccc2C1=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K21 compound treatment 63380.9524 -466000.0 -2.15 61860.4651 -421000.0 -2.23 -3.1008 -0.9998 1111942 ChemDiv3_000241 CN(C)CCC(=O)c1ccc(Br)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K22 compound treatment 517755.4745 -11900.0 -0.05 517762.6459 34600.0 0.18 0.0908 0.4743 3019922 ChemDiv3_000242 Cc1cc(NC(=O)c2ccc(N)cc2)c(N)cc1N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K23 mock treatment 664044.2804 134000.0 0.62 526565.8363 43400.0 0.23 0.6008 0.909 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 K24 mock treatment 504237.2263 -25400.0 -0.12 502650.3497 19400.0 0.1 -0.01 -0.064 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L01 compound treatment 680175.0 151000.0 0.69 685941.6667 203000.0 1.08 1.2512 0.9776 3117622 ChemDiv3_000243 CC(=O)Nc1ccc(NC(=O)/C=N/O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L02 compound treatment 323619.0476 -206000.0 -0.95 210760.5634 -272000.0 -1.45 -1.6937 -0.9793 3117623 ChemDiv3_000244 O=C(C[n+]1cccc(c1)C(=O)Nc2ccccc2)c3ccc(cc3)N4C(=O)c5ccccc5C4=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L03 compound treatment 783295.082 254000.0 1.17 622227.2727 139000.0 0.74 1.3485 0.9753 3019923 ChemDiv3_000245 CC1(C)CC(CC(C)(C)N1)NC(=O)/C=C/C(=O)NC2CC(C)(C)NC(C)(C)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L04 compound treatment 719732.7586 190000.0 0.88 575578.3133 92400.0 0.49 0.9662 0.9622 1260714 ChemDiv3_000246 CC(C)(C)c1ccc(O)c(CN2CCN(CC2)c3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L05 compound treatment 633486.3636 104000.0 0.48 615255.3191 132000.0 0.7 0.8338 0.9828 3019924 ChemDiv3_000247 CC(C)N1C(=O)N(C(=CC1(C)C)C)c2ccc(C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L06 compound treatment 680386.4542 151000.0 0.7 606734.6939 124000.0 0.66 0.9548 0.9996 1635573 ChemDiv3_000248 COc1ccc(cc1CN2CCOCC2)C(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L07 compound treatment 485560.7477 -44100.0 -0.2 263880.597 -219000.0 -1.16 -0.9664 -0.8183 1417227 ChemDiv3_000249 C1CN(CCO1)c2ccc(Nc3ccnc4cc5ccccc5cc34)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L08 compound treatment 623185.8407 93500.0 0.43 559409.0909 76200.0 0.4 0.5908 0.9995 3019925 ChemDiv3_000250 Brc1ccc(cc1)N(CN2C(=O)c3ccccc3C2=O)C(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L09 compound treatment 604206.278 74500.0 0.34 588947.3684 106000.0 0.56 0.6397 0.9724 1196316 ChemDiv3_000251 COc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccnc3OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L10 compound treatment 522550.0 -7120.0 -0.03 488454.9356 5250.0 0.03 -0.0035 -0.0816 1401655 ChemDiv3_000252 CCSC1=C(C#N)C(C(=C(C)N1)C(=O)Nc2ccccc2)c3cccs3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L11 compound treatment 688812.7341 159000.0 0.73 668137.6518 185000.0 0.98 1.2126 0.9898 1010418 ChemDiv3_000253 Oc1ccc(cc1)S(=O)(=O)c2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L12 compound treatment 526778.157 -2890.0 -0.01 599644.0 116000.0 0.62 0.4273 0.6917 1538510 ChemDiv3_000254 CCOC(=O)n1c(=O)oc2cc(Cl)ccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L13 compound treatment 651144.2953 121000.0 0.56 639779.1165 157000.0 0.83 0.9834 0.9816 1642025 ChemDiv3_000255 CCOC(=O)Nc1cc(=O)c2ccccc2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L14 compound treatment 600955.6452 71300.0 0.33 755984.556 273000.0 1.45 1.2555 0.8462 1641183 ChemDiv3_000256 O=C(COC(=O)c1cc2ccccc2oc1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L15 compound treatment 584146.9388 54500.0 0.25 565624.5211 82400.0 0.44 0.4868 0.9654 3019926 ChemDiv3_000257 O/N=C(\c1ccccc1)/C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L16 compound treatment 449668.0162 -80000.0 -0.37 529062.5 45900.0 0.24 -0.0889 -0.2011 3117624 ChemDiv3_000258 CC[n+]1c(/C=C\2/CC(C)(C)CC(=C2)C)oc3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L17 compound treatment 619746.13 90100.0 0.42 717267.101 234000.0 1.24 1.1716 0.8949 1920076 ChemDiv3_000259 Cc1cc(C)c2ccc(/C=N/O)nc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L18 compound treatment 475462.1849 -54200.0 -0.25 574591.8367 91400.0 0.48 0.166 0.3044 3117625 ChemDiv3_000260 CC[n+]1c(/C=C/2\CC(C)CC(=C2)C)sc3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L19 compound treatment 591111.4865 61400.0 0.28 506652.5424 23500.0 0.12 0.2883 0.9317 1315100 ChemDiv3_000261 CSc1nc2ccccc2n1CN(C)Cc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L20 compound treatment 513618.8679 -16000.0 -0.07 524705.4264 41500.0 0.22 0.1033 0.4449 1305784 ChemDiv3_000262 COC(=O)c1cccc(n1)C(=O)Oc2ccc(OC(=O)c3cccc(n3)C(=O)OC)c(Cl)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L21 compound treatment 274168.1818 -256000.0 -1.18 408033.6134 -75200.0 -0.4 -1.1151 -0.8964 1433025 ChemDiv3_000263 Cc1cc(cc(C)c1N)C2(CCCCC2)c3cc(C)c(N)c(C)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L22 compound treatment 435744.4089 -93900.0 -0.43 412160.1423 -71000.0 -0.38 -0.5727 -0.9976 1464584 ChemDiv3_000264 CN(C)c1ccc(cc1)C(O)C(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L23 mock treatment 504800.0 -24900.0 -0.11 527395.1049 44200.0 0.23 0.0847 0.3244 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 L24 mock treatment 529917.6471 249.0 0.0 499931.6547 16700.0 0.09 0.0636 0.7162 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M01 compound treatment 507197.5806 -22500.0 -0.1 457844.1558 -25400.0 -0.13 -0.1684 -0.9917 1660133 ChemDiv3_000265 CC1=CC(=O)OC1Cc2ccc3ccccc3n2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M02 compound treatment 544918.3673 15300.0 0.07 477446.9697 -5760.0 -0.03 0.0281 0.3671 1710588 ChemDiv3_000266 CC(=O)Nc1nc(cs1)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M03 compound treatment 630981.3433 101000.0 0.47 505439.7163 22200.0 0.12 0.4138 0.8587 3117626 ChemDiv3_000267 C/N=C\1/S/C(=C\c2cn(CC(=O)O)c3ccccc23)/C(=O)N1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M04 compound treatment 602652.3438 73000.0 0.34 523161.8257 40000.0 0.21 0.3879 0.9751 3019928 ChemDiv3_000268 CC(C)(C)NC(=O)C[n+]1cccc(/C=N/O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M05 compound treatment 567204.0 37500.0 0.17 662470.1493 179000.0 0.95 0.7947 0.8223 3117629 ChemDiv3_000269 CC(=O)OC1CCC(CC1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M06 compound treatment 353833.3333 -176000.0 -0.81 244357.1429 -239000.0 -1.27 -1.4692 -0.9768 3019929 ChemDiv3_000270 CC(=O)Nc1sc2CCCCc2c1SC#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M07 compound treatment 563019.1571 33400.0 0.15 544380.0 61200.0 0.32 0.3382 0.9418 3117630 ChemDiv3_000271 CCC1(CC)C(=[N+](C)c2ccccc21)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M08 compound treatment 582034.2679 52400.0 0.24 609111.5242 126000.0 0.67 0.643 0.9054 1692026 ChemDiv3_000272 CC1(C)CC(CC(C)(C)N1)NC(=O)c2ccccc2C(=O)NC3CC(C)(C)NC(C)(C)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M09 compound treatment 551261.9926 21600.0 0.1 542289.4737 59100.0 0.31 0.292 0.888 3019876 ChemDiv3_000273 CC[n+]1c(C)sc(c1c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M10 compound treatment 534558.8235 4890.0 0.02 507166.6667 24000.0 0.13 0.1058 0.8198 3117631 ChemDiv3_000274 NC(=O)c1ccc[n+](CC(=O)N2CCCCC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M11 compound treatment 582304.9327 52600.0 0.24 620039.8406 137000.0 0.73 0.6849 0.8949 1141301 ChemDiv3_000275 COC(=O)Nc1ccc(cc1)S(=O)(=O)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M12 compound treatment 533377.2894 3710.0 0.02 516139.3728 32900.0 0.17 0.1356 0.7726 3117632 ChemDiv3_000276 O/N=C/c1cc[n+](CCC(=O)NCc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M13 compound treatment 426844.523 -103000.0 -0.47 484851.7241 1650.0 0.01 -0.3291 -0.6939 3019878 ChemDiv3_000277 Cc1cccc(NC(=O)/C=C/c2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M14 compound treatment 494947.3684 -34700.0 -0.16 542433.0986 59200.0 0.31 0.1089 0.3089 3117633 ChemDiv3_000278 OC(=O)c1ccccc1NC(=O)C[n+]2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M15 compound treatment 496712.766 -33000.0 -0.15 580006.2305 96800.0 0.51 0.2556 0.4773 1048436 ChemDiv3_000279 O=C(Nc1ccccc1)C2CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M16 compound treatment 398305.8824 -131000.0 -0.61 438031.1284 -45200.0 -0.24 -0.5978 -0.9176 1410422 ChemDiv3_000280 CCNc1c(N)c(=O)oc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M17 compound treatment 465408.0268 -64300.0 -0.3 472992.9825 -10200.0 -0.05 -0.2478 -0.8227 3019903 ChemDiv3_000281 Nc1nonc1c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M18 compound treatment 450583.9161 -79100.0 -0.36 446963.9344 -36200.0 -0.19 -0.3938 -0.9552 3019904 ChemDiv3_000282 CC(C)C1=CCC(C)/C(=C\c2ccc(Cl)cc2)/C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M19 compound treatment 90466.6667 -439000.0 -2.03 102686.2745 -381000.0 -2.02 -2.8593 -1.0 1010017 ChemDiv3_000283 O=C1C=CC(=O)N1c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M20 compound treatment 345595.1662 -184000.0 -0.85 411783.5366 -71400.0 -0.38 -0.8681 -0.9339 1922526 ChemDiv3_000284 Brc1ccccc1c2nc3ccccc3c4nc5ccccc5n24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M21 compound treatment 452027.5229 -77600.0 -0.36 545068.4932 61900.0 0.33 -0.0212 -0.0436 1409537 ChemDiv3_000285 Nc1ccc(cc1)C(=O)CC(=O)Nc2ccc(Cl)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M22 compound treatment 290875.0 -239000.0 -1.1 264692.3077 -219000.0 -1.16 -1.5982 -0.9997 1104285 ChemDiv3_000286 OC(=O)c1cc2ccc3cccc4ccc(c1)c2c34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M23 mock treatment 554445.7831 24800.0 0.11 487722.0077 4520.0 0.02 0.0977 0.8372 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 M24 mock treatment 516835.3414 -12800.0 -0.06 488920.4152 5720.0 0.03 -0.0204 -0.3068 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N01 compound treatment 539031.3589 9360.0 0.04 505902.8777 22700.0 0.12 0.1157 0.9043 3019905 ChemDiv3_000287 C/C(=C/C(=O)O)/C=C/c1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N02 compound treatment 620857.1429 91200.0 0.42 532583.6299 49400.0 0.26 0.4826 0.974 1113098 ChemDiv3_000288 O=C(Oc1ccccc1OC(=O)c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N03 compound treatment 444317.9191 -85400.0 -0.39 369072.5806 -114000.0 -0.61 -0.7064 -0.9783 1455237 ChemDiv3_000289 S=C1NCN(CN1)C2CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N04 compound treatment 572306.6038 42600.0 0.2 611965.3846 129000.0 0.68 0.622 0.8751 1652365 ChemDiv3_000290 CC(C)c1cc(CN2CCN(CC2)c3ccccc3)c(O)c(CN4CCN(CC4)c5ccccc5)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N05 compound treatment 712280.1418 183000.0 0.84 630198.5816 147000.0 0.78 1.1468 0.9993 3019907 ChemDiv3_000291 CN(C)C/C(=N/O)/C(=O)Nc1ccc(C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N06 compound treatment 587146.8254 57500.0 0.27 675359.5041 192000.0 1.02 0.9081 0.8623 1498499 ChemDiv3_000292 COc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)nc(OC)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N07 compound treatment 620320.0 90700.0 0.42 658721.8045 176000.0 0.93 0.9539 0.9347 1034347 ChemDiv3_000293 N#CCCn1nnc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N08 compound treatment 620933.5443 91300.0 0.42 575075.7098 91900.0 0.49 0.6422 0.9973 3117634 ChemDiv3_000294 CC(=O)N(CN1C(=O)c2ccccc2C1=O)c3ccc4ccccc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N09 compound treatment 564945.3376 35300.0 0.16 519739.5833 36500.0 0.19 0.2521 0.9962 1051930 ChemDiv3_000295 C(c1ccccc1)n2ccc3ccccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N10 compound treatment 552082.3529 22400.0 0.1 427552.8455 -55600.0 -0.3 -0.1356 -0.4337 1022496 ChemDiv3_000296 OC(=O)CCCc1ccc2ccc3cccc4ccc1c2c34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N11 compound treatment 618166.6667 88500.0 0.41 669192.029 186000.0 0.99 0.9861 0.9237 1579194 ChemDiv3_000297 CN(C)C(=O)c1ccc(Oc2ccc(cc2)C(=O)N(C)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N12 compound treatment 482200.0 -47500.0 -0.22 535459.6491 52300.0 0.28 0.0412 0.1167 1676465 ChemDiv3_000298 Clc1ccc(cc1)C(=O)n2c(=O)oc3cc(Cl)ccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N13 compound treatment 540835.206 11200.0 0.05 521726.9373 38500.0 0.2 0.1809 0.8585 1542255 ChemDiv3_000299 CCOC(=O)c1c(O)cc(C)cc1Nc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N14 compound treatment 604761.9048 75100.0 0.35 604549.4071 121000.0 0.64 0.7 0.9577 3117635 ChemDiv3_000300 O=C(C[n+]1ccccc1)c2cc3ccccc3oc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N15 compound treatment 481592.4765 -48100.0 -0.22 514894.9153 31700.0 0.17 -0.0379 -0.1363 1382153 ChemDiv3_000301 O=C1N(CC2(CC3CC4CC(C3)C2)C4)C(=O)c5ccccc15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N16 compound treatment 526497.9592 -3170.0 -0.01 523702.2059 40500.0 0.21 0.1416 0.6575 1667966 ChemDiv3_000302 O=C(Nc1ccc(cc1)c2nc3cc(NC(=O)C4CCCCC4)ccc3o2)C5CCCCC5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N17 compound treatment 518488.5993 -11200.0 -0.05 513751.6779 30500.0 0.16 0.0781 0.4594 3019932 ChemDiv3_000303 COC(=O)c1cc2cc(Br)ccc2oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N18 compound treatment 554820.2247 25200.0 0.12 511403.7037 28200.0 0.15 0.1878 0.9921 1508788 ChemDiv3_000304 CC(=O)Nc1ccc2oc3ccccc3c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N19 compound treatment 743002.849 213000.0 0.98 514762.8458 31600.0 0.17 0.814 0.8157 3019933 ChemDiv3_000305 NC(=O)CSc1nc2ccccc2s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N20 compound treatment 481121.2121 -48500.0 -0.22 505140.7942 21900.0 0.12 -0.076 -0.3013 1682374 ChemDiv3_000306 COC(=O)c1cccc(n1)C(=O)Nc2ccc(F)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N21 compound treatment 483291.411 -46400.0 -0.21 561244.898 78000.0 0.41 0.1415 0.3036 1467868 ChemDiv3_000307 Cc1ccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N22 compound treatment 468386.3636 -61300.0 -0.28 512096.0 28900.0 0.15 -0.0915 -0.2845 3019936 ChemDiv3_000308 O=C/1OC(=N\C1=C/c2ccco2)c3ccc(cc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N23 mock treatment 488748.1752 -40900.0 -0.19 497410.4478 14200.0 0.08 -0.0801 -0.3944 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 N24 mock treatment 508330.9353 -21300.0 -0.1 480759.1973 -2440.0 -0.01 -0.0787 -0.7934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O01 compound treatment 419923.7668 -110000.0 -0.51 368861.9403 -114000.0 -0.61 -0.7867 -0.996 3117636 ChemDiv3_000309 NNc1nc(cc(n1)c2ccccc2O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O02 compound treatment 536865.942 7200.0 0.03 446614.2857 -36600.0 -0.19 -0.1138 -0.5778 3019937 ChemDiv3_000310 CCCc1[nH]c(Br)nc1c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O03 compound treatment 672292.5764 143000.0 0.66 545804.6358 62600.0 0.33 0.6999 0.9499 1573334 ChemDiv3_000311 COc1nsnc1N2CCOCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O04 compound treatment 567032.5581 37400.0 0.17 462903.2258 -20300.0 -0.11 0.0457 0.225 3117637 ChemDiv3_000312 CN(C)C(=O)C[n+]1cccc(/C=N/O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O05 compound treatment 102080.6452 -428000.0 -1.97 77027.7778 -406000.0 -2.15 -2.9177 -0.999 1280359 ChemDiv3_000313 CCCCC1CCC(CC1)c2ccc(cc2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O06 compound treatment 555224.1379 25600.0 0.12 562758.3643 79600.0 0.42 0.3817 0.8713 3019939 ChemDiv3_000314 C[n+]1ccccc1c2nc3ccccc3s2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O07 compound treatment 538058.5774 8390.0 0.04 475858.1315 -7340.0 -0.04 -2.0E-4 -0.0034 1372721 ChemDiv3_000315 CCCCC1CCC(CC1)C(=O)Oc2ccc(OCC)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O08 compound treatment 490704.1801 -39000.0 -0.18 513580.5471 30400.0 0.16 -0.0131 -0.0544 1559693 ChemDiv3_000316 CCOC(=O)c1[nH]c2ccc(OCC)cc2c1CCCN3C(=O)c4ccccc4C3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O09 compound treatment 535146.3415 5480.0 0.03 474912.7273 -8290.0 -0.04 -0.0132 -0.2608 1672292 ChemDiv3_000317 COC(=O)c1ccc2n(CCO)c(C)nc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O10 compound treatment 516691.6996 -13000.0 -0.06 492286.2454 9080.0 0.05 -0.0082 -0.1073 3117638 ChemDiv3_000318 CC(C)(C)CC[n+]1ccc(cc1)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O11 compound treatment 570230.7692 40600.0 0.19 552356.4356 69200.0 0.37 0.3916 0.9512 3019783 ChemDiv3_000319 CN1C(N(C)c2ccccc12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O12 compound treatment 515839.7213 -13800.0 -0.06 454817.5182 -28400.0 -0.15 -0.1516 -0.9269 3019784 ChemDiv3_000320 CC(C)(C)CC[n+]1ccc(/C=N/O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O13 compound treatment 489223.565 -40400.0 -0.19 440683.1683 -42500.0 -0.23 -0.2914 -0.9955 1564111 ChemDiv3_000321 Cc1ccc(cc1)C(=O)c2ccc(Oc3ccccc3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O14 compound treatment 518578.9474 -11100.0 -0.05 455608.3916 -27600.0 -0.15 -0.1397 -0.9008 1011033 ChemDiv3_000322 Cc1nc(N)c(nc1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O15 compound treatment 334126.2626 -196000.0 -0.9 271600.0 -212000.0 -1.12 -1.4313 -0.9941 1628748 ChemDiv3_000323 CN(CC(=O)C1=C(C(=O)c2ccccc2C1=O)c3ccc(Br)cc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O16 compound treatment 511716.7832 -18000.0 -0.08 429063.1579 -54100.0 -0.29 -0.2616 -0.8753 1540210 ChemDiv3_000324 Nc1c(N2CCOCC2)c3ccccc3oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O17 compound treatment 455657.4924 -74000.0 -0.34 460835.5263 -22400.0 -0.12 -0.3252 -0.9001 1072203 ChemDiv3_000325 CCCn1c2ccccc2c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O18 compound treatment 418519.5531 -111000.0 -0.51 469032.5733 -14200.0 -0.08 -0.4156 -0.8022 3019785 ChemDiv3_000326 COc1ccc(/C=C/2\C(C)CC=C(C(C)C)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O19 compound treatment 767836.7953 238000.0 1.1 490866.8942 7660.0 0.04 0.8054 0.7328 1084080 ChemDiv3_000327 CC[n+]1ccc(C)c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O20 compound treatment 495607.6389 -34100.0 -0.16 459462.2356 -23700.0 -0.13 -0.2001 -0.994 1594899 ChemDiv3_000328 COC(=O)CNC(=O)c1cc(OC)c(OC)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O21 compound treatment 488199.3464 -41500.0 -0.19 478972.1254 -4230.0 -0.02 -0.1511 -0.7847 1181132 ChemDiv3_000329 O=C(NCC1(CC2CC3CC(C2)C1)C3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O22 compound treatment 553903.2258 24200.0 0.11 492387.0968 9180.0 0.05 0.1135 0.9307 1124218 ChemDiv3_000330 CCc1nc(C)ccc1OCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O23 mock treatment 472075.0853 -57600.0 -0.27 475241.3793 -7960.0 -0.04 -0.2177 -0.8094 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 O24 mock treatment 536655.3191 6990.0 0.03 441344.8276 -41900.0 -0.22 -0.1342 -0.5982 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P01 compound treatment 522880.0 -6790.0 -0.03 447907.8947 -35300.0 -0.19 -0.1545 -0.814 1003174 ChemDiv3_000331 CC(O)c1ccc(Oc2ccc(cc2)C(C)O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P02 compound treatment 459417.0616 -70300.0 -0.32 395809.7015 -87400.0 -0.46 -0.5568 -0.9847 3019787 ChemDiv3_000332 CN(C)c1ccc(/C=N/c2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P03 compound treatment 356959.8394 -173000.0 -0.8 363600.6944 -120000.0 -0.63 -1.0118 -0.9936 1340347 ChemDiv3_000333 CC(C)(C)c1cc(CN2CCN(CCC#N)CC2)cc(c1O)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P04 compound treatment 509421.2766 -20200.0 -0.09 464985.4545 -18200.0 -0.1 -0.1343 -0.9999 3019803 ChemDiv3_000334 COc1cccc2s/c(=N/C(=O)CC3(CC4CC5CC(C4)C3)C5)/n(C)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P05 compound treatment 528317.0732 -1350.0 -0.01 481814.2857 -1390.0 -0.01 -0.0096 -0.9966 1922875 ChemDiv3_000335 CCN(CC)C(=O)C1(CC2CC3C1)CC(C2)CC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P06 compound treatment 526510.0402 -3160.0 -0.01 504161.3924 21000.0 0.11 0.0683 0.6093 3117639 ChemDiv3_000336 O/N=C/c1cccc[n+]1CC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P07 compound treatment 530140.4959 472.0 0.0 503893.2039 20700.0 0.11 0.0791 0.721 1035295 ChemDiv3_000337 CC(C)(C)N1C(=O)c2ccccc2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P08 compound treatment 518343.8914 -11300.0 -0.05 406950.9434 -76300.0 -0.4 -0.3229 -0.7918 1005478 ChemDiv3_000338 Nc1ccc(Oc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P09 compound treatment 524277.5665 -5390.0 -0.02 465212.4542 -18000.0 -0.1 -0.085 -0.8625 1734538 ChemDiv3_000339 OC(=O)CCNC(=O)c1ccco1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P10 compound treatment 328523.9617 -201000.0 -0.93 335175.6757 -148000.0 -0.79 -1.2111 -0.9966 3117642 ChemDiv3_000340 CN(C)c1ccc(/C=C/2\CCC/C(=C\c3ccccc3)/C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P11 compound treatment 483655.7377 -46000.0 -0.21 438534.296 -44700.0 -0.24 -0.3176 -0.9985 1511725 ChemDiv3_000341 COC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3cccc(c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P12 compound treatment 487017.2414 -42700.0 -0.2 445810.1266 -37400.0 -0.2 -0.2793 -1.0 1287341 ChemDiv3_000342 O=S(=O)(N1CCOCC1)c2cccc(c2)S(=O)(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P13 compound treatment 476220.5882 -53400.0 -0.25 449933.5347 -33300.0 -0.18 -0.2991 -0.9866 1166133 ChemDiv3_000343 CN(C)CCOC(=O)c1ccc2n(CCN(C)C)c(C)c(C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P14 compound treatment 447342.6295 -82300.0 -0.38 475161.2903 -8040.0 -0.04 -0.2986 -0.7816 1920545 ChemDiv3_000344 O=c1cc([nH]c(=S)[nH]1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P15 compound treatment 436887.372 -92800.0 -0.43 437868.6869 -45300.0 -0.24 -0.4726 -0.9629 3117643 ChemDiv3_000345 Oc1ccc(Br)cc1/C=N\CC2(CC3CC4CC(C3)CC2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P16 compound treatment 492401.7467 -37300.0 -0.17 443024.735 -40200.0 -0.21 -0.2722 -0.9943 1350693 ChemDiv3_000346 Nc1ccc(CCc2nc3ccccc3[nH]2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P17 compound treatment 427680.6084 -102000.0 -0.47 444381.5385 -38800.0 -0.21 -0.4782 -0.9313 1509469 ChemDiv3_000347 CCN(CC)C(=O)c1cc(nc2ccccc12)c3cc(C(=O)N(CC)CC)c4ccccc4n3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P18 compound treatment 416358.2555 -113000.0 -0.52 443102.7397 -40100.0 -0.21 -0.5199 -0.9215 3019852 ChemDiv3_000348 O/N=C(\Cn1cncn1)/c2ccc(Cl)cc2Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P19 compound treatment 383802.5478 -146000.0 -0.67 388942.6523 -94300.0 -0.5 -0.8292 -0.9893 1127886 ChemDiv3_000349 C(Cc1nc2ccccc2o1)Cc3nc4ccccc4o3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P20 compound treatment 365327.8146 -164000.0 -0.76 398125.0 -85100.0 -0.45 -0.855 -0.9693 1524725 ChemDiv3_000350 COC(=O)c1cccc(n1)C(=O)Nc2cnc3ccccc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P21 compound treatment 429489.9329 -100000.0 -0.46 464496.5986 -18700.0 -0.1 -0.3968 -0.8398 1740437 ChemDiv3_000351 OC(CNCc1ccccc1)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P22 compound treatment 413330.303 -116000.0 -0.54 433286.1736 -49900.0 -0.26 -0.5666 -0.947 3019853 ChemDiv3_000352 Brc1ccc(cc1)S(=O)(=O)/N=C(\Oc2ccccc2)/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P23 mock treatment 435409.2527 -94300.0 -0.43 426342.1053 -56900.0 -0.3 -0.5206 -0.984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2001 P24 mock treatment 392546.3918 -137000.0 -0.63 439319.8758 -43900.0 -0.23 -0.6117 -0.9078 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A01 compound treatment 483827.4336 -33600.0 -0.15 522817.3516 -27400.0 -0.15 -0.2121 -0.9995 3117644 ChemDiv3_000353 Brc1ccc(cc1)S(=O)(=O)NC(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A02 compound treatment 534951.4563 17500.0 0.08 618575.4717 68400.0 0.36 0.3138 0.8441 1625003 ChemDiv3_000354 NS(=O)(=O)c1ccc(cc1)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A03 compound treatment 519298.7552 1890.0 0.01 690836.5385 141000.0 0.75 0.5337 0.7153 1914243 ChemDiv3_000355 O=C(Oc1ccc2ccccc2c1)/C=C/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A04 compound treatment 575718.894 58300.0 0.27 534658.7678 -15500.0 -0.08 0.132 0.4693 1922486 ChemDiv3_000356 O=C/1NC(=S)S\C1=C\Nc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A05 compound treatment 604763.8191 87400.0 0.4 566755.5556 16600.0 0.09 0.3471 0.8417 1148913 ChemDiv3_000357 CC(C)(C)NC(=O)c1ccc2C(=O)c3ccccc3-c4onc1c42 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A06 compound treatment 526356.1644 8950.0 0.04 572358.4906 22200.0 0.12 0.1124 0.9013 1082370 ChemDiv3_000358 NCCSC1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A07 compound treatment 629840.1826 112000.0 0.52 606754.902 56600.0 0.3 0.5789 0.9662 1561720 ChemDiv3_000359 Cc1ccc2nc(cc(C(=O)Nc3ccccc3)c2c1)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A08 compound treatment 567274.4186 49900.0 0.23 551771.3004 1600.0 0.01 0.1686 0.7327 1739494 ChemDiv3_000360 CC(=O)Nc1c(N)c2ccccc2oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A09 compound treatment 646126.0163 129000.0 0.59 637020.5128 86900.0 0.46 0.7455 0.9921 1726014 ChemDiv3_000361 C(CN1CCN(CC1)C(c2ccccc2)c3ccccc3)Cc4c[nH]c5ccccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A10 compound treatment 499677.8846 -17700.0 -0.08 480833.3333 -69300.0 -0.37 -0.3179 -0.8437 1003179 ChemDiv3_000362 COc1ccc(cc1)C(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A11 compound treatment 600252.8736 82800.0 0.38 507203.7037 -43000.0 -0.23 0.109 0.245 1574213 ChemDiv3_000363 COc1ccc(cc1)S(=O)(=O)NC2CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A12 compound treatment 566518.6722 49100.0 0.23 530403.4335 -19800.0 -0.1 0.086 0.3447 3117645 ChemDiv3_000364 COc1ccc(/C=N/c2ccc(cc2)C(=O)N)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A13 compound treatment 527226.8908 9820.0 0.05 587538.1166 37400.0 0.2 0.1722 0.8468 3019887 ChemDiv3_000365 O/N=C(/c1ccccc1)\c2ccccn2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A14 compound treatment 914496.2963 397000.0 1.83 941834.7826 392000.0 2.08 2.7638 0.998 1478079 ChemDiv3_000366 Fc1ccc(NC(=O)c2cc3ccccc3oc2=N)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A15 compound treatment 602977.3756 85600.0 0.39 511401.8692 -38800.0 -0.21 0.1336 0.3003 3117646 ChemDiv3_000367 Cn1c2ccc(/N=C/c3ccccc3O)cc2c4nc5ccccc5nc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A16 compound treatment 524658.5366 7250.0 0.03 555344.6809 5180.0 0.03 0.0431 0.9952 1190781 ChemDiv3_000368 Cc1c(N=c2c(=O)c3ccccc3c2=O)c(=O)n(c4ccccc4)n1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A17 compound treatment 476875.0 -40500.0 -0.19 532925.3112 -17200.0 -0.09 -0.1968 -0.9459 3019890 ChemDiv3_000369 CCOC(=O)n1c(=S)oc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A18 compound treatment 553188.4817 35800.0 0.17 459555.0847 -90600.0 -0.48 -0.2232 -0.4392 1644186 ChemDiv3_000370 CCOC(=O)COc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A19 compound treatment 558092.1053 40700.0 0.19 565131.1475 15000.0 0.08 0.1888 0.9267 3117647 ChemDiv3_000371 COc1cccc(/C=N/c2cccc(NC(=O)c3ccc(F)cc3)c2)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A20 compound treatment 515081.8182 -2330.0 -0.01 522044.6429 -28100.0 -0.15 -0.1131 -0.756 1428551 ChemDiv3_000372 CCCC1(CCC2(CC1)c3ccc(C#N)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A21 compound treatment 536903.7657 19500.0 0.09 571177.2152 21000.0 0.11 0.1424 0.9943 3019912 ChemDiv3_000373 CC(C(=O)c1ccccc1)[n+]2ccc3ccccc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A22 compound treatment 414378.2772 -103000.0 -0.48 468205.6075 -82000.0 -0.43 -0.6434 -0.999 3117648 ChemDiv3_000374 Cc1cccc(NC(=O)CN2C(=O)/C(=N\N)/c3ccccc23)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A23 mock treatment 535971.5447 18600.0 0.09 478953.5865 -71200.0 -0.38 -0.2066 -0.5333 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 A24 mock treatment 459200.0 -58200.0 -0.27 477329.6703 -72800.0 -0.39 -0.463 -0.9842 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B01 compound treatment 728073.8916 211000.0 0.97 540029.7872 -10100.0 -0.05 0.6489 0.6669 3117649 ChemDiv3_000375 CCOC(=O)c1ccc(/N=C/c2ccc3OCOc3c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B02 compound treatment 574492.3077 57100.0 0.26 665759.434 116000.0 0.61 0.6197 0.9287 1617961 ChemDiv3_000376 CC(C)OC(=O)CN1C(=O)c2ccc(cc2C1=O)C(=O)OC(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B03 compound treatment 708193.8326 191000.0 0.88 658565.8537 108000.0 0.57 1.0287 0.9787 1656957 ChemDiv3_000377 CC1(CN2CN3C1)C(=O)C(C2)(C3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B04 compound treatment 648320.5742 131000.0 0.6 727688.6792 178000.0 0.94 1.0927 0.9769 3117650 ChemDiv3_000378 COc1ccc(/C=C/2\C(C)CCC(C)(C(C)C)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B05 compound treatment 201166.6667 -316000.0 -1.46 266701.4925 -283000.0 -1.5 -2.0944 -0.9999 1688345 ChemDiv3_000379 Oc1nc2SCCCn2c(=O)c1Cc3cc(Cl)cc(Cl)c3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B06 compound treatment 517851.145 444.0 0.0 550417.3913 248.0 0.0 0.0024 0.9772 3020471 ChemDiv3_000380 COc1ccc(cc1)c2c(C)s/c(=N\c3ccc(C)cc3)/n2CC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B07 compound treatment 567244.898 49800.0 0.23 591772.0207 41600.0 0.22 0.3185 0.9998 1735047 ChemDiv3_000381 CC(=O)Oc1ccc(cc1)N(C(=O)C)S(=O)(=O)c2ccc3ccccc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B08 compound treatment 606017.1674 88600.0 0.41 606090.9091 55900.0 0.3 0.4987 0.9876 3020472 ChemDiv3_000382 COc1ccc(/N=C/c2cn(nc2c3ccccc3)c4ccccc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B09 compound treatment 568094.8276 50700.0 0.23 632544.1176 82400.0 0.44 0.4742 0.9571 3020473 ChemDiv3_000383 CN(C)c1ccc(/C=N/c2cc(Br)c3OCCOc3c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B10 compound treatment 656048.6726 139000.0 0.64 591728.7234 41600.0 0.22 0.608 0.899 3020474 ChemDiv3_000384 O=C1NC(=O)C(=Cc2ccc(o2)c3ccccc3)C(=O)N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B11 compound treatment 584995.1691 67600.0 0.31 638441.3408 88300.0 0.47 0.5515 0.9805 3117651 ChemDiv3_000385 C(CSc1nc2ccccc2n1CCOc3ccccc3)Oc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B12 compound treatment 605653.8462 88200.0 0.41 682834.0611 133000.0 0.7 0.7853 0.9661 3020475 ChemDiv3_000386 Clc1ccc(/C=C/2\SC(=S)N(CCC(=O)Nc3ccccc3)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B13 compound treatment 624042.4528 107000.0 0.49 694772.9469 145000.0 0.77 0.8901 0.9769 3117652 ChemDiv3_000387 CN1/C(=C\2/SC(=S)N(C2=O)c3ccccc3)/Sc4ccccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B14 compound treatment 730740.4255 213000.0 0.98 653615.3846 103000.0 0.55 1.0836 0.962 1709090 ChemDiv3_000388 CC(C)(C)NC(=S)NC(=O)C1(CC2(C)CC3(C)CC(C)(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B15 compound treatment 529332.0611 11900.0 0.05 491292.887 -58900.0 -0.31 -0.1819 -0.5738 1222580 ChemDiv3_000389 C(n1ccc2ccccc12)C3(OCCO3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B16 compound treatment 595343.75 77900.0 0.36 559022.9358 8850.0 0.05 0.2873 0.7928 3020476 ChemDiv3_000390 Cn1c[n+](C)cc1C(O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B17 compound treatment 515840.5797 -1570.0 -0.01 491736.5854 -58400.0 -0.31 -0.2243 -0.7234 3117653 ChemDiv3_000391 C(=N/c1ccc2ccccc2c1)\c3ccncc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B18 compound treatment 609121.2121 91700.0 0.42 564280.0 14100.0 0.07 0.352 0.8195 3117654 ChemDiv3_000392 CC1(C)Cc2ccccc2/C(=N/c3nc(cs3)c4ccccc4)/N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B19 compound treatment 564664.0927 47300.0 0.22 536368.6131 -13800.0 -0.07 0.1023 0.4452 1338386 ChemDiv3_000393 CCC1(CC2CC3(O)CC(O)(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B20 compound treatment 395761.9048 -122000.0 -0.56 365626.0163 -185000.0 -0.98 -1.0888 -0.9651 1917487 ChemDiv3_000394 CC(/N=C/c1c(O)ccc2ccccc12)C3(CC4CC5CC(C4)C3)C5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B21 compound treatment 57508.7719 -460000.0 -2.12 75763.6364 -474000.0 -2.52 -3.2789 -0.9964 3117655 ChemDiv3_000395 S=C/1OC(=C\C1=C/N2CCCCC2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B22 compound treatment 449832.1429 -67600.0 -0.31 499895.5823 -50300.0 -0.27 -0.4089 -0.997 3020477 ChemDiv3_000396 Cc1c(/N=C/2\SCC(=O)N2/N=C\c3ccc(Br)cc3)c(=O)n(c4ccccc4)n1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B23 mock treatment 428979.021 -88400.0 -0.41 547832.5991 -2340.0 -0.01 -0.2971 -0.7283 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 B24 mock treatment 453552.1236 -63900.0 -0.29 490401.8265 -59800.0 -0.32 -0.4324 -0.9993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C01 compound treatment 497049.505 -20400.0 -0.09 584478.9916 34300.0 0.18 0.0623 0.3042 3117656 ChemDiv3_000397 O/N=C\1/C(=O)N(CC(=O)Nc2ccccc2)c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C02 compound treatment 578935.2227 61500.0 0.28 577757.9909 27600.0 0.15 0.3041 0.9526 1329935 ChemDiv3_000398 O=C1N(CCC2(CC3CC4CC(C3)C2)C4)C(=O)c5ccccc15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C03 compound treatment 529968.4685 12600.0 0.06 678058.0357 128000.0 0.68 0.5206 0.7647 3020478 ChemDiv3_000399 Cc1cc(=O)oc(C)c1C(=O)OCC(=O)c2ccc(Cl)c(Cl)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C04 compound treatment 328658.2278 -189000.0 -0.87 663773.6842 114000.0 0.6 -0.1894 -0.1789 3117657 ChemDiv3_000400 Cc1cc(C)c2nc(NC(=O)c3ccc(C#N)cc3)sc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C05 compound treatment 229968.75 -287000.0 -1.33 388282.6087 -162000.0 -0.86 -1.5445 -0.9779 1721945 ChemDiv3_000401 Cc1ccc2c(=O)c(coc2c1)C(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C06 compound treatment 540488.2943 23100.0 0.11 845606.2176 295000.0 1.57 1.1833 0.7534 1169311 ChemDiv3_000402 OC(=O)CSC1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C07 compound treatment 377701.5873 -140000.0 -0.64 555807.2917 5640.0 0.03 -0.4344 -0.6736 3117658 ChemDiv3_000403 COc1ccc(/C=C/2\CCCC3=C2NC(=S)NC3c4ccc(OC)cc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C08 compound treatment 440132.1321 -77300.0 -0.36 681533.3333 131000.0 0.7 0.2407 0.3076 1345307 ChemDiv3_000404 Cc1cc2nc(SCCN3CCCC3)[nH]c2cc1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C09 compound treatment 519933.7539 2530.0 0.01 625383.9662 75200.0 0.4 0.2903 0.7274 3117659 ChemDiv3_000405 Cc1sc(/N=C/c2ccccc2O)c(C#N)c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C10 compound treatment 356191.7808 -161000.0 -0.74 623100.0 72900.0 0.39 -0.2522 -0.3009 1625198 ChemDiv3_000406 COc1ccc(cc1OC)c2cnn(c2N)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C11 compound treatment 294963.1336 -222000.0 -1.03 603169.1542 53000.0 0.28 -0.5266 -0.4951 1460903 ChemDiv3_000407 Cc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)Nc3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C12 compound treatment 380588.2353 -137000.0 -0.63 562004.9505 11800.0 0.06 -0.4018 -0.6336 3020479 ChemDiv3_000408 Fc1ccccc1/C=N/c2cccc3ccccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C13 compound treatment 250197.6744 -267000.0 -1.23 635683.4862 85500.0 0.45 -0.5506 -0.4193 1489098 ChemDiv3_000409 CN1C2CCC1CC(C2)OC(=O)CCN3CCOCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C14 compound treatment 264102.1739 -253000.0 -1.17 682040.9836 132000.0 0.7 -0.3314 -0.2434 3117660 ChemDiv3_000410 CC(=O)NC1C(O)C(O)C(CO)OC1OCCOc2ccc(Cl)cc2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C15 compound treatment 432073.6842 -85300.0 -0.39 634605.2632 84400.0 0.45 0.0384 0.0644 3020480 ChemDiv3_000411 Fc1ccccc1/C=C\2/SC(=O)N(CN3CCCCC3)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C16 compound treatment 267299.7658 -250000.0 -1.15 458364.1304 -91800.0 -0.49 -1.1599 -0.9265 3117661 ChemDiv3_000412 Cc1cs/c(=N\c2ccccc2)/n1CC(=O)c3ccc(C)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C17 compound treatment 374107.8947 -143000.0 -0.66 550242.5532 73.2 0.0 -0.467 -0.7067 1338722 ChemDiv3_000413 O=c1oc2ccccc2n1CNc3ccccn3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C18 compound treatment 386002.5316 -131000.0 -0.61 602201.5504 52000.0 0.28 -0.2334 -0.3504 3117662 ChemDiv3_000414 CCOc1ccc(cc1)[n+]2c(cn3CCCc32)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C19 compound treatment 333464.2857 -184000.0 -0.85 699334.8624 149000.0 0.79 -0.0404 -0.0348 3117663 ChemDiv3_000415 CC(C)C1(C)N=C(NC1=O)c2ncccc2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C20 compound treatment 242973.6308 -274000.0 -1.27 573966.8246 23800.0 0.13 -0.8057 -0.6334 3020481 ChemDiv3_000416 CC(=C)C(=O)Nc1ccc(O)c(c1)c2nc3ccccc3[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C21 compound treatment 345333.3333 -172000.0 -0.79 616597.5104 66400.0 0.35 -0.312 -0.3593 3117664 ChemDiv3_000417 CC(C(=O)c1ccccc1)[n+]2cccc(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C22 compound treatment 375577.2947 -142000.0 -0.65 591301.6529 41100.0 0.22 -0.3082 -0.447 3020482 ChemDiv3_000418 N/C(=N\O)/C[n+]1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C23 mock treatment 580377.5934 63000.0 0.29 555878.3784 5710.0 0.03 0.2268 0.7766 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 C24 mock treatment 608713.1474 91300.0 0.42 554550.4202 4380.0 0.02 0.3142 0.745 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D01 compound treatment 613689.6552 96300.0 0.44 582251.1211 32100.0 0.17 0.4343 0.9133 3117665 ChemDiv3_000419 Brc1ccc(/C=N\C2C3CC4CC(C3)CC2C4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D02 compound treatment 635207.5472 118000.0 0.54 739231.5789 189000.0 1.0 1.0932 0.9586 1642252 ChemDiv3_000420 CC(C(CC(=O)O)C(=O)O)c1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D03 compound treatment 278805.6537 -239000.0 -1.1 709315.4362 159000.0 0.84 -0.1812 -0.1306 1348263 ChemDiv3_000421 CC(C)Oc1ccc2c(C)c(Cc3ccccc3)c(=O)oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D04 compound treatment 493530.086 -23900.0 -0.11 613497.5124 63300.0 0.34 0.1596 0.4517 1509351 ChemDiv3_000422 COc1ccc(cc1OC)C(=O)Nc2ccc3C(=O)N(C)C(=O)c3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D05 compound treatment 388671.2329 -129000.0 -0.59 802069.8925 252000.0 1.34 0.525 0.3591 3020483 ChemDiv3_000423 CCN1C(=O)C(=Cc2ccc(cc2)N(C)C)C(=O)N(CC)C1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D06 compound treatment 341089.9743 -176000.0 -0.81 661653.0612 111000.0 0.59 -0.1568 -0.156 3117666 ChemDiv3_000424 CCOC(=O)C1=C(C)NC(=S)NC1c2ccc(o2)c3ccccc3Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D07 compound treatment 298362.6062 -219000.0 -1.01 658601.1905 108000.0 0.58 -0.3076 -0.2646 1529711 ChemDiv3_000425 Oc1cc2ccccc2cc1C(=O)Nc3ccccc3Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D08 compound treatment 10793.7743 -507000.0 -2.34 47185.1852 -503000.0 -2.67 -3.5385 -0.9978 3117667 ChemDiv3_000426 CN(C)c1ccc(cc1)c2cccc([o+]2)c3ccc(cc3)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D09 compound treatment 425800.6231 -91600.0 -0.42 653094.7867 103000.0 0.55 0.0873 0.1265 3020484 ChemDiv3_000427 Nc1nc2ccc(cc2s1)c3nc4ccccc4o3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D10 compound treatment 208421.5385 -309000.0 -1.42 523691.0569 -26500.0 -0.14 -1.1069 -0.7731 3117668 ChemDiv3_000428 Cn1c(c(/C=C\2/C(=O)Oc3ccccc3C2=O)c4ccccc14)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D11 compound treatment 321583.9416 -196000.0 -0.9 587560.6061 37400.0 0.2 -0.4983 -0.539 3020485 ChemDiv3_000429 CCC1SC2=NCN(CN2C1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D12 compound treatment 294379.6296 -223000.0 -1.03 566857.7406 16700.0 0.09 -0.6647 -0.6439 1918348 ChemDiv3_000430 COc1ccc(/C=C/2\SC(=S)N(CC(=O)Nc3ccccc3)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D13 compound treatment 252123.5698 -265000.0 -1.22 577601.0929 27400.0 0.15 -0.7622 -0.6187 3117669 ChemDiv3_000431 CCN1/C(=C\2/SC(=S)NC2=O)/Sc3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D14 compound treatment 298698.1567 -219000.0 -1.01 642668.2243 92500.0 0.49 -0.3663 -0.3266 1556840 ChemDiv3_000432 Cc1ccc(NC(=S)NC(=O)C2(CC3CC4C2)CC(C3)CC4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D15 compound treatment 253442.1488 -264000.0 -1.22 588651.2821 38500.0 0.2 -0.7164 -0.5804 1257795 ChemDiv3_000433 O=C1CSC(N1CCc2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D16 compound treatment 342960.5911 -174000.0 -0.8 630822.335 80700.0 0.43 -0.2664 -0.2923 3020486 ChemDiv3_000434 C[n+]1cc(ccc1/C=N/O)C(=O)NCCC[N+]2(C)CCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D17 compound treatment 287722.3476 -230000.0 -1.06 471981.3433 -78200.0 -0.41 -1.0422 -0.9162 1486295 ChemDiv3_000435 C1CCc2c(C1)c(nc3ccc4ccccc4c23)c5cccnc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D18 compound treatment 348839.5349 -169000.0 -0.78 609436.3636 59300.0 0.31 -0.3274 -0.3905 3117670 ChemDiv3_000436 Cc1cc2CC(C)(C)N/C(=N\c3ccccc3)/c2cc1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D19 compound treatment 315690.0452 -202000.0 -0.93 578213.2701 28000.0 0.15 -0.5526 -0.5866 1377733 ChemDiv3_000437 OC(=O)C1(CC2CC3C1)CC(C2)C3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D20 compound treatment 374193.6416 -143000.0 -0.66 534947.1698 -15200.0 -0.08 -0.5241 -0.7877 1712241 ChemDiv3_000438 CCOc1ccc(Nc2nc3cc(C)ccc3cc2C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D21 compound treatment 120333.3333 -397000.0 -1.83 113767.8571 -436000.0 -2.31 -2.9315 -0.9933 3020487 ChemDiv3_000439 N/C=C/1\C=C(OC1=S)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D22 compound treatment 523382.9787 5980.0 0.03 475379.661 -74800.0 -0.4 -0.261 -0.6564 3117671 ChemDiv3_000440 Cc1cccc(Nc2nc3ccccn3c(=O)c2/C=N/c4cccc(C)c4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D23 mock treatment 451435.8108 -66000.0 -0.3 602818.1818 52600.0 0.28 -0.0177 -0.0428 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 D24 mock treatment 475688.4615 -41700.0 -0.19 545868.4211 -4300.0 -0.02 -0.1522 -0.7854 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E01 compound treatment 476764.7059 -40600.0 -0.19 527488.1517 -22700.0 -0.12 -0.2176 -0.977 3020488 ChemDiv3_000441 O=C/1NC(=S)N\C1=C/c2ccco2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E02 compound treatment 555665.1982 38300.0 0.18 674437.8109 124000.0 0.66 0.5908 0.8659 1159657 ChemDiv3_000442 CC1SC(=NC1(O)C2(CC3CC4CC(C3)C2)C4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E03 compound treatment 282475.8065 -235000.0 -1.08 729688.6228 180000.0 0.95 -0.0928 -0.0643 1407431 ChemDiv3_000443 Cc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E04 compound treatment 311523.2558 -206000.0 -0.95 631278.9474 81100.0 0.43 -0.3672 -0.3522 1509204 ChemDiv3_000444 COC(=O)C(C)Nc1cccc(Br)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E05 compound treatment 422698.895 -94700.0 -0.44 628206.422 78000.0 0.41 -0.0162 -0.0269 3117672 ChemDiv3_000445 O=C(/C=C/c1ccco1)/C=C/c2ccco2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E06 compound treatment 271517.316 -246000.0 -1.13 659097.2763 109000.0 0.58 -0.3933 -0.309 1168228 ChemDiv3_000446 CNC1(CC2CC3CC(S)(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E07 compound treatment 219420.7048 -298000.0 -1.37 612220.0957 62100.0 0.33 -0.739 -0.523 3117673 ChemDiv3_000447 OC(=O)CCC(=O)N1N=C/2C(CCC\C2=C/c3ccc(F)cc3)C1c4ccc(F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E08 compound treatment 277285.7143 -240000.0 -1.11 530362.5731 -19800.0 -0.11 -0.8573 -0.7707 1139169 ChemDiv3_000448 C1CCN(CC1)Sc2nc3ccccc3[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E09 compound treatment 309667.4419 -208000.0 -0.96 586404.9587 36200.0 0.19 -0.5415 -0.5542 1916119 ChemDiv3_000449 Brc1ccc(cc1)C(=O)COC(=O)c2ccc(Br)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E10 compound treatment 369796.0199 -148000.0 -0.68 667380.7107 117000.0 0.62 -0.0417 -0.0453 3020489 ChemDiv3_000450 Oc1ccc(Br)cc1/C=N/c2cc3OCCOc3cc2Br 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E11 compound treatment 390200.0 -127000.0 -0.59 671772.2772 122000.0 0.64 0.0413 0.0473 3117674 ChemDiv3_000451 NC(=S)NC(=O)/C=C/c1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E12 compound treatment 275120.5074 -242000.0 -1.12 658300.813 108000.0 0.57 -0.3845 -0.3062 3020490 ChemDiv3_000452 Fc1ccc(/N=C/c2ccccc2F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E13 compound treatment 236000.0 -281000.0 -1.3 650521.5686 100000.0 0.53 -0.5413 -0.3859 1516214 ChemDiv3_000453 CN(Cc1ccccc1)C(=O)CN2CCCC2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E14 compound treatment 408365.1226 -109000.0 -0.5 565715.4812 15500.0 0.08 -0.2973 -0.5834 1022614 ChemDiv3_000454 OCCNC(=O)COc1ccc(Cl)cc1Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E15 compound treatment 236279.8265 -281000.0 -1.3 514784.689 -35400.0 -0.19 -1.0494 -0.8011 3117675 ChemDiv3_000455 Cc1ccc(cc1)c2cs/c(=N/C(=O)Nc3ccccc3)/[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E16 compound treatment 304697.9167 -213000.0 -0.98 630225.5319 80100.0 0.42 -0.3934 -0.368 3020491 ChemDiv3_000456 Clc1ccc(cc1Cl)c2cnc3CCCn23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E17 compound treatment 307753.304 -210000.0 -0.97 572708.9552 22500.0 0.12 -0.5991 -0.615 3117676 ChemDiv3_000457 CCSc1nnc(NC(=O)/C=C/c2ccccc2)s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E18 compound treatment 344614.4068 -173000.0 -0.8 600435.2518 50300.0 0.27 -0.3749 -0.4462 1523604 ChemDiv3_000458 CC(C)C1CCC(C)CC1OCC(O)C[N+]2(C)CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E19 compound treatment 450269.7842 -67100.0 -0.31 541660.3774 -8510.0 -0.05 -0.2508 -0.8017 3020492 ChemDiv3_000459 O=C(/C=C\1/Nc2ccccc2NC1=O)c3cccc4ccccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E20 compound treatment 591492.5373 74100.0 0.34 620174.8634 70000.0 0.37 0.5041 0.9991 3117677 ChemDiv3_000460 c1ccc2[nH]c(nc2c1)c3nc4ccccc4s3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E21 compound treatment 635186.9159 118000.0 0.54 586427.8075 36300.0 0.19 0.5201 0.9026 3020493 ChemDiv3_000461 O=C1N(C(=O)C(=Cc2ccccc2)C(=O)N1c3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E22 compound treatment 572399.0826 55000.0 0.25 591849.7854 41700.0 0.22 0.3356 0.9977 1013141 ChemDiv3_000462 C[n+]1cccc(c1)C(=O)NO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E23 mock treatment 605641.791 88200.0 0.41 584553.6481 34400.0 0.18 0.4167 0.9345 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 E24 mock treatment 593096.3855 75700.0 0.35 680784.6154 131000.0 0.69 0.7367 0.9496 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F01 compound treatment 593795.0 76400.0 0.35 617560.6061 67400.0 0.36 0.5018 1.0 1512742 ChemDiv3_000463 CN(C)CCNC(=O)C1(CC2(C)CC3(C)CC(C)(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F02 compound treatment 621521.327 104000.0 0.48 518573.8636 -31600.0 -0.17 0.221 0.4346 1734477 ChemDiv3_000464 O=c1n(Cc2ccccc2)c3ccccc3n1Cc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F03 compound treatment 406147.6923 -111000.0 -0.51 617633.0275 67500.0 0.36 -0.1098 -0.1755 3117678 ChemDiv3_000465 CCN(CC)C(=S)Sc1ncnc2sc3CCCCc3c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F04 compound treatment 269805.9361 -248000.0 -1.14 677241.573 127000.0 0.67 -0.3308 -0.2495 3020494 ChemDiv3_000466 COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)NC1c3ccccc3F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F05 compound treatment 346215.4696 -171000.0 -0.79 576903.0303 26700.0 0.14 -0.458 -0.571 3020545 ChemDiv3_000467 C=CCN1C(=O)NC(=O)/C(=C/c2ccco2)/C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F06 compound treatment 463715.4255 -53700.0 -0.25 597968.0365 47800.0 0.25 0.0042 0.0118 1529101 ChemDiv3_000468 Clc1ccc(NC(NC(=O)c2ccccc2)C(=O)c3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F07 compound treatment 7996.9136 -509000.0 -2.35 56711.1111 -493000.0 -2.62 -3.5119 -0.9985 1408295 ChemDiv3_000469 Clc1ccc(OCC(=O)CC(=O)c2ccc(Cl)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F08 compound treatment 374337.3206 -143000.0 -0.66 651635.3591 101000.0 0.54 -0.086 -0.101 1428920 ChemDiv3_000470 Cc1cc(C)c(OCC(O)CNC(C)(C)C)c(C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F09 compound treatment 328335.6481 -189000.0 -0.87 737668.0851 187000.0 0.99 0.0867 0.0655 1291361 ChemDiv3_000471 Nc1ccc(cc1)C(=O)OCc2nc3cc4ccccc4cc3[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F10 compound treatment 281388.7399 -236000.0 -1.09 224290.3226 -326000.0 -1.73 -1.9918 -0.9751 1234670 ChemDiv3_000472 CCOC(=O)c1oc2ccccc2c1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F11 compound treatment 216629.4737 -301000.0 -1.39 434514.8936 -116000.0 -0.61 -1.4146 -0.9327 1627155 ChemDiv3_000473 CN1C(=O)C(O)N(C1=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F12 compound treatment 232138.4929 -285000.0 -1.32 531232.9545 -18900.0 -0.1 -1.0013 -0.7589 3020546 ChemDiv3_000474 COc1ccc(/C=C/2\SC(=S)N(CCCC(=O)O)C2=O)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F13 compound treatment 267102.9412 -250000.0 -1.15 560147.651 9980.0 0.05 -0.7788 -0.674 3117679 ChemDiv3_000475 CCN1/C(=C\2/SC(=S)N(CC=C)C2=O)/Sc3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F14 compound treatment 231346.3918 -286000.0 -1.32 483022.2222 -67100.0 -0.36 -1.1847 -0.867 3117681 ChemDiv3_000476 Cc1ccc(cc1)C2(CC3CC4CC(C3)(C2)C(=O)NC5=NCCS5)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F15 compound treatment 400146.5296 -117000.0 -0.54 577371.179 27200.0 0.14 -0.2804 -0.5009 1673178 ChemDiv3_000477 COc1cc(cc(OC)c1OC)C2SC(C)C(=O)N2CCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F16 compound treatment 16436.1234 -501000.0 -2.31 74810.3448 -475000.0 -2.52 -3.4165 -0.999 3117682 ChemDiv3_000478 COC(=O)/C=C/S(=O)(=O)c1ccc(NC(=O)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F17 compound treatment 349340.2778 -168000.0 -0.78 579193.9163 29000.0 0.15 -0.4392 -0.5558 1500308 ChemDiv3_000479 Cc1ccc2c(=O)cc(oc2c1)c3ccc(F)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F18 compound treatment 282973.6148 -234000.0 -1.08 430081.6327 -120000.0 -0.64 -1.2149 -0.9682 3020547 ChemDiv3_000480 CC(=C1C(=NN(C1=O)c2ccccc2)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F19 compound treatment 286284.7222 -231000.0 -1.07 516594.697 -33600.0 -0.18 -0.8796 -0.814 1047176 ChemDiv3_000481 CCOC(=O)c1cc[nH]c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F20 compound treatment 531759.5819 14400.0 0.07 598097.2763 47900.0 0.25 0.2266 0.8625 3117683 ChemDiv3_000482 O=C1NC(=O)C(=Cc2cn(Cc3ccccc3)c4ccccc24)C(=O)N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F21 compound treatment 490914.8936 -26500.0 -0.12 506754.717 -43400.0 -0.23 -0.2492 -0.956 3020548 ChemDiv3_000483 c1cc2cc(oc2s1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F22 compound treatment 814681.1594 297000.0 1.37 847696.2963 298000.0 1.58 2.0853 0.9975 1488230 ChemDiv3_000484 COc1ccc(NC(=O)c2cc3cc(OC)ccc3oc2=N)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F23 mock treatment 501521.5517 -15900.0 -0.07 557975.7085 7810.0 0.04 -0.0225 -0.2677 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 F24 mock treatment 523669.6429 6260.0 0.03 574071.7489 23900.0 0.13 0.1101 0.8465 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G01 compound treatment 487577.1429 -29800.0 -0.14 508136.6906 -42000.0 -0.22 -0.2549 -0.9731 1360606 ChemDiv3_000485 CC(C)C(=O)Oc1cc(OC(=O)C(C)C)c2ccccc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G02 compound treatment 569071.4286 51700.0 0.24 582700.4405 32500.0 0.17 0.2905 0.9874 1922577 ChemDiv3_000486 Cc1[nH]c(=S)[nH]c1C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G03 compound treatment 358933.5347 -158000.0 -0.73 533353.5354 -16800.0 -0.09 -0.5798 -0.7876 1463550 ChemDiv3_000487 Fc1ccc(cc1)c2nc3ccc4ccccc4c3c5CCCc52 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G04 compound treatment 359294.1176 -158000.0 -0.73 552144.9275 1980.0 0.01 -0.5082 -0.6969 3020549 ChemDiv3_000488 COc1ccc(/C=C\2/SC(=S)N(C)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G05 compound treatment 335288.9518 -182000.0 -0.84 587782.6087 37600.0 0.2 -0.4528 -0.5245 3117684 ChemDiv3_000489 O=C/1/C(=C/c2ccccn2)/CC\C1=C/c3ccccn3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G06 compound treatment 363417.5824 -154000.0 -0.71 558556.9106 8390.0 0.04 -0.4707 -0.6615 1021484 ChemDiv3_000490 O=C1CSC(N1Cc2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G07 compound treatment 232027.7228 -285000.0 -1.32 510985.7651 -39200.0 -0.21 -1.0776 -0.8087 1308794 ChemDiv3_000491 Nc1ncc(s1)c2cc3ccccc3oc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G08 compound treatment 333279.8982 -184000.0 -0.85 553386.7925 3220.0 0.02 -0.5884 -0.6928 1604550 ChemDiv3_000492 CCN1CCCC1CNC(=O)c2cc(NC(=O)C)c(cc2OC)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G09 compound treatment 218671.9368 -299000.0 -1.38 553820.8955 3650.0 0.02 -0.9605 -0.6971 3020550 ChemDiv3_000493 Cn/1cccc\c1=N\c2cccc[n+]2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G10 compound treatment 266272.5322 -251000.0 -1.16 525290.3226 -24900.0 -0.13 -0.9122 -0.7826 3020551 ChemDiv3_000494 Cc1ccc(/C=N/c2cccc(Cl)c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G11 compound treatment 272348.8943 -245000.0 -1.13 508463.5193 -41700.0 -0.22 -0.9555 -0.8298 1452502 ChemDiv3_000495 Cc1cc(Nc2ccc(Cl)cc2)n3c4ccccc4nc3c1C#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G12 compound treatment 271457.7657 -246000.0 -1.13 536643.5644 -13500.0 -0.07 -0.8528 -0.7503 1609352 ChemDiv3_000496 Nc1ccc2[nH]c(nc2c1)c3ccccc3c4nc5cc(N)ccc5[nH]4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G13 compound treatment 309427.8846 -208000.0 -0.96 473677.193 -76500.0 -0.41 -0.9651 -0.9267 3117685 ChemDiv3_000497 Cc1ccc(NS(=O)(=O)c2cc(ccc2Br)C(=O)O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G14 compound treatment 385932.9897 -131000.0 -0.61 527914.1791 -22300.0 -0.12 -0.5122 -0.8292 1253750 ChemDiv3_000498 COc1ccc(cc1)N(C2SC(=O)N(C2=O)c3ccccc3)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G15 compound treatment 315293.6893 -202000.0 -0.93 520170.7317 -30000.0 -0.16 -0.7716 -0.816 3020552 ChemDiv3_000499 Cc1nc2ccc3nc(NC(=O)c4ccccc4C)sc3c2s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G16 compound treatment 267114.4708 -250000.0 -1.15 523269.2308 -26900.0 -0.14 -0.9171 -0.7885 3117686 ChemDiv3_000500 CCOc1ccc(cc1)[n+]2c(cn3CCCCCc32)c4ccc(OC)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G17 compound treatment 253781.8575 -264000.0 -1.22 407072.2892 -143000.0 -0.76 -1.3963 -0.9743 1162912 ChemDiv3_000501 CCc1ccc(cc1)c2nc3ccccc3c(=O)o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G18 compound treatment 223467.6409 -294000.0 -1.36 539168.6747 -11000.0 -0.06 -0.9998 -0.7369 1671355 ChemDiv3_000502 O=C(Oc1ccc2cc(OC(=O)c3ccccc3)ccc2c1)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G19 compound treatment 278180.2469 -239000.0 -1.1 470740.4844 -79400.0 -0.42 -1.078 -0.9128 1168078 ChemDiv3_000503 COC(=O)C1=C(C)NC(=O)NC1c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G20 compound treatment 286451.3716 -231000.0 -1.07 620557.6923 70400.0 0.37 -0.4891 -0.4334 1591511 ChemDiv3_000504 CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G21 compound treatment 469178.8079 -48200.0 -0.22 668058.0645 118000.0 0.63 0.2849 0.4292 1660119 ChemDiv3_000505 CCOC(=O)c1c(NC(=O)c2ccccc2C(=O)O)sc3CCCCc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G22 compound treatment 357586.4198 -160000.0 -0.74 569262.7119 19100.0 0.1 -0.4496 -0.6043 1447109 ChemDiv3_000506 CC(NS(=O)(=O)c1ccc(cc1)C(C)(C)C)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G23 mock treatment 518949.1525 1540.0 0.01 544235.5556 -5930.0 -0.03 -0.0172 -0.5339 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 G24 mock treatment 497979.0795 -19400.0 -0.09 506582.5688 -43600.0 -0.23 -0.2268 -0.9148 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H01 compound treatment 314756.0976 -203000.0 -0.93 287300.0 -263000.0 -1.39 -1.6467 -0.9811 1421806 ChemDiv3_000507 Nc1sc(c(Cc2ccccc2)c1C(=O)O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H02 compound treatment 570957.672 53600.0 0.25 637810.0 87600.0 0.46 0.5033 0.9562 3020553 ChemDiv3_000508 Cc1ccc2n(CC=C)c(=O)n(CC=C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H03 compound treatment 443639.3443 -73800.0 -0.34 560741.9355 10600.0 0.06 -0.2009 -0.5827 3117687 ChemDiv3_000509 Clc1ccccc1/C=C/C=N/c2ccc(cc2)N3CCOCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H04 compound treatment 363893.7198 -154000.0 -0.71 639745.3704 89600.0 0.48 -0.1646 -0.1931 1282292 ChemDiv3_000510 CC(C)CNP(=O)(OC1CC(C)CCC1C(C)C)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H05 compound treatment 382725.2747 -135000.0 -0.62 629810.9453 79600.0 0.42 -0.1405 -0.187 3020554 ChemDiv3_000511 CN1C(=O)N(C)C(=O)C(=CNC2(CC3CC4CC(C3)C2)C4)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H06 compound treatment 266195.122 -251000.0 -1.16 476979.8995 -73200.0 -0.39 -1.0937 -0.8951 1916294 ChemDiv3_000512 O=C(NC(Sc1ncccn1)C(=O)c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H07 compound treatment 418944.9541 -98500.0 -0.45 671054.0541 121000.0 0.64 0.1323 0.1684 1433778 ChemDiv3_000513 OC(=O)CSc1nc2ccccc2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H08 compound treatment 350656.7164 -167000.0 -0.77 633758.6207 83600.0 0.44 -0.2303 -0.2594 1920143 ChemDiv3_000514 Sc1n[n+]2c(cc(nc2s1)c3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H09 compound treatment 291367.5418 -226000.0 -1.04 600272.7273 50100.0 0.27 -0.5492 -0.5105 3020555 ChemDiv3_000515 Nc1cc(N)cc(c1)C(=O)OCN2C(=O)c3ccccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H10 compound treatment 284171.6738 -233000.0 -1.08 556871.6981 6700.0 0.04 -0.7354 -0.6834 3117688 ChemDiv3_000516 O=C(NCc1ccccc1)/C(=C\c2ccccc2)/NC(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H11 compound treatment 225558.8235 -292000.0 -1.35 471263.5379 -78900.0 -0.42 -1.2476 -0.8852 3117689 ChemDiv3_000517 CCN1/C(=C\2/N(C(=S)N(C)C2=O)c3ccccc3)/C=Cc4ccccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H12 compound treatment 228833.0059 -289000.0 -1.33 598400.9009 48200.0 0.26 -0.7601 -0.5609 1591023 ChemDiv3_000518 CC(=O)Nc1ccc(NS(=O)(=O)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H13 compound treatment 410573.0994 -107000.0 -0.49 523606.7416 -26600.0 -0.14 -0.448 -0.8743 3020556 ChemDiv3_000519 CC/C(=C\c1sc2ccc(OC)cc2[n+]1CC)/SCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H14 compound treatment 285655.8891 -232000.0 -1.07 445885.7143 -104000.0 -0.55 -1.1468 -0.953 1680898 ChemDiv3_000520 S=C(NC1CCCCC1)C2(CC3CC4CC(C3)CC2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H15 compound treatment 283313.0435 -234000.0 -1.08 520972.549 -29200.0 -0.15 -0.8729 -0.8003 1183680 ChemDiv3_000521 Clc1ccccc1NC(=O)c2cc3ccccc3oc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H16 compound treatment 195046.729 -322000.0 -1.49 368800.0 -181000.0 -0.96 -1.7314 -0.9778 1868581 ChemDiv3_000522 Nc1cc(=O)[nH]c(SCC=C)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H17 compound treatment 336429.8643 -181000.0 -0.83 578899.5816 28700.0 0.15 -0.4824 -0.5686 1530765 ChemDiv3_000523 CC(C)(O)C1(CC2CC3C1)CC(C2)(C3)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H18 compound treatment 292659.6737 -225000.0 -1.04 551962.1212 1790.0 0.01 -0.7262 -0.7006 1142850 ChemDiv3_000524 CC1(C)CC(C)(O)P(=O)(O1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H19 compound treatment 250684.1004 -267000.0 -1.23 486154.5064 -64000.0 -0.34 -1.1099 -0.8698 1258965 ChemDiv3_000525 COC(OC)(C(=O)c1ccccc1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H20 compound treatment 332343.662 -185000.0 -0.85 477694.4444 -72500.0 -0.38 -0.8753 -0.9351 1712075 ChemDiv3_000526 Nc1ccc(cc1)C(=O)Nc2ccc(O)c(c2)c3nc4ccccc4o3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H21 compound treatment 10506.4103 -507000.0 -2.34 70296.2963 -480000.0 -2.55 -3.4527 -0.9991 3020557 ChemDiv3_000527 CC(C)(C)N/C=C\1/C=C(SC1=S)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H22 compound treatment 265635.2459 -252000.0 -1.16 484676.3636 -65500.0 -0.35 -1.0666 -0.8801 1374190 ChemDiv3_000528 COc1ccc(CC(CC(=O)O)C(=O)Nc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H23 mock treatment 469901.4085 -47500.0 -0.22 547151.7857 -3020.0 -0.02 -0.1662 -0.7567 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 H24 mock treatment 484004.8544 -33400.0 -0.15 580217.3913 30000.0 0.16 0.0038 0.017 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I01 compound treatment 494556.5611 -22900.0 -0.11 499495.1923 -50700.0 -0.27 -0.2646 -0.9164 1677573 ChemDiv3_000529 CN1C(=O)c2ccc(NC(=O)c3cccc4ccccc34)cc2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I02 compound treatment 523658.9862 6250.0 0.03 570407.8947 20200.0 0.11 0.0963 0.8663 1561089 ChemDiv3_000530 C1C2CC3CC1CC(C2)(C3)c4coc(n4)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I03 compound treatment 448079.2079 -69300.0 -0.32 597874.3169 47700.0 0.25 -0.0472 -0.1157 1284188 ChemDiv3_000531 CN(C)c1ccc(cc1)c2nc3ccc4ccccc4c3c5CCCc52 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I04 compound treatment 325515.7385 -192000.0 -0.88 712000.0 162000.0 0.86 -0.0188 -0.0152 3020558 ChemDiv3_000532 O=C/1N(CNc2ccccc2)C(=S)S\C1=C\c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I05 compound treatment 391831.8584 -126000.0 -0.58 672849.2462 123000.0 0.65 0.0506 0.0581 3117690 ChemDiv3_000533 O=C/1/C(=C/c2cc3ccccc3o2)/CC\C1=C/c4cc5ccccc5o4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I06 compound treatment 379473.9454 -138000.0 -0.64 650707.4468 101000.0 0.53 -0.0727 -0.0876 1740048 ChemDiv3_000534 Cc1ccc(cc1C)C2(CC3CC4CC(CN)(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I07 compound treatment 261114.2857 -256000.0 -1.18 553157.8947 2990.0 0.02 -0.8245 -0.6976 3117691 ChemDiv3_000535 CC(C)C1CCC(C)/C(=C\c2ccc(N)cc2)/C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I08 compound treatment 335427.4611 -182000.0 -0.84 670619.7183 120000.0 0.64 -0.1417 -0.1343 3020559 ChemDiv3_000536 Cc1cccc(/N=C/c2c(C)c(C#N)c3nc4ccccc4n3c2O)c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I09 compound treatment 276181.07 -241000.0 -1.11 678756.6372 129000.0 0.68 -0.3044 -0.2332 3117692 ChemDiv3_000537 Cn1c(c2ccc3ccccc3n2)[n+](C)c4ccccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I10 compound treatment 303062.3377 -214000.0 -0.99 509602.3392 -40600.0 -0.22 -0.8511 -0.8413 3020560 ChemDiv3_000538 Cc1ccc(/C=N/c2cccc3ccccc23)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I11 compound treatment 240972.8155 -276000.0 -1.27 670086.7925 120000.0 0.64 -0.4517 -0.317 3117694 ChemDiv3_000539 CC(C)c1c(C#N)c(N)nc(SCC(=O)c2ccc(Cl)c(Cl)c2)c1C#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I12 compound treatment 206752.7675 -311000.0 -1.43 478278.3883 -71900.0 -0.38 -1.2826 -0.8652 1294664 ChemDiv3_000540 O=S(=O)(N1CCCc2ccccc12)c3ccc4ccccc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I13 compound treatment 274021.692 -243000.0 -1.12 579901.9608 29700.0 0.16 -0.6821 -0.6018 3020561 ChemDiv3_000541 CCOc1c(NC(=O)c2ccc(N)cc2)cc(NC(=O)c3ccc(N)cc3)cc1C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I14 compound treatment 296752.4178 -221000.0 -1.02 551682.5939 1510.0 0.01 -0.7139 -0.7015 1029333 ChemDiv3_000542 COc1ccc(cc1)S(=O)(=O)c2ccc(OC)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I15 compound treatment 205614.1079 -312000.0 -1.44 474704.2254 -75500.0 -0.4 -1.2998 -0.8708 3117695 ChemDiv3_000543 Cc1ccc(cc1)N(CCCCN2C(=O)c3ccccc3C2=O)C(=O)c4cccc(Cl)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I16 compound treatment 265494.9084 -252000.0 -1.16 526974.6377 -23200.0 -0.12 -0.9085 -0.7776 3020562 ChemDiv3_000544 COc1ccc(cc1)C(=O)C[n+]2cc(c3ccc(OC)cc3)n4CCCCCc42 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I17 compound treatment 294387.2832 -223000.0 -1.03 464541.2186 -85600.0 -0.45 -1.0484 -0.9325 1434553 ChemDiv3_000545 CCc1ccc(cc1)C(=O)Nc2ccc(Br)cn2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I18 compound treatment 311882.7586 -206000.0 -0.95 436354.3307 -114000.0 -0.6 -1.0971 -0.9763 3117696 ChemDiv3_000546 OC1=C(C(N(C1=O)c2ccccc2)c3ccccc3)C(=O)/C=C/c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I19 compound treatment 293469.163 -224000.0 -1.03 666917.8082 117000.0 0.62 -0.2924 -0.2428 1267294 ChemDiv3_000547 COc1ccc(cc1)N(CN2C(=O)c3ccccc3C2=O)C(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I20 compound treatment 303314.4796 -214000.0 -0.99 617017.7305 66800.0 0.35 -0.4474 -0.4265 1626144 ChemDiv3_000548 CC(C)C1CCC(=C(Cc2ccc(OC(=O)c3ccccc3)cc2)C1=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I21 compound treatment 318807.5 -199000.0 -0.92 540385.2459 -9780.0 -0.05 -0.6843 -0.746 3020563 ChemDiv3_000549 Cc1sc(NC(=O)/C=C/C(=O)O)c(C#N)c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I22 compound treatment 519643.1373 2240.0 0.01 574192.0 24000.0 0.13 0.0974 0.7618 1738105 ChemDiv3_000550 CNC(=O)C1OC(C)(OC1C(=O)NC)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I23 mock treatment 325432.5069 -192000.0 -0.89 738166.6667 188000.0 1.0 0.0791 0.0593 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 I24 mock treatment 543665.1786 26300.0 0.12 583898.6175 33700.0 0.18 0.2121 0.9819 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J01 compound treatment 277836.6337 -240000.0 -1.1 213228.972 -337000.0 -1.79 -2.0449 -0.9733 3020564 ChemDiv3_000551 COc1ccccc1NC(=O)c2c(/N=C/c3c(O)ccc4ccccc34)cnn2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J02 compound treatment 780824.4681 263000.0 1.21 709348.3146 159000.0 0.84 1.456 0.9842 3117697 ChemDiv3_000552 FC(F)(F)c1nc2cc(Cl)ccc2[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J03 compound treatment 446103.2258 -71300.0 -0.33 611479.5918 61300.0 0.33 -0.0026 -0.0056 1921072 ChemDiv3_000553 Clc1cccc(/C=N/c2ccc(cc2)N3CCOCC3)c1Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J04 compound treatment 293648.2618 -224000.0 -1.03 705521.7391 155000.0 0.82 -0.147 -0.1113 1215794 ChemDiv3_000554 Cc1cc(C)n2c(Br)c(CSc3nc4ccccc4o3)nc2n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J05 compound treatment 390870.0265 -127000.0 -0.58 731417.1429 181000.0 0.96 0.2671 0.2375 3020627 ChemDiv3_000555 CCN(CC)c1ccc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J06 compound treatment 376895.1841 -141000.0 -0.65 660094.3396 110000.0 0.58 -0.0459 -0.0527 1612444 ChemDiv3_000556 O=C(NCn1ccc(=O)[nH]c1=S)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J07 compound treatment 239466.3677 -278000.0 -1.28 598678.7565 48500.0 0.26 -0.7244 -0.5541 1318279 ChemDiv3_000557 S=C(N1CCOCC1)c2nc3ccccc3[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J08 compound treatment 364833.3333 -153000.0 -0.7 694923.0769 145000.0 0.77 0.0454 0.0436 1916211 ChemDiv3_000558 CC(=O)N[N+]1=C(N)c2ccccc2C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J09 compound treatment 321217.5926 -196000.0 -0.9 594175.2137 44000.0 0.23 -0.4747 -0.5081 3020628 ChemDiv3_000559 Cc1c(/C=C/2\SC(=NC2=O)c3ccccc3)c(=O)n(c4ccccc4)n1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J10 compound treatment 276421.5457 -241000.0 -1.11 529764.0449 -20400.0 -0.11 -0.8624 -0.7723 1181384 ChemDiv3_000560 CCN(CC)Cn1c(=S)oc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J11 compound treatment 388704.9608 -129000.0 -0.59 505080.9859 -45100.0 -0.24 -0.5888 -0.9201 1918939 ChemDiv3_000561 CCn1c(C)nc2cc(ccc12)S(=O)(=O)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J12 compound treatment 217296.9072 -300000.0 -1.38 540021.1864 -10100.0 -0.05 -1.0167 -0.7341 1013703 ChemDiv3_000562 OC(=O)CNc1ccc(cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J13 compound treatment 248971.2092 -268000.0 -1.24 485444.4444 -64700.0 -0.34 -1.1181 -0.8704 3117698 ChemDiv3_000563 COc1ccc2cc(C(=O)NC(=O)C)/c(=N/c3ccccc3)/oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J14 compound treatment 257156.1822 -260000.0 -1.2 503487.4552 -46700.0 -0.25 -1.0237 -0.8354 1005380 ChemDiv3_000564 O=C(Oc1cccc2ccccc12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J15 compound treatment 265666.6667 -252000.0 -1.16 487544.586 -62600.0 -0.33 -1.0558 -0.8743 1320959 ChemDiv3_000565 Cc1ccccc1NC(=O)CN2C(=O)c3ccccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J16 compound treatment 259860.1942 -258000.0 -1.19 550483.871 315.0 0.0 -0.8387 -0.7061 3117699 ChemDiv3_000566 Cc1cccc(/C=N/c2ccc(cc2)c3nc4cc(C)c(C)cc4o3)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J17 compound treatment 412130.4348 -105000.0 -0.49 516073.6842 -34100.0 -0.18 -0.4712 -0.9095 1212050 ChemDiv3_000567 OC1(C2CC3CC(C2)CC1C3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J18 compound treatment 281352.5896 -236000.0 -1.09 495258.8235 -54900.0 -0.29 -0.9757 -0.8658 1521008 ChemDiv3_000568 CCN(CC)P1(=O)OC(C)(C)CC1(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J19 compound treatment 262606.0 -255000.0 -1.18 536951.5419 -13200.0 -0.07 -0.8805 -0.748 1778430 ChemDiv3_000569 CCN1C(=O)/C(=C\2/C=Cc3ccccc3N2CC)/SC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J20 compound treatment 279020.0893 -238000.0 -1.1 536682.8194 -13500.0 -0.07 -0.8279 -0.7515 1147350 ChemDiv3_000570 Clc1cccc(NCN2C(=O)CCC2=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J21 compound treatment 14394.8718 -503000.0 -2.32 54897.9592 -495000.0 -2.63 -3.4978 -0.9981 3020629 ChemDiv3_000571 CN(C)/C=C\1/C=C(SC1=S)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J22 compound treatment 401958.5062 -115000.0 -0.53 452904.7619 -97300.0 -0.52 -0.7413 -0.9999 3117701 ChemDiv3_000572 CC(CC(=O)Nc1ccccc1I)Cc2cc(C)cc(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J23 mock treatment 526713.0435 9310.0 0.04 534822.3938 -15300.0 -0.08 -0.0272 -0.2957 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 J24 mock treatment 513333.3333 -4070.0 -0.02 530380.2281 -19800.0 -0.1 -0.0875 -0.8206 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K01 compound treatment 617247.5248 99800.0 0.46 547143.5185 -3030.0 -0.02 0.3142 0.682 3020630 ChemDiv3_000573 Brc1ccc(/C=N/c2nnc(NC(=O)/C=C/c3ccccc3)s2)s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K02 compound treatment 753373.057 236000.0 1.09 741442.953 191000.0 1.01 1.4868 0.9994 1679209 ChemDiv3_000574 O=C(CSC#N)C1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K03 compound treatment 327089.7098 -190000.0 -0.88 579537.3134 29400.0 0.16 -0.5105 -0.5727 1307245 ChemDiv3_000575 CCN(CC)c1ccc(cc1)C2C3=C(CC(C)(C)CC3=O)OC4=C2C(=O)CC(C)(C)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K04 compound treatment 277531.1111 -240000.0 -1.11 620766.5198 70600.0 0.37 -0.5174 -0.4431 3020631 ChemDiv3_000576 FC(F)(F)C(=O)N(CN1C(=O)c2ccccc2C1=O)c3ccc(Cl)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K05 compound treatment 204334.7023 -313000.0 -1.44 465768.8172 -84400.0 -0.45 -1.3374 -0.8848 3117702 ChemDiv3_000577 COC(=O)CNC(c1ccccc1)c2cc(Br)ccc2/N=C/c3ccccc3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K06 compound treatment 226441.5011 -291000.0 -1.34 569028.8462 18900.0 0.1 -0.8781 -0.6526 3020632 ChemDiv3_000578 CC(=C)C(=O)Nc1ccc2C(=O)NC(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K07 compound treatment 240622.093 -277000.0 -1.28 505079.4393 -45100.0 -0.24 -1.0717 -0.8252 3117703 ChemDiv3_000579 CC(C)C1CCC(C)/C(=C\c2ccc(cc2)N(C)C)/C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K08 compound treatment 363824.2894 -154000.0 -0.71 540347.6395 -9820.0 -0.05 -0.5377 -0.7571 3020633 ChemDiv3_000580 COc1ccc(/C=C/2\Cc3ccccc3C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K09 compound treatment 442770.8333 -74600.0 -0.34 556021.4592 5850.0 0.03 -0.2214 -0.6407 3020634 ChemDiv3_000581 C[n+]1cc(cc2ccccc12)c3ccc4ccccc4n3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K10 compound treatment 304522.1239 -213000.0 -0.98 587198.1567 37000.0 0.2 -0.5553 -0.5547 3117704 ChemDiv3_000582 CC(=O)Nc1ccc(/N=C/c2ccc(C)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K11 compound treatment 466812.3249 -50600.0 -0.23 682178.744 132000.0 0.7 0.3301 0.4473 1317973 ChemDiv3_000583 CC(=O)NS(=O)(=O)c1ccc(Br)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K12 compound treatment 234474.2857 -283000.0 -1.3 743986.7841 194000.0 1.03 -0.1957 -0.1178 1685696 ChemDiv3_000584 COCc1cc(C)nc(N2CCOCC2)c1C#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K13 compound treatment 228374.5174 -289000.0 -1.33 410576.5766 -140000.0 -0.74 -1.4661 -0.9615 1680270 ChemDiv3_000585 CCCCN1CCN(CC1)c2nc(c3ccccc3)c4cc(C)ccc4n2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K14 compound treatment 149630.4348 -368000.0 -1.7 468500.0 -81700.0 -0.43 -1.5056 -0.8601 3020635 ChemDiv3_000586 COC(=O)Oc1cc2oc(=O)sc2cc1Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K15 compound treatment 370657.277 -147000.0 -0.68 555430.2326 5260.0 0.03 -0.4588 -0.6774 3117705 ChemDiv3_000587 COc1ccc(cc1)C(=O)N(CCCCN2C(=O)c3ccccc3C2=O)c4ccc(C)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K16 compound treatment 267057.6208 -250000.0 -1.15 712491.8699 162000.0 0.86 -0.2076 -0.1441 1915086 ChemDiv3_000588 OCCNC(=S)Nc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K17 compound treatment 338133.9492 -179000.0 -0.83 613773.1959 63600.0 0.34 -0.3461 -0.3875 3020636 ChemDiv3_000589 CCc1ccc(cc1)C(=O)Nc2nccs2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K18 compound treatment 423923.4973 -93500.0 -0.43 610531.6901 60400.0 0.32 -0.0785 -0.1461 1362496 ChemDiv3_000590 O=C(Nn1cnc2ccccc2c1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K19 compound treatment 352669.1729 -165000.0 -0.76 533406.015 -16800.0 -0.09 -0.6001 -0.7845 3117706 ChemDiv3_000591 NC(=O)C[n+]1cccc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K20 compound treatment 317894.8655 -200000.0 -0.92 686085.5856 136000.0 0.72 -0.1408 -0.1205 3117707 ChemDiv3_000592 C/C(=N\N)/c1c(c2ccccc2)c3cc(Br)ccc3[nH]c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K21 compound treatment 560988.189 43600.0 0.2 643225.1082 93100.0 0.49 0.4911 0.9216 1318329 ChemDiv3_000593 OCC1(CC2CC3C1)CC(CO)(C2)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K22 compound treatment 549177.1654 31800.0 0.15 617767.1756 67600.0 0.36 0.3571 0.922 1110839 ChemDiv3_000594 OC(=O)c1ccccc1C(=O)OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K23 mock treatment 610780.4878 93400.0 0.43 705793.4272 156000.0 0.83 0.8881 0.954 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 K24 mock treatment 546105.5046 28700.0 0.13 533877.7293 -16300.0 -0.09 0.0325 0.2055 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L01 compound treatment 739344.186 222000.0 1.02 727150.4854 177000.0 0.94 1.3875 0.9991 1272387 ChemDiv3_000595 CC(=O)Nc1ccc(NC(=O)c2ccnn2C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L02 compound treatment 600819.5122 83400.0 0.38 597483.0918 47300.0 0.25 0.4494 0.9786 3020637 ChemDiv3_000596 C(Sc1nnc(o1)c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L03 compound treatment 509371.875 -8040.0 -0.04 713995.2153 164000.0 0.87 0.5882 0.6763 3117708 ChemDiv3_000597 COC(=O)c1ccc(/C=N/c2ccc3oc(nc3c2)c4cccc(OC)c4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L04 compound treatment 437773.7789 -79600.0 -0.37 715530.2326 165000.0 0.88 0.3605 0.3791 3020638 ChemDiv3_000598 Cc1csc2nc(CSc3ccc(Cl)cc3)c(Br)n12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L05 compound treatment 456492.0635 -60900.0 -0.28 698262.8866 148000.0 0.79 0.3568 0.4277 3117709 ChemDiv3_000599 CC(=O)NC(=O)c/1cc2ccccc2o\c1=N/c3ccc(cc3)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L06 compound treatment 285092.6316 -232000.0 -1.07 670412.3711 120000.0 0.64 -0.3066 -0.2459 3020639 ChemDiv3_000600 S=c1cc[nH]c(=S)n1c2nc(sc2c3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L07 compound treatment 305314.6552 -212000.0 -0.98 648598.9583 98400.0 0.52 -0.3225 -0.2908 3117710 ChemDiv3_000601 CC(=O)N1CCc2cc(/N=C/c3ccc(Cl)cc3)ccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L08 compound treatment 347864.9289 -170000.0 -0.78 671984.9246 122000.0 0.65 -0.096 -0.0946 3020640 ChemDiv3_000602 Cc1nc2ccc(/N=C/c3ccc(Br)cc3)cc2s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L09 compound treatment 394072.9412 -123000.0 -0.57 640355.3719 90200.0 0.48 -0.0639 -0.086 3117711 ChemDiv3_000603 Cc1n[nH]c(C)c1Sc2ccccc2/N=C/c3ccc(C)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L10 compound treatment 337655.2707 -180000.0 -0.83 604069.1244 53900.0 0.29 -0.384 -0.4379 1663127 ChemDiv3_000604 CC(C)OC(=O)C1=C(C)NC(=S)NC1c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L11 compound treatment 295473.6842 -222000.0 -1.02 446720.5882 -103000.0 -0.55 -1.1117 -0.9573 1238798 ChemDiv3_000605 CC[N+]1=C(C)C(C)(C)c2cc(ccc12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L12 compound treatment 223567.0732 -294000.0 -1.36 792524.4444 242000.0 1.29 -0.0492 -0.0264 3117713 ChemDiv3_000606 Brc1cccc(NC(=O)c2cccc3-c4ccccc4C(=O)c32)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L13 compound treatment 347492.0128 -170000.0 -0.78 758386.6667 208000.0 1.1 0.2268 0.1675 1507618 ChemDiv3_000607 COc1ccc2oc(=N)c(cc2c1)c3nc4ccccc4[nH]3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L14 compound treatment 194136.4764 -323000.0 -1.49 567737.8049 17600.0 0.09 -0.9883 -0.6616 3020641 ChemDiv3_000608 CNc1ncnc(S)c1N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L15 compound treatment 383807.2289 -134000.0 -0.62 615036.6492 64900.0 0.34 -0.1924 -0.2726 1703537 ChemDiv3_000609 O=C(CN1C(=O)c2ccccc2C1=O)Nc3nccs3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L16 compound treatment 268504.386 -249000.0 -1.15 576383.3992 26200.0 0.14 -0.7133 -0.6169 3117714 ChemDiv3_000610 Oc1ccc(Cl)cc1/C=N/c2ccc3oc(Cc4ccc(Cl)cc4)nc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L17 compound treatment 494359.2018 -23000.0 -0.11 701778.2258 152000.0 0.8 0.4934 0.6084 1529335 ChemDiv3_000611 OC(=O)C=C1C2CC3CC(C2)CC1C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L18 compound treatment 371740.6542 -146000.0 -0.67 499832.7526 -50300.0 -0.27 -0.6638 -0.9183 3117715 ChemDiv3_000612 Clc1ccccc1/C=C\2/SC(=O)N(C2=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L19 compound treatment 391040.107 -126000.0 -0.58 580190.6977 30000.0 0.16 -0.2995 -0.4957 3117716 ChemDiv3_000613 CCOc1ccc(/C=C(\NC(=O)c2ccccc2)/C(=O)NC)c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L20 compound treatment 453099.4475 -64300.0 -0.3 611175.4386 61000.0 0.32 0.0191 0.0435 3020642 ChemDiv3_000614 COc1cccc2ccc(Cl)nc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L21 compound treatment 61583.3333 -456000.0 -2.1 45656.25 -505000.0 -2.68 -3.3786 -0.9929 3020643 ChemDiv3_000615 CN/C=C\1/C=C(SC1=S)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L22 compound treatment 521706.1224 4300.0 0.02 538012.0968 -12200.0 -0.06 -0.0316 -0.4681 3117717 ChemDiv3_000616 N#CCC(c1ccccc1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L23 mock treatment 556720.8333 39300.0 0.18 529498.0392 -20700.0 -0.11 0.0507 0.2392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 L24 mock treatment 604652.7197 87200.0 0.4 539995.5556 -10200.0 -0.05 0.2463 0.6068 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M01 compound treatment 359969.8276 -157000.0 -0.73 308969.697 -241000.0 -1.28 -1.418 -0.964 1490670 ChemDiv3_000617 O=C(Oc1ccccc1)Oc2ccc3oc(=O)sc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M02 compound treatment 530177.5701 12800.0 0.06 547624.4344 -2540.0 -0.01 0.0321 0.5313 3117718 ChemDiv3_000618 Cc1ccc(Oc2ccc(C)c(C)c2)cc1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M03 compound treatment 367979.4118 -149000.0 -0.69 611938.9671 61800.0 0.33 -0.2556 -0.335 1380597 ChemDiv3_000619 COc1ccc(cc1)c2nc3ccc4ccccc4c3c5CCCc52 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M04 compound treatment 362362.2449 -155000.0 -0.72 600045.2489 49900.0 0.26 -0.3185 -0.4178 3020644 ChemDiv3_000620 FC(F)(F)C(=O)N(CN1C(=O)CCC1=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M05 compound treatment 364633.0749 -153000.0 -0.7 592151.0417 42000.0 0.22 -0.3407 -0.4611 1629777 ChemDiv3_000621 Nc1ccc(Br)cc1C(O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M06 compound treatment 373871.3911 -144000.0 -0.66 600122.5296 50000.0 0.26 -0.2807 -0.3937 3117719 ChemDiv3_000622 CNc1cc(NC)c2ncnc3-c4ccccc4C(=O)c1c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M07 compound treatment 317563.0841 -200000.0 -0.92 564923.913 14800.0 0.08 -0.5963 -0.6447 3020645 ChemDiv3_000623 CC(C)C1CCC(C)/C(=C/c2ccc(NC(=O)CCC(=O)O)cc2)/C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M08 compound treatment 308987.2611 -208000.0 -0.96 644573.4597 94400.0 0.5 -0.3256 -0.3004 1472960 ChemDiv3_000624 COc1ccc2CN(C(=O)c2c1OC)c3nnc[nH]3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M09 compound treatment 337642.5121 -180000.0 -0.83 489377.8626 -60800.0 -0.32 -0.8142 -0.9153 3020646 ChemDiv3_000625 CC(=O)n1c2ccccc2c3cc(Br)ccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M10 compound treatment 370580.2139 -147000.0 -0.68 691264.7059 141000.0 0.75 0.0504 0.0499 3117720 ChemDiv3_000626 COc1ccc(/C=N/c2cccc(Cl)c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M11 compound treatment 414094.6746 -103000.0 -0.48 759079.3651 209000.0 1.11 0.4466 0.3703 1922766 ChemDiv3_000627 Oc1ccccc1/C=N/c2ccc(cc2)c3nc4ccccc4s3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M12 compound treatment 264367.4833 -253000.0 -1.17 556082.4742 5910.0 0.03 -0.803 -0.6879 3020648 ChemDiv3_000628 CCN1C(=C(C#N)C#N)C=Cc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M13 compound treatment 310445.8763 -207000.0 -0.95 574234.7826 24100.0 0.13 -0.5846 -0.6071 1708776 ChemDiv3_000629 C1CC[N+]2(C1)CCN(CC2)c3ncccn3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M14 compound treatment 341567.9348 -176000.0 -0.81 606306.9767 56100.0 0.3 -0.3629 -0.42 1728722 ChemDiv3_000630 COc1ccc(cc1)N2C(=O)c3ccc(Oc4ccccc4)cc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M15 compound treatment 325516.4835 -192000.0 -0.88 671684.4262 122000.0 0.64 -0.17 -0.1553 3020649 ChemDiv3_000631 COc1cccc(/N=C\c2c[nH]c3ccccc23)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M16 compound treatment 347906.3291 -170000.0 -0.78 598456.1404 48300.0 0.26 -0.3716 -0.4518 3117721 ChemDiv3_000632 Brc1ccc2NC(=O)CN(C(c3ccccc3)c2c1)C(=O)/C=C/c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M17 compound treatment 389132.5 -128000.0 -0.59 608297.8723 58100.0 0.31 -0.2003 -0.3002 1294702 ChemDiv3_000633 C1CCCN(CC1)c2nc(nc(n2)N3CCCCCC3)N4CCCCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M18 compound treatment 334737.9135 -183000.0 -0.84 525184.0 -25000.0 -0.13 -0.6894 -0.8084 3117722 ChemDiv3_000634 Brc1ccc(NC(=O)Nc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M19 compound treatment 357498.7893 -160000.0 -0.74 539549.2228 -10600.0 -0.06 -0.5613 -0.7589 1311944 ChemDiv3_000635 c1c(nc2ccccn12)c3ccc(cc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M20 compound treatment 614072.6496 96700.0 0.45 610616.1616 60400.0 0.32 0.5419 0.9869 1216291 ChemDiv3_000636 OCCNC(=S)NC1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M21 compound treatment 617303.0303 99900.0 0.46 588240.0 38100.0 0.2 0.4685 0.9315 1664260 ChemDiv3_000637 OC(=O)c1cc(ccc1O)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M22 compound treatment 511452.6749 -5950.0 -0.03 556809.0909 6640.0 0.04 0.0055 0.1228 3020650 ChemDiv3_000638 Fc1ccccc1C(=O)Nc2cc(ccc2Br)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M23 mock treatment 605305.2209 87900.0 0.41 591611.1111 41400.0 0.22 0.4421 0.9587 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 M24 mock treatment 503780.5907 -13600.0 -0.06 511350.4274 -38800.0 -0.21 -0.19 -0.8827 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N01 compound treatment 666483.871 149000.0 0.69 570334.7458 20200.0 0.11 0.5618 0.8074 3020651 ChemDiv3_000639 Cn1nccc1C(=O)Nc2ccc(Cl)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N02 compound treatment 698019.6078 181000.0 0.83 674019.1388 124000.0 0.66 1.0535 0.9931 3117723 ChemDiv3_000640 COC(=O)CSc1nnc(o1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N03 compound treatment 579465.0206 62100.0 0.29 583440.0 33300.0 0.18 0.3271 0.973 3117724 ChemDiv3_000641 COc1cc(Br)cc(/C=N/c2cccc(c2)c3nc4ccccc4o3)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N04 compound treatment 440331.5068 -77100.0 -0.36 716541.4634 166000.0 0.88 0.3726 0.3917 1628862 ChemDiv3_000642 CCOC(=O)c1csc(NC(=O)c2ccc(cc2)S(=O)(=O)N(CC)CC)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N05 compound treatment 366552.2388 -151000.0 -0.7 633687.1508 83500.0 0.44 -0.1787 -0.2167 1290427 ChemDiv3_000643 CC(=O)Oc1ccccc1N(C(=O)C)S(=O)(=O)c2ccc(C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N06 compound treatment 425129.6296 -92300.0 -0.43 660521.327 110000.0 0.59 0.113 0.1561 1570356 ChemDiv3_000644 CC(C)(C)C(=O)Nc1c(Cl)sc2nccc(=O)n12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N07 compound treatment 288290.4656 -229000.0 -1.06 581684.2105 31500.0 0.17 -0.6289 -0.5879 3020698 ChemDiv3_000645 CC(=O)N1CCc2cc(/N=C/c3ccc(O)cc3)ccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N08 compound treatment 23943.3962 -493000.0 -2.28 100786.8852 -449000.0 -2.38 -3.2945 -0.9997 3020699 ChemDiv3_000646 CN(C)/C=C/c1cc(=S)c2ccccc2s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N09 compound treatment 367781.1765 -150000.0 -0.69 625865.3061 75700.0 0.4 -0.204 -0.2556 1598396 ChemDiv3_000647 CSc1nnc-2c(OC(Nc3ccccc32)C4CCC(=CC4)C)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N10 compound treatment 76677.0428 -441000.0 -2.03 151240.9639 -399000.0 -2.12 -2.9334 -0.9998 3020700 ChemDiv3_000648 Oc1ccc(/C=C/2\SC(=S)N(CCc3ccccc3)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N11 compound treatment 65616.5644 -452000.0 -2.08 156500.0 -394000.0 -2.09 -2.9497 -1.0 3020701 ChemDiv3_000649 CN1/C(=C/C=C/c2oc3ccccc3[n+]2C)/Oc4ccccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N12 compound treatment 362979.5918 -154000.0 -0.71 583615.7895 33400.0 0.18 -0.3781 -0.5152 3117725 ChemDiv3_000650 Clc1ccc(/C=N/C(=O)CC#N)c(Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N13 compound treatment 265896.4646 -252000.0 -1.16 776092.1053 226000.0 1.2 0.0272 0.0163 1340722 ChemDiv3_000651 N=c1oc2ccc3ccccc3c2cc1C(=O)Nc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N14 compound treatment 342748.3589 -175000.0 -0.81 521498.1949 -28700.0 -0.15 -0.6771 -0.826 3117726 ChemDiv3_000652 COc1cc(/C=C\2/SC(=S)N(CC=C)C2=O)ccc1OC(=O)c3ccco3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N15 compound treatment 323006.135 -194000.0 -0.9 656770.7317 107000.0 0.57 -0.2341 -0.2209 3020702 ChemDiv3_000653 CC1=N/C(=C/c2cccnc2)/C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N16 compound treatment 267521.2528 -250000.0 -1.15 490133.3333 -60000.0 -0.32 -1.04 -0.8699 3117727 ChemDiv3_000654 CCN1/C(=C/c2ccc3ccccc3[n+]2CC)/Sc4cc(NC(=O)C)ccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N17 compound treatment 218665.8477 -299000.0 -1.38 647600.0 97400.0 0.52 -0.6088 -0.4137 1208186 ChemDiv3_000655 OC(=O)c1cc(nc2ccc(Br)cc12)C3(CC4CC5CC(C4)C3)C5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N18 compound treatment 413206.1856 -104000.0 -0.48 578593.4579 28400.0 0.15 -0.2332 -0.463 3020703 ChemDiv3_000656 CCN1C(=O)/C(=C\C(=C\c2ccccc2)\C)/SC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N19 compound treatment 19125.6281 -498000.0 -2.3 59736.8421 -490000.0 -2.6 -3.4642 -0.9981 3020704 ChemDiv3_000657 CN1C(=O)/C(=C\Nc2ccccc2)/C=C1c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N20 compound treatment 340850.2825 -177000.0 -0.81 485194.332 -65000.0 -0.34 -0.8194 -0.9268 3117728 ChemDiv3_000658 Cc1cccc(c1)N2C(=O)/C(=C\3/C(=O)Nc4ccccc34)/SC2=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N21 compound treatment 363728.3951 -154000.0 -0.71 607117.8451 56900.0 0.3 -0.2876 -0.3733 1544837 ChemDiv3_000659 Cc1cc(=O)nc(SCc2nc3ccccc3[nH]2)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N22 compound treatment 530767.4419 13400.0 0.06 574183.8565 24000.0 0.13 0.1336 0.9445 1021435 ChemDiv3_000660 Nc1ccc(NS(=O)(=O)c2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N23 mock treatment 549964.1434 32600.0 0.15 504768.9243 -45400.0 -0.24 -0.0641 -0.2259 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 N24 mock treatment 517617.3913 210.0 0.0 510445.3441 -39700.0 -0.21 -0.1483 -0.7038 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O01 compound treatment 551830.2583 34400.0 0.16 544852.2727 -5320.0 -0.03 0.0923 0.5725 1913320 ChemDiv3_000661 O=C(Oc1ccccc1)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O02 compound treatment 298257.0281 -219000.0 -1.01 320288.5572 -230000.0 -1.22 -1.5768 -0.9957 3020705 ChemDiv3_000662 Cc1cc(C)c(NC(=S)NC(=O)c2ccccc2)c(C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O03 compound treatment 561076.0456 43700.0 0.2 527766.1692 -22400.0 -0.12 0.0584 0.2497 3117729 ChemDiv3_000663 CCOc1ccc(N/C=N/c2ccc(OCC)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O04 compound treatment 553682.1705 36300.0 0.17 503669.5652 -46500.0 -0.25 -0.0561 -0.1883 1253491 ChemDiv3_000664 N#CCCN(Cn1c2ccccc2c3ccccc13)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O05 compound treatment 621236.0515 104000.0 0.48 540675.6757 -9490.0 -0.05 0.303 0.6293 1678987 ChemDiv3_000665 Cc1ccc2nc(cc(C(=O)NCc3ccccc3)c2c1)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O06 compound treatment 437727.6786 -79700.0 -0.37 487200.0 -63000.0 -0.33 -0.496 -0.9989 1464157 ChemDiv3_000666 Cc1cc(C)c(cc1C(=O)c2ccccc2)C(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O07 compound treatment 477992.8058 -39400.0 -0.18 539213.6364 -11000.0 -0.06 -0.1696 -0.8888 1645442 ChemDiv3_000667 CCOC(=O)c1ccc(NC(=O)CCc2c[nH]c3ccccc23)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O08 compound treatment 367126.9036 -150000.0 -0.69 378397.7901 -172000.0 -0.91 -1.1343 -0.9909 1026640 ChemDiv3_000668 Nc1ccccc1CC(c2c[nH]c3ccccc23)c4c[nH]c5ccccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O09 compound treatment 624513.0435 107000.0 0.49 685305.3435 135000.0 0.72 0.8561 0.9835 1267081 ChemDiv3_000669 CCN(CC)S(=O)(=O)c1cc(ccc1C)C(=O)Nc2ccccc2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O10 compound treatment 589157.6763 71800.0 0.33 640535.7143 90400.0 0.48 0.5729 0.9836 3117730 ChemDiv3_000670 CCOc1ccc(/C=N/c2ccc3sc(C)nc3c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O11 compound treatment 448915.5844 -68500.0 -0.32 498733.7278 -51400.0 -0.27 -0.4163 -0.9973 3020706 ChemDiv3_000671 CC(C)(C)c1cc(c2OCN(CC(=O)O)Cc2c1)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O12 compound treatment 535719.2982 18300.0 0.08 563572.093 13400.0 0.07 0.11 0.9963 3117731 ChemDiv3_000672 CCN(CC)c1ccc2cc(C(=O)N)/c(=N/c3ccc(F)cc3)/oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O13 compound treatment 616889.4009 99500.0 0.46 585892.7039 35700.0 0.19 0.4584 0.9235 3020707 ChemDiv3_000673 Clc1ccc2nc(Cl)cc(c3ccccc3)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O14 compound treatment 592715.0259 75300.0 0.35 562626.4151 12500.0 0.07 0.2923 0.8268 3117732 ChemDiv3_000674 Cc1cccc(C)c1OC(=O)Cc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O15 compound treatment 525482.2335 8070.0 0.04 558469.5122 8300.0 0.04 0.0575 0.9965 3020708 ChemDiv3_000675 C(=N/c1cccc2ccccc12)/c3c[nH]c4ccccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O16 compound treatment 740613.7339 223000.0 1.03 553271.3568 3100.0 0.02 0.7395 0.7183 1675948 ChemDiv3_000676 OC(=O)C(NC(=O)c1ccc(F)cc1)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O17 compound treatment 494504.0 -22900.0 -0.11 493776.8924 -56400.0 -0.3 -0.2862 -0.9022 1019063 ChemDiv3_000677 CC(C)(C)c1ccc(O)c(N)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O18 compound treatment 601127.451 83700.0 0.39 603355.7692 53200.0 0.28 0.4725 0.9881 1676074 ChemDiv3_000678 OC(=O)C1CCC(CC1)c2ccc(cc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O19 compound treatment 524311.7409 6900.0 0.03 582234.7826 32100.0 0.17 0.1428 0.8252 3020709 ChemDiv3_000679 CC(C(=O)c1ccccc1)[n+]2cccc(Br)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O20 compound treatment 492591.3621 -24800.0 -0.11 547417.3554 -2750.0 -0.01 -0.0912 -0.7909 1276194 ChemDiv3_000680 CC1(CC2CC3C1)CC(C2)(C3)NC(=O)c4ccc(Cl)cc4Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O21 compound treatment 539375.8389 22000.0 0.1 517099.2366 -33100.0 -0.18 -0.0524 -0.2586 1695393 ChemDiv3_000681 O=C(N1CCOCC1)C2(CC3CC4C2)CC(C3)(C4)C(=O)N5CCOCC5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O22 compound treatment 552600.8584 35200.0 0.16 574019.2308 23800.0 0.13 0.2042 0.9924 1315761 ChemDiv3_000682 CCN(CC)S(=O)(=O)c1cccc2cc(C(=O)O)c(O)cc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O23 mock treatment 538728.1553 21300.0 0.1 572683.9827 22500.0 0.12 0.154 0.9953 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 O24 mock treatment 523580.6452 6170.0 0.03 468116.4659 -82100.0 -0.44 -0.2876 -0.6594 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P01 compound treatment 575295.4545 57900.0 0.27 524919.598 -25200.0 -0.13 0.0941 0.315 1316678 ChemDiv3_000683 O=C(c1ccccc1)C2(CN3CN4CN(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P02 compound treatment 527937.5 10500.0 0.05 590852.8139 40700.0 0.22 0.1869 0.8451 3117733 ChemDiv3_000684 CC(C)OC(=O)CSc1nnc(o1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P03 compound treatment 551860.9023 34500.0 0.16 549212.3894 -957.0 -0.01 0.1088 0.6842 1919584 ChemDiv3_000685 Oc1ccccc1/C=N/c2ccc3oc(nc3c2)c4cccc(I)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P04 compound treatment 537638.6555 20200.0 0.09 528594.2029 -21600.0 -0.11 -0.0149 -0.1012 3020710 ChemDiv3_000686 OCCNC(=O)c1cc[n+](CC(=O)c2cccs2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P05 compound treatment 542319.6721 24900.0 0.11 499829.2683 -50300.0 -0.27 -0.1076 -0.37 1512305 ChemDiv3_000687 O=C(Oc1ccccc1N(C(=O)c2ccccc2)S(=O)(=O)c3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P06 compound treatment 511376.5182 -6030.0 -0.03 507524.0 -42600.0 -0.23 -0.1796 -0.7881 3020711 ChemDiv3_000688 Cc1ccc(/N=C/c2cn(nc2c3ccccc3)c4ccccc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P07 compound treatment 534057.1429 16600.0 0.08 571519.802 21400.0 0.11 0.1344 0.9821 1010956 ChemDiv3_000689 FC(F)(F)C(=O)Nc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P08 compound treatment 531207.7295 13800.0 0.06 536287.1795 -13900.0 -0.07 -0.0071 -0.0726 3117734 ChemDiv3_000690 CC(C)C1CCC(C)CC1OC(=O)Cn2c[n+](C)c3ccccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P09 compound treatment 567970.5882 50600.0 0.23 519513.3929 -30700.0 -0.16 0.0499 0.1756 3020712 ChemDiv3_000691 OC(=O)CCn1c(SCCOc2ccccc2)nc3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P10 compound treatment 606210.7623 88800.0 0.41 549561.3208 -608.0 0.0 0.2873 0.7015 3117735 ChemDiv3_000692 Cc1ccc(NC(=O)CN2C(=O)/C(=C\c3ccccc3)/SC2=S)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P11 compound treatment 375693.4866 -142000.0 -0.65 375556.4516 -175000.0 -0.93 -1.117 -0.9854 3020713 ChemDiv3_000693 COc1cc2sc(C)nc2c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P12 compound treatment 502322.8346 -15100.0 -0.07 550427.1845 258.0 0.0 -0.0482 -0.6931 3117736 ChemDiv3_000694 CC1(CCC2(CC(=O)c3ccccc3)CC1)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P13 compound treatment 501608.8435 -15800.0 -0.07 503172.5352 -47000.0 -0.25 -0.2278 -0.8771 3020714 ChemDiv3_000695 Nc1c(C#N)c(C(=O)c2ccc(Br)cc2)n3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P14 compound treatment 582298.7552 64900.0 0.3 525315.0685 -24900.0 -0.13 0.1184 0.362 3117737 ChemDiv3_000696 CCNc1nc(F)cc(=O)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P15 compound treatment 494441.6667 -23000.0 -0.11 547053.8117 -3120.0 -0.02 -0.0866 -0.8077 1476541 ChemDiv3_000697 OC(=O)c1ccc(NS(=O)(=O)c2ccc3NC(=O)c4cccc2c34)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P16 compound treatment 462706.1224 -54700.0 -0.25 546101.6949 -4070.0 -0.02 -0.1936 -0.7648 1722951 ChemDiv3_000698 C1CCC2(C1)Cc3ccccc3-c4nnc(c5ccccc5)n42 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P17 compound treatment 543245.7627 25800.0 0.12 544363.2653 -5810.0 -0.03 0.0625 0.5077 3117738 ChemDiv3_000699 CCC(O)(CC)C1(CC2CC3CC(C2)C1)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P18 compound treatment 508236.0515 -9170.0 -0.04 510655.3191 -39500.0 -0.21 -0.1781 -0.833 1912570 ChemDiv3_000700 Cc1ccc(CCS(=O)(=O)c2ccc(cc2)C(C)(C)C)c[n+]1CC(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P19 compound treatment 46142.8571 -471000.0 -2.17 41508.4746 -509000.0 -2.7 -3.4445 -0.9943 3020715 ChemDiv3_000701 CN/C=C\1/C=C(N(C)C1=S)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P20 compound treatment 459321.2996 -58100.0 -0.27 496596.8379 -53600.0 -0.28 -0.3903 -0.9996 3117739 ChemDiv3_000702 COc1ccc(/C=C\2/SC(=S)N(CCC(=O)Nc3ccccc3)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P21 compound treatment 421957.0552 -95500.0 -0.44 461615.7025 -88600.0 -0.47 -0.6434 -0.9995 3020716 ChemDiv3_000703 COc1ccc(OCCSc2ncnc3[nH]cnc23)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P22 compound treatment 418906.0403 -98500.0 -0.45 435921.7391 -114000.0 -0.61 -0.7497 -0.9899 1343334 ChemDiv3_000704 COC(=O)C1=C(C)NC2=C(C1c3ccncc3)C(=O)CC(C)(C)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P23 mock treatment 412754.9669 -105000.0 -0.48 456569.7211 -93600.0 -0.5 -0.6923 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2002 P24 mock treatment 489219.8276 -28200.0 -0.13 464234.7826 -85900.0 -0.46 -0.4142 -0.8739 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A01 compound treatment 542938.8489 20800.0 0.1 417239.7004 -65600.0 -0.35 -0.1781 -0.4937 1487428 ChemDiv3_000705 CCOC(=O)C1=C(CC)NC2=C(C1c3ccc(Cl)cc3)C(=O)CCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A02 compound treatment 489696.2963 -32500.0 -0.15 520451.3274 37700.0 0.2 0.0354 0.1418 1295860 ChemDiv3_000706 Ic1ccc(NC(=O)COc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A03 compound treatment 658306.3063 136000.0 0.63 518516.2791 35700.0 0.19 0.578 0.8812 1077646 ChemDiv3_000707 Clc1ccc2Sc3ccccc3N(CCC#N)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A04 compound treatment 590535.2697 68400.0 0.32 502728.7449 19900.0 0.11 0.2978 0.8952 3117740 ChemDiv3_000708 FC(F)(F)Oc1ccc(cc1)N2C(=O)c3ccccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A05 compound treatment 468360.6557 -53800.0 -0.25 464828.7938 -18000.0 -0.1 -0.2428 -0.9137 3020717 ChemDiv3_000709 NC(=S)N1C(CCN1c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A06 compound treatment 541326.7974 19200.0 0.09 545662.5 62900.0 0.33 0.2983 0.8648 1443291 ChemDiv3_000710 OCCc1ccc(s1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A07 compound treatment 596650.2058 74500.0 0.34 573369.8113 90600.0 0.48 0.5826 0.9865 3117741 ChemDiv3_000711 CCN(N(CC)S(=O)(=O)c1ccc(C)cc1)C2=NS(=O)(=O)c3ccccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A08 compound treatment 539290.1786 17100.0 0.08 534702.5641 51900.0 0.28 0.2506 0.8748 3020718 ChemDiv3_000712 COc1ccccc1/N=C/c2ccsc2S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A09 compound treatment 584759.542 62600.0 0.29 542389.1213 59600.0 0.32 0.4277 0.999 1233664 ChemDiv3_000713 O=C(CCN1C(=O)c2ccccc2C1=O)NCc3ccco3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A10 compound treatment 567606.1776 45500.0 0.21 542980.916 60200.0 0.32 0.3739 0.9792 1914325 ChemDiv3_000714 NC(=N)SCCS(=O)(=O)c1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A11 compound treatment 542578.7037 20400.0 0.09 562790.6977 80000.0 0.42 0.3666 0.8436 1506625 ChemDiv3_000715 COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)c3ccc(OC)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A12 compound treatment 574398.0583 52200.0 0.24 555540.0 72700.0 0.39 0.4432 0.9743 1069326 ChemDiv3_000716 FC(F)(F)c1ccccc1NC(=O)c2ccccc2Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A13 compound treatment 632106.6667 110000.0 0.51 516230.0469 33400.0 0.18 0.4839 0.9009 1446136 ChemDiv3_000717 COc1ccc(NC(=O)C2CSC(C)(C)N2C=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A14 compound treatment 574398.19 52300.0 0.24 523797.4138 41000.0 0.22 0.3241 0.9987 3020719 ChemDiv3_000718 COc1ccc(/C=N/c2nc3ccccc3n2Cc4ccc(Cl)cc4)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A15 compound treatment 568825.0951 46700.0 0.22 478553.6332 -4250.0 -0.02 0.1363 0.6297 1718021 ChemDiv3_000719 COC(=O)c1cc(Cl)c(NC(=S)NC(=O)C(C)(C)C)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A16 compound treatment 539064.257 16900.0 0.08 505545.045 22700.0 0.12 0.1405 0.9777 3117742 ChemDiv3_000720 CN(C)c1ccc(/C=N/c2nc3ccccc3n2Cc4ccc(C)cc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A17 compound treatment 535558.3333 13400.0 0.06 502805.1471 20000.0 0.11 0.1188 0.967 1339224 ChemDiv3_000721 COC(=O)C(Cc1c[nH]c2ccccc12)NS(=O)(=O)c3ccc(Cl)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A18 compound treatment 515829.6296 -6320.0 -0.03 517764.4628 35000.0 0.19 0.1105 0.5888 1054488 ChemDiv3_000722 Cc1cc(C)n(n1)S(=O)(=O)c2ccc(C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A19 compound treatment 567154.8673 45000.0 0.21 569357.4007 86600.0 0.46 0.4714 0.9356 1779183 ChemDiv3_000723 CC(C)COC(=O)CNc1n[nH]c(=O)[nH]c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A20 compound treatment 553037.9747 30900.0 0.14 545980.6202 63200.0 0.34 0.3377 0.9274 3117743 ChemDiv3_000724 CCOc1cc(/C=C/2\Sc3ccccc3C2=O)cc(I)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A21 compound treatment 566592.7273 44400.0 0.2 492062.2407 9260.0 0.05 0.1797 0.8525 1646638 ChemDiv3_000725 COC(=O)C(Cc1ccc(O)cc1)NC(=O)c2ccccc2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A22 compound treatment 568008.0972 45900.0 0.21 500869.0476 18100.0 0.1 0.2173 0.9359 1624682 ChemDiv3_000726 COC(=O)c1ccccc1NC(=O)CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A23 mock treatment 446813.4328 -75300.0 -0.35 444637.3626 -38200.0 -0.2 -0.3888 -0.9669 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 A24 mock treatment 485250.0 -36900.0 -0.17 526364.6617 43600.0 0.23 0.0431 0.1501 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B01 compound treatment 574338.4615 52200.0 0.24 492698.2456 9900.0 0.05 0.2073 0.8416 1725673 ChemDiv3_000727 CCc1ccc(cc1)C2C(=C(C)NC3=C2C(=O)CCC3)C#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B02 compound treatment 619137.3391 97000.0 0.45 532856.5401 50100.0 0.27 0.504 0.969 3117744 ChemDiv3_000728 CN1C(=O)/C(=C\2/SC(=S)N(NC(=O)C)C2=O)/c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B03 compound treatment 628497.4093 106000.0 0.49 553524.7934 70700.0 0.38 0.6121 0.9912 3020720 ChemDiv3_000729 Cc1cccc(c1)C(=O)Oc2ccc(C)c(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B04 compound treatment 483746.0317 -38400.0 -0.18 412194.8052 -70600.0 -0.37 -0.39 -0.9415 1254173 ChemDiv3_000730 Cc1ccccc1OCCn2c(SCc3nc4ccccc4[nH]3)nc5ccccc25 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B05 compound treatment 611383.3333 89200.0 0.41 713289.5928 230000.0 1.22 1.1554 0.8957 3020816 ChemDiv3_000731 C1CCC2CC(OCC2C1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B06 compound treatment 467691.6667 -54500.0 -0.25 442355.4688 -40400.0 -0.21 -0.3293 -0.9969 3117745 ChemDiv3_000732 Cc1ccc(cc1)S(=O)(=O)/N=C(/NC(=S)Nc2ccccc2)\c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B07 compound treatment 642498.0989 120000.0 0.56 548019.9203 65200.0 0.35 0.6371 0.9741 3020817 ChemDiv3_000733 CCN(CC)C(=O)CSc1nnc(o1)c2ccccc2Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B08 compound treatment 542789.2377 20600.0 0.1 503355.6701 20600.0 0.11 0.1444 0.9977 3117746 ChemDiv3_000734 CC(=O)NC(=O)c/1cc2c(ccc3ccccc32)o\c1=N/c4ccc(C)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B09 compound treatment 57638.2979 -465000.0 -2.14 52734.6939 -430000.0 -2.28 -3.1277 -0.9995 1423328 ChemDiv3_000735 OC(CNCc1ccccc1)Cn2c3ccc(Cl)cc3c4cc(Cl)ccc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B10 compound treatment 634485.7143 112000.0 0.52 577754.4643 95000.0 0.5 0.7225 0.9999 1240251 ChemDiv3_000736 Cc1c(Cl)cccc1NC(=O)c2cccnc2Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B11 compound treatment 630261.2613 108000.0 0.5 581038.4615 98200.0 0.52 0.721 0.9998 3020818 ChemDiv3_000737 CCOc1ccc-2c(c1)C(=O)c3cc(OCC)ccc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B12 compound treatment 527448.5597 5300.0 0.02 524397.1292 41600.0 0.22 0.1733 0.7807 1727003 ChemDiv3_000738 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)Nc2ccc3sc(SC)nc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B13 compound treatment 613271.1111 91100.0 0.42 489546.4286 6750.0 0.04 0.3225 0.7646 1740255 ChemDiv3_000739 Cc1ccc(cc1)S(=O)(=O)N2CCN(C2c3ccccc3)C(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B14 compound treatment 633509.7276 111000.0 0.51 638176.9231 155000.0 0.82 0.9459 0.9741 3020819 ChemDiv3_000740 CC1(C)CC(=S)C=C(C1)N2CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B15 compound treatment 571328.8288 49200.0 0.23 490800.0 8000.0 0.04 0.1904 0.8251 1741101 ChemDiv3_000741 Clc1cc2sc(=O)oc2cc1OC(=O)NC3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B16 compound treatment 492728.5714 -29400.0 -0.14 510358.9744 27600.0 0.15 0.0074 0.0372 3117538 ChemDiv3_000742 COc1ccc(OC)c(/N=C/c2cc(I)cc(C)c2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B17 compound treatment 679076.9231 157000.0 0.72 525595.4198 42800.0 0.23 0.6722 0.8863 3117539 ChemDiv3_000743 CCOc1ccc(cc1)N2C(=O)S/C(=C/3\C(=O)Nc4ccccc34)/C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B18 compound treatment 579244.6043 57100.0 0.26 549300.3663 66500.0 0.35 0.4356 0.9896 1455599 ChemDiv3_000744 CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)Nc2ccc(C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B19 compound treatment 525980.0664 3830.0 0.02 477786.8217 -5010.0 -0.03 -0.0063 -0.1974 1507311 ChemDiv3_000745 CC(C)CN(CC(C)C)C(=O)c1cc2ccccc2oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B20 compound treatment 554087.2727 31900.0 0.15 484753.1381 1950.0 0.01 0.1115 0.755 3117540 ChemDiv3_000746 CCN1C(=O)/C(=C/Nc2ccccc2)/OC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B21 compound treatment 451025.4545 -71100.0 -0.33 528869.0476 46100.0 0.24 -0.0591 -0.1446 1429235 ChemDiv3_000747 CCOc1ccc(NC(=O)CCOc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B22 compound treatment 542858.5859 20700.0 0.1 467249.0842 -15500.0 -0.08 0.0092 0.073 1159158 ChemDiv3_000748 O=C1CC(CC(=C1)NCc2ccco2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B23 mock treatment 592334.4828 70200.0 0.32 526166.6667 43400.0 0.23 0.3915 0.986 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 B24 mock treatment 561889.8305 39700.0 0.18 506563.5739 23800.0 0.13 0.2187 0.9833 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C01 compound treatment 544741.3127 22600.0 0.1 485068.0272 2270.0 0.01 0.0822 0.7836 1611722 ChemDiv3_000749 CCOC(=O)C1=C(CC)NC2=C(C1c3ccccc3OCC)C(=O)CCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C02 compound treatment 595852.1739 73700.0 0.34 485855.2036 3060.0 0.02 0.2518 0.74 1332565 ChemDiv3_000750 CCOC(=O)c1ccc(NC(=O)c2ccc(C)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C03 compound treatment 618103.4483 96000.0 0.44 503486.4865 20700.0 0.11 0.3905 0.8565 1451908 ChemDiv3_000751 CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)CCN(C)C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C04 compound treatment 689745.098 168000.0 0.77 586596.2441 104000.0 0.55 0.9358 0.9862 2112223 ChemDiv3_000752 O=c1oc2ccccc2cc1c3cn4c(n3)sc5ccccc54 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C05 compound treatment 669129.4643 147000.0 0.68 555680.8511 72900.0 0.39 0.7526 0.9645 1471012 ChemDiv3_000753 S=C(Nc1ccccc1)N2CCCN2c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C06 compound treatment 530935.1145 8790.0 0.04 557032.6087 74200.0 0.39 0.3071 0.7758 1915139 ChemDiv3_000754 NC(C(=O)O)c1ccc(CCCC(=O)O)s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C07 compound treatment 674301.3699 152000.0 0.7 485819.6078 3020.0 0.02 0.5075 0.7231 1351042 ChemDiv3_000755 O=C(Nc1ccccc1)Nc2ccc3OCOc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C08 compound treatment 505205.3872 -16900.0 -0.08 490913.3858 8110.0 0.04 -0.0248 -0.2782 3020820 ChemDiv3_000756 CN(/C=C\1/C=C(C)SC1=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C09 compound treatment 599319.5021 77200.0 0.36 563645.8333 80800.0 0.43 0.5549 0.9957 3117541 ChemDiv3_000757 Clc1ccc(C(=O)OCCCN2C(=O)c3ccccc3C2=O)c(Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C10 compound treatment 672082.9694 150000.0 0.69 584441.6667 102000.0 0.54 0.8701 0.9924 1673647 ChemDiv3_000758 O=C1CC(OC21CCCCC2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C11 compound treatment 632282.6087 110000.0 0.51 580235.5372 97400.0 0.52 0.7246 1.0 1920609 ChemDiv3_000759 FC(F)(F)c1ccccc1NC(=O)NC2CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C12 compound treatment 577639.4231 55500.0 0.26 542638.8889 59800.0 0.32 0.4054 0.9943 1187258 ChemDiv3_000760 O=C(N(CC#N)CC#N)c1ccc(cc1)C(=O)N(CC#N)CC#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C13 compound treatment 637733.3333 116000.0 0.53 567965.2174 85200.0 0.45 0.6963 0.9966 1351252 ChemDiv3_000761 CC(C)C(=O)Oc1ccc2c(c1)oc(=O)c3ccccc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C14 compound treatment 583322.4299 61200.0 0.28 512772.9258 30000.0 0.16 0.3119 0.9632 3117542 ChemDiv3_000762 Clc1ccc(Cn2c(/N=C/c3ccc4OCOc4c3)nc5ccccc25)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C15 compound treatment 575227.0916 53100.0 0.24 469662.3377 -13100.0 -0.07 0.1238 0.4865 1648199 ChemDiv3_000763 Nc1c(C#N)c2nc3ccccc3nc2n1c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C16 compound treatment 634871.4286 113000.0 0.52 558424.2424 75600.0 0.4 0.6512 0.9918 3117543 ChemDiv3_000764 Cc1ccc(Cn2c(/N=C/c3ccc(Br)cc3)nc4ccccc24)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C17 compound treatment 568360.4651 46200.0 0.21 468847.0149 -14000.0 -0.07 0.0984 0.436 3020844 ChemDiv3_000765 CN(Cc1ccccc1)C(=O)c2ccc(C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C18 compound treatment 528659.5745 6510.0 0.03 509330.5439 26500.0 0.14 0.1207 0.8391 1586578 ChemDiv3_000766 Brc1ccc(cc1)C(=O)COC(=O)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C19 compound treatment 578786.7299 56600.0 0.26 539372.6937 56600.0 0.3 0.3969 0.9976 1919025 ChemDiv3_000767 FC(F)(F)c1cccc(NC(=O)COc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C20 compound treatment 478776.9231 -43400.0 -0.2 390606.8966 -92200.0 -0.49 -0.4872 -0.9222 3020845 ChemDiv3_000768 NNC(=O)c1ccc(/C=N\O)nc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C21 compound treatment 465135.4167 -57000.0 -0.26 472129.9213 -10700.0 -0.06 -0.2259 -0.8401 3020846 ChemDiv3_000769 Brc1ccc(NC(=O)/C=C/c2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C22 compound treatment 616063.3484 93900.0 0.43 603713.0045 121000.0 0.64 0.7597 0.9817 1510082 ChemDiv3_000770 OC(=O)CCC(=O)NCc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C23 mock treatment 525568.4647 3420.0 0.02 509069.2308 26300.0 0.14 0.1097 0.7822 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 C24 mock treatment 538854.1033 16700.0 0.08 437039.1459 -45800.0 -0.24 -0.1171 -0.46 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D01 compound treatment 520237.1542 -1910.0 -0.01 441714.2857 -41100.0 -0.22 -0.1603 -0.7351 1123230 ChemDiv3_000771 Oc1ccccc1N2C(=O)C3CC=CCC3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D02 compound treatment 605334.9282 83200.0 0.38 577147.0588 94300.0 0.5 0.6251 0.9914 1485584 ChemDiv3_000772 CCN(CC)c1ccc(NC(=O)C(C)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D03 compound treatment 563088.1356 40900.0 0.19 528291.3043 45500.0 0.24 0.3041 0.9926 3020847 ChemDiv3_000773 O=C(NN1C(=O)CSC1=S)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D04 compound treatment 764085.0 242000.0 1.12 580873.1707 98100.0 0.52 1.1568 0.9397 3117544 ChemDiv3_000774 C(CSc1nc2ccccc2[nH]1)CN3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D05 compound treatment 627233.3333 105000.0 0.48 524652.5097 41900.0 0.22 0.4996 0.9374 1778456 ChemDiv3_000775 OC(=O)CC(Sc1nc2sc3CCCCc3c2c(=O)[nH]1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D06 compound treatment 538599.278 16500.0 0.08 599602.459 117000.0 0.62 0.4917 0.7878 3020848 ChemDiv3_000776 FC(F)(F)c1cccc(NC(=O)c2ccc3ccccc3c2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D07 compound treatment 601889.8305 79700.0 0.37 504064.6259 21300.0 0.11 0.3398 0.8834 3020849 ChemDiv3_000777 Cc1sc(Nc2ccccc2F)nc1c3ccc(C)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D08 compound treatment 565846.8468 43700.0 0.2 660860.5769 178000.0 0.94 0.8103 0.8391 1364991 ChemDiv3_000778 Brc1cccc(c1)c2nnc(o2)c3cc4ccccc4oc3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D09 compound treatment 474366.7954 -47800.0 -0.22 555690.1408 72900.0 0.39 0.1176 0.2642 3117545 ChemDiv3_000779 CCOC(=O)c1c(/N=c/2\oc3ccc4ccccc4c3cc2C(=O)N)sc5CCCCc15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D10 compound treatment 532924.2424 10800.0 0.05 589719.8582 107000.0 0.57 0.4361 0.7661 1665286 ChemDiv3_000780 CN1CCN(CC1)NC(=O)c2ccc(cc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D11 compound treatment 612120.3704 90000.0 0.41 657343.4783 175000.0 0.93 0.948 0.9345 1652224 ChemDiv3_000781 COC(=O)COc1ccc-2c(c1)C(=NO)c3cc(OCC(=O)OC)ccc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D12 compound treatment 595506.4378 73400.0 0.34 505354.8387 22600.0 0.12 0.3238 0.9024 1235358 ChemDiv3_000782 CCC1Nc2ccccc2-c3nnc(SC)nc3O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D13 compound treatment 314868.4211 -207000.0 -0.96 277292.6829 -206000.0 -1.09 -1.4467 -0.9979 1443634 ChemDiv3_000783 OC(=O)C1C2CC=CC2c3cc(Cl)cc4C5C=CCC5CN1c43 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D14 compound treatment 539794.1176 17600.0 0.08 462811.8081 -20000.0 -0.11 -0.0174 -0.1303 3020850 ChemDiv3_000784 Fc1cccc(c1)C2=N/C(=C\c3cccc4ccccc34)/C(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D15 compound treatment 603345.679 81200.0 0.37 426678.5714 -56100.0 -0.3 0.0543 0.1135 1569541 ChemDiv3_000785 CCOC(=O)c1cnn(c1N(C(=O)c2ccccc2F)C(=O)c3ccccc3F)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D16 compound treatment 571646.0905 49500.0 0.23 436209.4017 -46600.0 -0.25 -0.0133 -0.0396 3020851 ChemDiv3_000786 CC(=O)Nc1cccc(/N=C/c2cc(I)cc(C)c2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D17 compound treatment 558755.0336 36600.0 0.17 473450.8197 -9350.0 -0.05 0.0843 0.4792 1355069 ChemDiv3_000787 CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D18 compound treatment 467038.6473 -55100.0 -0.25 360396.3415 -122000.0 -0.65 -0.6388 -0.9162 1626307 ChemDiv3_000788 CC(C)c1cc(C(C)C)c(c(c1)C(C)C)S(=O)(=O)NCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D19 compound treatment 455974.0741 -66200.0 -0.31 468605.5046 -14200.0 -0.08 -0.269 -0.8559 3117546 ChemDiv3_000789 Cc1cc(C)c(C(=O)NCC=C)c(C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D20 compound treatment 457828.2828 -64300.0 -0.3 423836.1775 -59000.0 -0.31 -0.4309 -0.9997 3117547 ChemDiv3_000790 CCN1/C(=C\2/C(=NN(C2=O)c3ccccc3)C)/C=Cc4ccccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D21 compound treatment 529962.1212 7810.0 0.04 454167.2131 -28600.0 -0.15 -0.0819 -0.5247 1388884 ChemDiv3_000791 O=C(CCOc1ccccc1)NCc2ccco2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D22 compound treatment 448874.5763 -73300.0 -0.34 476594.7955 -6200.0 -0.03 -0.2622 -0.7723 3117548 ChemDiv3_000792 COc1ccccc1/C=C/2\SC(=O)N(CCC(=O)N3c4ccccc4Sc5ccccc35)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D23 mock treatment 506352.7397 -15800.0 -0.07 432884.984 -49900.0 -0.26 -0.2387 -0.8694 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 D24 mock treatment 479085.5856 -43100.0 -0.2 438298.3051 -44500.0 -0.24 -0.3073 -0.9963 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E01 compound treatment 557492.891 35300.0 0.16 523603.6866 40800.0 0.22 0.2683 0.9902 1583492 ChemDiv3_000793 COC(=O)C1=C(C)NC2=C(C1c3ccc(cc3)N(C)C)C(=O)CC(C2)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E02 compound treatment 612064.8148 89900.0 0.41 513007.6923 30200.0 0.16 0.4065 0.9144 1432876 ChemDiv3_000794 CCc1ccc(OCC(=O)Nc2ccc(OC)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E03 compound treatment 288419.3548 -234000.0 -1.08 211847.4576 -271000.0 -1.44 -1.7784 -0.99 3117549 ChemDiv3_000795 COc1cccc(/C=C/C(=O)C2C(=O)c3ccccc3C2=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E04 compound treatment 431893.4426 -90300.0 -0.42 314894.7368 -168000.0 -0.89 -0.924 -0.94 1606983 ChemDiv3_000796 Oc1cccc(NC(=O)c2c(O)c3ccccc3n(CC=C)c2=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E05 compound treatment 705176.7241 183000.0 0.84 533501.8182 50700.0 0.27 0.787 0.8884 1715553 ChemDiv3_000797 Cc1[nH]c2ccc(CN3C(=O)c4ccccc4C3=O)cc2c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E06 compound treatment 475529.8013 -46600.0 -0.21 544071.1111 61300.0 0.32 0.0778 0.1996 3020853 ChemDiv3_000798 COC(=O)c1cc(N)c(Cl)s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E07 compound treatment 509269.7674 -12900.0 -0.06 448246.4286 -34600.0 -0.18 -0.1716 -0.8907 1915335 ChemDiv3_000799 FC(F)(F)c1cccc(NC(=O)Nc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E08 compound treatment 561382.4885 39200.0 0.18 409708.5427 -73100.0 -0.39 -0.1462 -0.3417 1289585 ChemDiv3_000800 CC1(OC(=O)C2C1C3CCCCC3=C4CCCCC24)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E09 compound treatment 526222.9965 4070.0 0.02 571259.6899 88500.0 0.47 0.3451 0.7348 1304126 ChemDiv3_000801 O=C(N1CC(=O)Nc2ccccc12)c3ccco3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E10 compound treatment 576680.8511 54500.0 0.25 582810.2767 100000.0 0.53 0.5529 0.9419 1265761 ChemDiv3_000802 COc1cc(nc(OC)n1)N2C(=O)c3ccccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E11 compound treatment 618603.9604 96500.0 0.44 564405.0179 81600.0 0.43 0.6206 0.9999 1735414 ChemDiv3_000803 COC(=O)c1ccc(OC(=O)CCN2C(=O)c3ccccc3C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E12 compound treatment 612663.4146 90500.0 0.42 465721.3115 -17100.0 -0.09 0.2311 0.5411 3020873 ChemDiv3_000804 CN(c1ccccc1)S(=O)(=O)c2c(C)cc(C)cc2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E13 compound treatment 570521.5311 48400.0 0.22 503296.6102 20500.0 0.11 0.2346 0.9454 1517748 ChemDiv3_000805 CN(C1CCCCC1)C(=O)COc2ccc(Cl)c(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E14 compound treatment 439232.3651 -82900.0 -0.38 448427.1845 -34400.0 -0.18 -0.3993 -0.9426 1467248 ChemDiv3_000806 Cc1nc2n(Cc3ccccc3)c4ccccc4n2c1C(=S)Nc5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E15 compound treatment 544011.583 21900.0 0.1 470785.4545 -12000.0 -0.06 0.0262 0.22 1918958 ChemDiv3_000807 Clc1cccc(CC2SC(=N)NC2=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E16 compound treatment 609241.7062 87100.0 0.4 436923.588 -45900.0 -0.24 0.112 0.2384 3020874 ChemDiv3_000808 CC(/N=C/c1nc2ccccc2n1C)C3(CC4CC5CC(C4)C3)C5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E17 compound treatment 488000.0 -34100.0 -0.16 386833.3333 -96000.0 -0.51 -0.4713 -0.8845 3117550 ChemDiv3_000809 Cc1ccc(cc1)C(=O)Nc2cccc(c2)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E18 compound treatment 610807.1749 88700.0 0.41 480920.0 -1880.0 -0.01 0.2821 0.6897 3117551 ChemDiv3_000810 COc1ccc(O)c(/C=N/CC(C)\N=C\c2cc(OC)ccc2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E19 compound treatment 465882.1429 -56300.0 -0.26 433840.678 -49000.0 -0.26 -0.3671 -1.0 1413824 ChemDiv3_000811 COC(=O)c1ccccc1NC(=O)COc2ccc(OC)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E20 compound treatment 494958.3333 -27200.0 -0.13 572396.9072 89600.0 0.48 0.2474 0.5033 1629872 ChemDiv3_000812 COc1ccccc1C(=O)Nc2ccc3oc(nc3c2)c4ccc5ccccc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E21 compound treatment 510336.7698 -11800.0 -0.05 451860.1399 -30900.0 -0.16 -0.1546 -0.8939 1625558 ChemDiv3_000813 COC(=O)c1cccc(NC(=O)c2ccccc2C(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E22 compound treatment 572342.2053 50200.0 0.23 593283.5249 110000.0 0.59 0.578 0.9174 1326899 ChemDiv3_000814 COc1ccccc1N2CCN(CC2)C(=O)CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E23 mock treatment 579457.7465 57300.0 0.26 457306.8966 -25500.0 -0.14 0.0913 0.3075 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 E24 mock treatment 597026.3158 74900.0 0.35 534995.3052 52200.0 0.28 0.4399 0.994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F01 compound treatment 545612.2449 23500.0 0.11 598738.9381 116000.0 0.61 0.5113 0.819 1373507 ChemDiv3_000815 OC(=O)C1CC=CCC1C(=O)Nc2ccc(Cc3ccncc3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F02 compound treatment 639020.6186 117000.0 0.54 631144.7368 148000.0 0.79 0.9375 0.983 3020875 ChemDiv3_000816 O=C(NC1CCCC1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F03 compound treatment 490424.812 -31700.0 -0.15 507047.2727 24200.0 0.13 -0.0125 -0.0642 1442394 ChemDiv3_000817 O=C(NCCc1ccccc1)c2ccccc2CN3C(=O)c4ccccc4C3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F04 compound treatment 561863.354 39700.0 0.18 558705.2023 75900.0 0.4 0.4142 0.9364 3020876 ChemDiv3_000818 FC(F)(F)c1nc2ccccc2n1CCOc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F05 compound treatment 606333.3333 84200.0 0.39 688480.9524 206000.0 1.09 1.0459 0.9033 3117552 ChemDiv3_000819 O=C(N/C(=C/c1ccccc1)/S(=O)(=O)c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F06 compound treatment 661754.386 140000.0 0.64 531022.9008 48200.0 0.26 0.6361 0.9182 3020877 ChemDiv3_000820 CCOc1ccc(cc1Br)C(=O)Nc2cccc(NC(=O)c3ccccc3)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F07 compound treatment 588348.2143 66200.0 0.31 539916.3498 57100.0 0.3 0.4301 1.0 3117553 ChemDiv3_000821 O=C(Nc1ccccc1)c2cnc[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F08 compound treatment 417329.8611 -105000.0 -0.48 393728.3019 -89100.0 -0.47 -0.6759 -0.9999 1673072 ChemDiv3_000822 OC(C(=O)Nc1cc(Cl)ccc1Cl)(c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F09 compound treatment 424340.1015 -97800.0 -0.45 423694.0639 -59100.0 -0.31 -0.5406 -0.9842 3020878 ChemDiv3_000823 CCN(CC)c1ccc2cc(C(=O)N)/c(=N/c3cccc(C)c3)/oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F10 compound treatment 601595.5556 79400.0 0.37 565469.5652 82700.0 0.44 0.5691 0.996 3117554 ChemDiv3_000824 Fc1ccc(NC(=O)c2cnccn2)c(F)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F11 compound treatment 583165.2542 61000.0 0.28 503756.5789 21000.0 0.11 0.2776 0.9174 1470949 ChemDiv3_000825 COc1ccc(cc1)c2ccc(OC)cc2C(=O)NN 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F12 compound treatment 472182.8358 -50000.0 -0.23 465311.284 -17500.0 -0.09 -0.2285 -0.92 1687536 ChemDiv3_000826 CCN(CC)S(=O)(=O)c1ccc(Cl)c(c1)C(=O)Oc2ccc(C)cc2n3nc4ccccc4n3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F13 compound treatment 396015.1515 -126000.0 -0.58 340221.2766 -143000.0 -0.76 -0.946 -0.9916 1365314 ChemDiv3_000827 Clc1ccc2NC(C3CC=CC3c2c1)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F14 compound treatment 450059.3607 -72100.0 -0.33 451983.1933 -30800.0 -0.16 -0.3506 -0.9465 1517186 ChemDiv3_000828 Cc1cccc(c1)C(=O)Nc2ccc(NC(=O)c3ccco3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F15 compound treatment 414786.0465 -107000.0 -0.5 386422.8188 -96400.0 -0.51 -0.7116 -0.9999 1513840 ChemDiv3_000829 COC(=O)C1=C(C)N(C(=C(C1c2ccccc2)C(=O)OC)C)c3ccc(OC)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F16 compound treatment 436591.5493 -85600.0 -0.39 390169.3122 -92600.0 -0.49 -0.6264 -0.9941 3117555 ChemDiv3_000830 COc1cccc(/C=C\2/C(=O)NN(C2=O)c3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F17 compound treatment 507896.5517 -14300.0 -0.07 486818.8976 4020.0 0.02 -0.0314 -0.4544 3020879 ChemDiv3_000831 CS(=O)(=O)NCCc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F18 compound treatment 644680.6723 123000.0 0.57 503880.7692 21100.0 0.11 0.4786 0.8309 1468720 ChemDiv3_000832 OC(=O)c1ccccc1C(=O)NC=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F19 compound treatment 568247.191 46100.0 0.21 439176.6667 -43600.0 -0.23 -0.0133 -0.0423 3117556 ChemDiv3_000833 CC(C)c1ccc(/C=C/C(=O)NCC=C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F20 compound treatment 506864.5418 -15300.0 -0.07 478164.8352 -4630.0 -0.02 -0.0672 -0.9005 3117557 ChemDiv3_000834 CC(C)CNC=C1C(=O)CC(C)(C)CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F21 compound treatment 576723.6181 54600.0 0.25 410931.3305 -71900.0 -0.38 -0.0916 -0.2005 1393505 ChemDiv3_000835 Cc1cc(C)cc(NC(=O)c2cc3ccccc3o2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F22 compound treatment 507877.7778 -14300.0 -0.07 420653.2508 -62100.0 -0.33 -0.2796 -0.8319 3117558 ChemDiv3_000836 CN1CCN(CC1)C(=O)CCN2C(=O)/C(=C/c3ccc(Cl)cc3)/SC2=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F23 mock treatment 496925.0936 -25200.0 -0.12 546470.5882 63700.0 0.34 0.1565 0.4383 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 F24 mock treatment 510717.9487 -11400.0 -0.05 477439.8625 -5360.0 -0.03 -0.0574 -0.958 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G01 compound treatment 492624.031 -29500.0 -0.14 506205.2239 23400.0 0.12 -0.0085 -0.0461 1690924 ChemDiv3_000837 COC(=O)C1=C(C)NC2=C(C1c3ccccc3)C(=O)CCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G02 compound treatment 528879.3774 6730.0 0.03 470189.6552 -12600.0 -0.07 -0.0253 -0.3437 1254482 ChemDiv3_000838 Cc1ccc(OCC(=O)NCc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G03 compound treatment 496797.5709 -25400.0 -0.12 455775.5102 -27000.0 -0.14 -0.184 -0.9949 1006818 ChemDiv3_000839 OC(=O)CCCC(=O)c1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G04 compound treatment 528099.5475 5950.0 0.03 356124.2236 -127000.0 -0.67 -0.4557 -0.6777 3117559 ChemDiv3_000840 CC(C)(C)c1ccc(cc1)C(=O)N2CCCc3ccccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G05 compound treatment 423996.139 -98200.0 -0.45 363605.1661 -119000.0 -0.63 -0.7671 -0.9866 1344674 ChemDiv3_000841 Clc1ccccc1C(=O)c2ccc3OCCOc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G06 compound treatment 452452.5547 -69700.0 -0.32 527180.7229 44400.0 0.24 -0.0608 -0.1527 1914993 ChemDiv3_000842 COC(=O)CCC(=O)c1cc(sc1C(C)(C)C)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G07 compound treatment 452243.2432 -69900.0 -0.32 469737.2881 -13100.0 -0.07 -0.2769 -0.8399 1342176 ChemDiv3_000843 CC1CCN(Cn2c(=S)oc3ccccc23)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G08 compound treatment 438120.7547 -84000.0 -0.39 429391.0035 -53400.0 -0.28 -0.4743 -0.9881 1917056 ChemDiv3_000844 FC(F)(F)COc1nc(nc(n1)N2CCCCC2)N(c3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G09 compound treatment 601835.9788 79700.0 0.37 497574.8503 14800.0 0.08 0.3153 0.839 1584064 ChemDiv3_000845 Cc1ccccc1OCC(=O)NC(c2ccccc2)c3c(O)ccc4ccccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G10 compound treatment 450840.4669 -71300.0 -0.33 463682.6087 -19100.0 -0.1 -0.3042 -0.8841 1318907 ChemDiv3_000846 CCCc1nc(N)c(C#N)c(c1CC)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G11 compound treatment 408202.4922 -114000.0 -0.53 440366.6667 -42400.0 -0.23 -0.5307 -0.9284 1607665 ChemDiv3_000847 O=C(NCCc1ccccc1)c2cc3ccccc3oc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G12 compound treatment 378592.5926 -144000.0 -0.66 388203.6364 -94600.0 -0.5 -0.8229 -0.9906 1316192 ChemDiv3_000848 CCN(Cc1ccccc1)S(=O)(=O)c2cc(Cl)ccc2Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G13 compound treatment 358230.2158 -164000.0 -0.76 358669.7819 -124000.0 -0.66 -1.0001 -0.9976 3117560 ChemDiv3_000849 Clc1ccc(/C=C/C(=O)Nc2nccs2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G14 compound treatment 454721.5686 -67400.0 -0.31 460242.9022 -22600.0 -0.12 -0.3045 -0.9139 1342653 ChemDiv3_000850 Clc1ccc2[nH]c(nc2c1)N3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G15 compound treatment 433181.1321 -89000.0 -0.41 418083.3333 -64700.0 -0.34 -0.5328 -0.9961 1360061 ChemDiv3_000851 CCOc1ccccc1C(=O)Nc2cccc(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G16 compound treatment 495137.037 -27000.0 -0.12 442106.1224 -40700.0 -0.22 -0.2407 -0.9659 1160846 ChemDiv3_000852 CC1CN(CC(C)O1)S(=O)(=O)c2ccc(NC(=O)C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G17 compound treatment 516016.5289 -6130.0 -0.03 442558.5938 -40200.0 -0.21 -0.1709 -0.7939 3020907 ChemDiv3_000853 Cc1ccc(NC(=O)c2ccc(F)cc2)c(C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G18 compound treatment 451514.3885 -70600.0 -0.33 507148.2759 24300.0 0.13 -0.139 -0.3967 1569529 ChemDiv3_000854 Cc1ccc(NC(=O)c2nc[nH]c2C(=O)N3CCCCC3)c(c1)C(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G19 compound treatment 575267.7966 53100.0 0.24 548742.7536 65900.0 0.35 0.4205 0.9848 1657157 ChemDiv3_000855 CC(C)(C)C(=O)NC(c1ccccc1)c2c(O)ccc3ccccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G20 compound treatment 439796.2085 -82400.0 -0.38 435042.6829 -47800.0 -0.25 -0.4477 -0.9806 1709867 ChemDiv3_000856 COc1cccc(c1)C(=O)Nc2ccc3oc(nc3c2)c4cccc(I)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G21 compound treatment 502329.5019 -19800.0 -0.09 471907.2581 -10900.0 -0.06 -0.1055 -0.9755 1083894 ChemDiv3_000857 Clc1ccc(cc1)C(=O)NCCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G22 compound treatment 588794.6768 66600.0 0.31 473383.6735 -9420.0 -0.05 0.182 0.5845 3117561 ChemDiv3_000858 COc1cccc(c1)C(C(F)(F)F)P(=O)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G23 mock treatment 483047.4138 -39100.0 -0.18 480785.124 -2010.0 -0.01 -0.1351 -0.7477 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 G24 mock treatment 489957.9832 -32200.0 -0.15 457683.7945 -25100.0 -0.13 -0.1992 -0.9985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H01 compound treatment 546037.5587 23900.0 0.11 557266.9683 74500.0 0.39 0.3572 0.8711 1366343 ChemDiv3_000859 CC(=O)N(CN1C(=O)C2CC=CCC2C1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H02 compound treatment 655137.7551 133000.0 0.61 511113.8614 28300.0 0.15 0.5399 0.855 1584378 ChemDiv3_000860 CCOC(=O)Cc1csc(NC(=O)c2ccccc2)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H03 compound treatment 541185.6061 19000.0 0.09 475084.8708 -7710.0 -0.04 0.0331 0.3422 3117562 ChemDiv3_000861 CC(C)c1ccc(C)cc1OCC(=O)/C=C/2\Sc3ccccc3N2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H04 compound treatment 682804.878 161000.0 0.74 548918.1034 66100.0 0.35 0.7719 0.9416 1622162 ChemDiv3_000862 Cc1ccccc1C(=O)Nc2ccc(NC(=O)c3ccc(cc3)C(C)(C)C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H05 compound treatment 446066.2252 -76100.0 -0.35 177285.7143 -306000.0 -1.62 -1.3939 -0.8407 3117563 ChemDiv3_000863 Cc1ccc(cc1)S(=O)(=O)NN2C(=O)S/C(=C/c3ccccc3)/C2=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H06 compound treatment 495989.9497 -26200.0 -0.12 422897.9592 -59900.0 -0.32 -0.31 -0.9121 3020908 ChemDiv3_000864 CSc1ccc(/C=C\2/SC(=O)N(CNc3ccccc3)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H07 compound treatment 382312.1019 -140000.0 -0.64 213360.0 -269000.0 -1.43 -1.4665 -0.9354 1912608 ChemDiv3_000865 Oc1ccc(/N=C/c2c[nH]c3ccccc23)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H08 compound treatment 508757.9365 -13400.0 -0.06 445685.0394 -37100.0 -0.2 -0.1829 -0.8863 1623791 ChemDiv3_000866 Cc1ccc(NC(=O)c2ccc(cc2)c3ccccc3)nc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H09 compound treatment 475390.1515 -46800.0 -0.22 475093.2203 -7710.0 -0.04 -0.1814 -0.8264 3117564 ChemDiv3_000867 COc1cccc2cc(c3csc(Nc4cccc(c4)C(F)(F)F)n3)c(=O)oc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H10 compound treatment 354766.9173 -167000.0 -0.77 370317.0732 -112000.0 -0.6 -0.9677 -0.9919 3020909 ChemDiv3_000868 CC(C)(C)c1ccc(cc1)C(=O)Nc2cccc(c2)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H11 compound treatment 502839.8268 -19300.0 -0.09 474618.4211 -8180.0 -0.04 -0.0936 -0.9454 1919894 ChemDiv3_000869 CCS(=O)(=O)C(=C(Nc1ccccc1)Nc2ccccc2)S(=O)(=O)CC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H12 compound treatment 427604.5016 -94500.0 -0.44 473588.4477 -9210.0 -0.05 -0.3428 -0.7814 1361150 ChemDiv3_000870 COC(=O)C(C(C)C)N1C(=O)C2C3CC(C=C3)C2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H13 compound treatment 471009.901 -51100.0 -0.24 488070.4846 5270.0 0.03 -0.147 -0.6189 1526618 ChemDiv3_000871 Cc1c(Cl)cccc1NC(=O)c2ccc(cc2)N3C(=O)c4ccccc4C3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H14 compound treatment 462031.9149 -60100.0 -0.28 398023.9234 -84800.0 -0.45 -0.514 -0.973 3118161 ChemDiv3_000872 O=C(Nc1ccc(cc1)c2nc3c(ccc4ccccc34)o2)c5ccco5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H15 compound treatment 424017.3611 -98100.0 -0.45 411845.6592 -71000.0 -0.38 -0.5861 -0.9958 1157871 ChemDiv3_000873 O=C(COc1ccc2c(cc(=O)oc2c1)c3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H16 compound treatment 423219.5122 -98900.0 -0.46 413681.8182 -69100.0 -0.37 -0.5818 -0.9941 3118162 ChemDiv3_000874 Nc1nnnn1/N=C\c2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H17 compound treatment 469212.963 -52900.0 -0.24 503451.9573 20700.0 0.11 -0.0952 -0.3556 1288630 ChemDiv3_000875 CCOC(=O)c1ccccc1NS(=O)(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H18 compound treatment 431132.9305 -91000.0 -0.42 409458.042 -73300.0 -0.39 -0.5719 -0.9993 1696480 ChemDiv3_000876 Cc1ccc(NCC(O)Cn2c3ccccc3c4ccccc24)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H19 compound treatment 379780.4878 -142000.0 -0.66 417497.9079 -65300.0 -0.35 -0.7092 -0.9553 1434081 ChemDiv3_000877 CC(C)c1ccc(OCC(=O)NCC=C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H20 compound treatment 417476.1905 -105000.0 -0.48 470337.1212 -12500.0 -0.07 -0.3881 -0.7965 3020910 ChemDiv3_000878 CC1(C)CC(=O)C(=CNCc2ccco2)C(=O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H21 compound treatment 535940.7115 13800.0 0.06 407951.7241 -74800.0 -0.4 -0.2357 -0.5863 1350794 ChemDiv3_000879 COc1ccc(OC(=O)c2cc3ccccc3o2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H22 compound treatment 452980.6202 -69200.0 -0.32 430926.2295 -51900.0 -0.28 -0.4201 -0.9973 3020911 ChemDiv3_000880 O=c1[nH]nc(N2CCOCC2)c(=O)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H23 mock treatment 486701.4218 -35400.0 -0.16 422329.8611 -60500.0 -0.32 -0.3424 -0.9511 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 H24 mock treatment 446625.4826 -75500.0 -0.35 491029.0456 8230.0 0.04 -0.2154 -0.6137 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I01 compound treatment 490211.7117 -31900.0 -0.15 432226.7206 -50600.0 -0.27 -0.2938 -0.9601 1682167 ChemDiv3_000881 CCOC(=O)C1=C(NC(=O)NC1c2ccc(OC)cc2)c3ccc(OC)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I02 compound treatment 557787.8788 35600.0 0.16 464559.4714 -18200.0 -0.1 0.0478 0.2507 3020912 ChemDiv3_000882 C1CN(CCO1)c2ccc(C=Nn3cncn3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I03 compound treatment 543244.6352 21100.0 0.1 532817.3913 50000.0 0.27 0.2564 0.9073 1588286 ChemDiv3_000883 CCOc1ccccc1N2C(=O)C3C(C(C=CC3c4ccccc4)c5ccccc5)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I04 compound treatment 601081.7308 78900.0 0.36 592470.339 110000.0 0.58 0.6687 0.9745 3118163 ChemDiv3_000884 Cc1ccc(C)c(c1)S(=O)(=O)NCCCn2ccnc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I05 compound treatment 575984.0 53800.0 0.25 623638.4977 141000.0 0.75 0.7038 0.894 1319250 ChemDiv3_000885 O=C(Nc1ccc2-c3ccc(NC(=O)C4CCCCC4)cc3S(=O)(=O)c2c1)C5CCCCC5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I06 compound treatment 631844.697 110000.0 0.51 534423.0769 51600.0 0.27 0.5513 0.9584 3020913 ChemDiv3_000886 CC1NC(=O)NC1CCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I07 compound treatment 546973.7828 24800.0 0.11 470020.9205 -12800.0 -0.07 0.033 0.2483 1370690 ChemDiv3_000887 CCC1CCCCN1C(=O)CN2C(=O)c3ccccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I08 compound treatment 587041.5094 64900.0 0.3 559031.9149 76200.0 0.4 0.4975 0.989 3020914 ChemDiv3_000888 CCC1(CC)Cc2ccccc2/C(=N/c3c(C)n(C)n(c4ccccc4)c3=O)/N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I09 compound treatment 458227.4368 -63900.0 -0.29 489431.6547 6630.0 0.04 -0.1836 -0.6183 3118164 ChemDiv3_000889 CC(C)CC(N1C(=O)c2ccccc2C1=O)C(=O)Nc3cccc(c3)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I10 compound treatment 517825.0 -4320.0 -0.02 576923.9544 94100.0 0.5 0.3389 0.6783 3118165 ChemDiv3_000890 COc1ccc(Cl)cc1NC(=O)c2nc3nc(cc(n3n2)C(F)(F)F)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I11 compound treatment 494125.6281 -28000.0 -0.13 537013.0293 54200.0 0.29 0.112 0.3551 1696086 ChemDiv3_000891 CCc1ccc(OCC(=O)N)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I12 compound treatment 482030.7692 -40100.0 -0.19 501711.3402 18900.0 0.1 -0.0599 -0.2846 1643226 ChemDiv3_000892 OC(=O)CP(=O)(O)c1ccc(Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I13 compound treatment 459200.0 -62900.0 -0.29 453209.3023 -29600.0 -0.16 -0.3162 -0.9583 3118166 ChemDiv3_000893 Clc1ccccc1/C=C/C(=O)N2CCCCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I14 compound treatment 461709.3023 -60400.0 -0.28 453542.5101 -29300.0 -0.16 -0.3068 -0.9618 3020915 ChemDiv3_000894 COc1ccccc1/C=N\c2ccc3n(Cc4ccccc4)c(C)nc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I15 compound treatment 440223.3677 -81900.0 -0.38 537695.7831 54900.0 0.29 -0.0613 -0.1284 1438926 ChemDiv3_000895 COC(=O)c1ccccc1NC(=O)c2ccccc2Br 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I16 compound treatment 547945.3782 25800.0 0.12 547547.7032 64700.0 0.34 0.327 0.8996 1126074 ChemDiv3_000896 O=S(=O)(Cc1ccccc1)Nc2cccnc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I17 compound treatment 443459.0747 -78700.0 -0.36 440996.1832 -41800.0 -0.22 -0.4134 -0.9721 3118167 ChemDiv3_000897 Clc1ccc(/C=C/C(=O)NCc2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I18 compound treatment 417327.5109 -105000.0 -0.48 324038.4615 -159000.0 -0.84 -0.9372 -0.9653 3118168 ChemDiv3_000898 O=C1CS/C(=N\c2ccccc2)/N1Cc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I19 compound treatment 568867.7686 46700.0 0.22 513344.8276 30500.0 0.16 0.2669 0.9901 1496753 ChemDiv3_000899 CC(=O)n1cc(c2ccncc2)c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I20 compound treatment 547154.717 25000.0 0.12 573403.5088 90600.0 0.48 0.4214 0.8526 3118169 ChemDiv3_000900 CC(=O)NC(=O)c/1cc2ccccc2o\c1=N/c3ccc(Cl)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I21 compound treatment 519768.0 -2380.0 -0.01 499294.1176 16500.0 0.09 0.0541 0.6136 1085397 ChemDiv3_000901 Clc1ccccc1NC(=O)COc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I22 compound treatment 481048.0349 -41100.0 -0.19 483068.4932 270.0 0.0 -0.133 -0.7018 3020938 ChemDiv3_000902 CP(=O)(O)C(c1cccc(Cl)c1)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I23 mock treatment 504764.7059 -17400.0 -0.08 488581.6733 5780.0 0.03 -0.035 -0.4077 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 I24 mock treatment 563262.4434 41100.0 0.19 495876.652 13100.0 0.07 0.1831 0.907 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J01 compound treatment 250134.1463 -272000.0 -1.25 177345.2381 -305000.0 -1.62 -2.0326 -0.992 3118170 ChemDiv3_000903 O=C1NC(=O)/C(=C\c2c3ccccc3cc4ccccc24)/C(=O)N1c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J02 compound treatment 578142.8571 56000.0 0.26 509235.2941 26400.0 0.14 0.2817 0.9588 1538193 ChemDiv3_000904 Cc1cccc(Nc2nc(C)cc(C)c2C#N)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J03 compound treatment 580616.3793 58500.0 0.27 507160.0 24400.0 0.13 0.282 0.9432 3020939 ChemDiv3_000905 CC(C)C(=O)/C=C\1/Sc2ccccc2N1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J04 compound treatment 777343.75 255000.0 1.18 606084.1121 123000.0 0.65 1.2946 0.9615 1399642 ChemDiv3_000906 CC(C)(C#CC(O)(c1ccccc1)c2ccccc2)N3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J05 compound treatment 469253.5714 -52900.0 -0.24 402556.3636 -80200.0 -0.43 -0.4734 -0.9651 3118171 ChemDiv3_000907 Clc1ccc(/C=C\2/SC(=O)N(NC(=O)c3ccccc3Cl)C2=S)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J06 compound treatment 613696.2617 91500.0 0.42 553964.7577 71200.0 0.38 0.5654 0.9984 1545446 ChemDiv3_000908 OC(=O)c1ccccc1n2c(=O)c3cc4c(=O)n(c5ccccc5C(=O)O)c(=O)c4cc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J07 compound treatment 586748.8152 64600.0 0.3 651693.5484 169000.0 0.9 0.8441 0.8941 1642929 ChemDiv3_000909 C(N1CCN(Cc2ccccc2)C1c3c[nH]c4ccccc34)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J08 compound treatment 549646.5863 27500.0 0.13 457996.3504 -24800.0 -0.13 -0.0034 -0.0183 3118172 ChemDiv3_000910 FC(F)(F)c1cccc(NC(=O)c2ccc(cc2)c3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J09 compound treatment 521193.7984 -954.0 0.0 502453.4413 19700.0 0.1 0.0706 0.6767 3020940 ChemDiv3_000911 Ic1cccc(/C=N/N2C(=O)C3C4C=CC(C3C2=O)C54CC5)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J10 compound treatment 604050.0 81900.0 0.38 532496.0317 49700.0 0.26 0.4535 0.9845 3118173 ChemDiv3_000912 Cc1cc(I)ccc1NC(=O)c2ccc(cc2)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J11 compound treatment 493266.9492 -28900.0 -0.13 479363.3218 -3440.0 -0.02 -0.1071 -0.7964 1477505 ChemDiv3_000913 CCCS(=O)(=O)c1c(C(=O)OC)n2ccccc2c1S(=O)(=O)CCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J12 compound treatment 430698.2759 -91400.0 -0.42 440622.8814 -42200.0 -0.22 -0.4564 -0.956 1130176 ChemDiv3_000914 Cc1cccc(NCN2C(=O)C3C4CC(C=C4)C3C2=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J13 compound treatment 472768.6275 -49400.0 -0.23 483878.1362 1080.0 0.01 -0.157 -0.6891 3020941 ChemDiv3_000915 O=C/1OC(=N\C1=C/Nc2ccccn2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J14 compound treatment 419987.9032 -102000.0 -0.47 516289.2562 33500.0 0.18 -0.2075 -0.4122 1478515 ChemDiv3_000916 CCCOc1ccc(cc1)C(=O)Nc2ccc(cc2)c3nc4ccccc4o3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J15 compound treatment 474890.2821 -47300.0 -0.22 482856.1644 57.2 0.0 -0.1539 -0.7061 3118174 ChemDiv3_000917 CC(C)(C)NC(=O)CCCN1C(=O)/C(=C/c2ccccc2)/SC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J16 compound treatment 319158.4158 -203000.0 -0.94 390071.4286 -92700.0 -0.49 -1.0097 -0.9548 3020942 ChemDiv3_000918 Brc1ccc(cc1)C2=N/C(=C\Nc3ccccc3)/C(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J17 compound treatment 515888.8889 -6260.0 -0.03 444635.2941 -38200.0 -0.2 -0.1635 -0.7998 3118175 ChemDiv3_000919 OC(=O)CCCNc1n[nH]c(=O)[nH]c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J18 compound treatment 398866.6667 -123000.0 -0.57 407627.5304 -75200.0 -0.4 -0.6839 -0.9849 1721267 ChemDiv3_000920 O=C1N(CN2CCCCC2)C(=O)c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J19 compound treatment 390491.5254 -132000.0 -0.61 337359.1837 -145000.0 -0.77 -0.9748 -0.993 1065790 ChemDiv3_000921 COc1ccc(NC(=S)NC2CCCCC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J20 compound treatment 493182.8794 -29000.0 -0.13 448484.5679 -34300.0 -0.18 -0.2231 -0.9884 1923178 ChemDiv3_000922 CC1(C)CC(=O)C(=CNCC2CCCO2)C(=O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J21 compound treatment 490843.6364 -31300.0 -0.14 465841.3793 -17000.0 -0.09 -0.1657 -0.9741 1623304 ChemDiv3_000923 Cc1ccc(OC(=O)c2cc3ccccc3o2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J22 compound treatment 474487.5 -47700.0 -0.22 437807.6923 -45000.0 -0.24 -0.3242 -0.9992 3118176 ChemDiv3_000924 CCOCc1c[nH]c(=O)[nH]c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J23 mock treatment 493502.3474 -28600.0 -0.13 475662.3794 -7140.0 -0.04 -0.1202 -0.8745 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 J24 mock treatment 529867.9245 7720.0 0.04 481150.2347 -1650.0 -0.01 0.019 0.518 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K01 compound treatment 541573.913 19400.0 0.09 527516.2791 44700.0 0.24 0.2311 0.9113 1216806 ChemDiv3_000925 CC(=O)OCCn1c(=O)[nH]c(=O)c2nsnc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K02 compound treatment 518934.7826 -3210.0 -0.01 208166.6667 -275000.0 -1.46 -1.0405 -0.7143 3118177 ChemDiv3_000926 CC(C)(C)c1cc(Cl)c(O)c(/N=C/c2ccccc2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K03 compound treatment 564051.2821 41900.0 0.19 492139.3443 9340.0 0.05 0.1717 0.8606 1915945 ChemDiv3_000927 CCOC(=O)/C=C(\C)/N1N=C2C(CCc3cc(OC)ccc23)C1c4ccc(OC)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K04 compound treatment 568676.9912 46500.0 0.21 460928.5714 -21900.0 -0.12 0.0697 0.2858 1496403 ChemDiv3_000928 Cc1cn(cn1)S(=O)(=O)c2ccc(F)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K05 compound treatment 564948.2072 42800.0 0.2 592883.7209 110000.0 0.58 0.5524 0.8963 1637460 ChemDiv3_000929 CCOc1cc(ccc1O)c2cc(C)c3c(ccc4ccccc43)n2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K06 compound treatment 576351.2545 54200.0 0.25 491097.9021 8300.0 0.04 0.2079 0.819 3020943 ChemDiv3_000930 CCC1=C/C(=C/N(C)c2ccccc2)/C(=O)S1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K07 compound treatment 575983.6066 53800.0 0.25 517653.4296 34900.0 0.18 0.3063 0.9895 1083865 ChemDiv3_000931 FC(F)(F)c1cccc(NC(=O)c2ccco2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K08 compound treatment 691352.0 169000.0 0.78 487414.6341 4620.0 0.02 0.5691 0.7289 1678628 ChemDiv3_000932 NCCCc1nc2cc3ccccc3cc2[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K09 compound treatment 597985.0187 75800.0 0.35 565357.7236 82600.0 0.44 0.5569 0.9938 3118178 ChemDiv3_000933 CN(C)c1n[nH]c(=O)[nH]c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K10 compound treatment 541512.8205 19400.0 0.09 548891.4729 66100.0 0.35 0.311 0.8598 1535139 ChemDiv3_000934 NC(=O)C1CCN(CC1)S(=O)(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K11 compound treatment 515782.4268 -6370.0 -0.03 512293.9189 29500.0 0.16 0.0899 0.5646 3020944 ChemDiv3_000935 NN1C(=O)/C(=C\c2ccccc2)/SC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K12 compound treatment 605006.9444 82900.0 0.38 598515.6794 116000.0 0.61 0.7042 0.974 1729835 ChemDiv3_000936 C(Cn1c(Cc2ccccc2)nc3ccccc13)N4CCCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K13 compound treatment 484264.9007 -37900.0 -0.17 545884.2105 63100.0 0.33 0.1131 0.2995 3020945 ChemDiv3_000937 CC1CCN(CC1)C(=O)/C=C/c2ccc3OCOc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K14 compound treatment 533143.8849 11000.0 0.05 554552.0833 71800.0 0.38 0.305 0.7943 3118311 ChemDiv3_000938 Cc1nc2cc(/N=C\c3ccc(Cl)cc3)ccc2n1Cc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K15 compound treatment 347238.0952 -175000.0 -0.81 397543.75 -85300.0 -0.45 -0.8901 -0.9626 3020946 ChemDiv3_000939 CCCCc1ccc(NC(=O)CC)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K16 compound treatment 525616.0 3470.0 0.02 537137.0968 54300.0 0.29 0.2151 0.7452 1129901 ChemDiv3_000940 O=S(=O)(Cc1ccccc1)Nn2cnnc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K17 compound treatment 413772.5118 -108000.0 -0.5 397558.011 -85200.0 -0.45 -0.6731 -0.9987 3020947 ChemDiv3_000941 CC(NC(=O)/C=C/c1ccccc1Cl)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K18 compound treatment 477794.5205 -44400.0 -0.2 399514.2857 -83300.0 -0.44 -0.457 -0.9388 3020310 ChemDiv3_000942 CCOc1ccc(OCCSc2nc3ccccc3n2Cc4ccccc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K19 compound treatment 592115.5378 70000.0 0.32 569059.4406 86300.0 0.46 0.5517 0.9854 1632334 ChemDiv3_000943 CCOC(=O)c1ccccc1NC(=O)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K20 compound treatment 628195.2381 106000.0 0.49 506232.3651 23400.0 0.12 0.4337 0.8595 3118312 ChemDiv3_000944 CCOc1cccc2cc(C(=O)N)/c(=N/Cc3ccccc3)/oc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K21 compound treatment 526577.4059 4430.0 0.02 457467.6806 -25300.0 -0.13 -0.0806 -0.5928 1564768 ChemDiv3_000945 COC(=O)c1cccc(NC(=O)COc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K22 compound treatment 525532.1101 3380.0 0.02 516310.8614 33500.0 0.18 0.1367 0.7662 1122886 ChemDiv3_000946 COC(=O)C1=C(C)NC(=O)CC1c2ccccc2I 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K23 mock treatment 572865.1163 50700.0 0.23 521055.3506 38300.0 0.2 0.3089 0.9975 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 K24 mock treatment 627711.6279 106000.0 0.49 525073.1707 42300.0 0.22 0.5028 0.9381 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L01 compound treatment 641614.0351 119000.0 0.55 621714.8289 139000.0 0.74 0.9106 0.9897 1725902 ChemDiv3_000947 CCOC(=O)CSc1nc2ccccc2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L02 compound treatment 635433.3333 113000.0 0.52 528312.2363 45500.0 0.24 0.5401 0.9385 3118313 ChemDiv3_000948 Clc1cccc(c1)C2OCC3(CO2)COC(OC3)c4cccc(Cl)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L03 compound treatment 668586.0656 146000.0 0.68 630188.9764 147000.0 0.78 1.0303 0.9973 3020311 ChemDiv3_000949 Clc1ccc(/C=C\2/C=C(OC2=O)c3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L04 compound treatment 681655.5024 160000.0 0.74 568033.6134 85200.0 0.45 0.8398 0.9727 1215566 ChemDiv3_000950 COc1ccc(cc1)C2Nc3ccccc3C(=O)N2c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L05 compound treatment 678346.9388 156000.0 0.72 571038.3142 88200.0 0.47 0.8403 0.9782 1482448 ChemDiv3_000951 Clc1ccc(OCC(=O)NC2CCS(=O)(=O)C2)c(Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L06 compound treatment 649333.3333 127000.0 0.59 586877.4704 104000.0 0.55 0.8051 0.9995 3118314 ChemDiv3_000952 O=C1CCC(=O)N1c2nccs2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L07 compound treatment 638866.6667 117000.0 0.54 599396.6942 117000.0 0.62 0.8179 0.9976 1240764 ChemDiv3_000953 Oc1ccccc1C2N(Cc3ccccc3)CCN2Cc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L08 compound treatment 569979.0419 47800.0 0.22 564678.5714 81900.0 0.43 0.4631 0.9507 1351151 ChemDiv3_000954 Clc1c(sc2ccccc12)C(=O)NCc3ccc(Cl)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L09 compound treatment 640768.8889 119000.0 0.55 620060.3448 137000.0 0.73 0.9016 0.9901 1921190 ChemDiv3_000955 Nc1nnc(CCS(=O)(=O)c2ccc(Br)cc2)s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L10 compound treatment 555155.3785 33000.0 0.15 553022.3048 70200.0 0.37 0.371 0.9221 1668007 ChemDiv3_000956 O=C(Nc1cccnc1)c2cc3ccccc3oc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L11 compound treatment 625149.7797 103000.0 0.48 639828.5714 157000.0 0.83 0.9248 0.9645 3118315 ChemDiv3_000957 CN1CNC(=NS(=O)(=O)c2ccc(C)cc2)NC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L12 compound treatment 547034.0426 24900.0 0.11 508119.5652 25300.0 0.13 0.1761 0.9969 1733849 ChemDiv3_000958 COC(=O)c1ccc(NC(=O)C2C(C3CCC2C3)C(=O)O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L13 compound treatment 474916.6667 -47200.0 -0.22 466003.367 -16800.0 -0.09 -0.217 -0.9222 3020312 ChemDiv3_000959 O=C/1OC(=N\C1=C/N2CCCCC2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L14 compound treatment 666136.3636 144000.0 0.66 707566.2651 225000.0 1.19 1.3125 0.9618 1222654 ChemDiv3_000960 CCCOc1ccc(cc1)C(=O)Nc2ccc-3c(Cc4ccccc43)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L15 compound treatment 523545.0 1400.0 0.01 630450.0 148000.0 0.78 0.5583 0.7129 3020313 ChemDiv3_000961 Cc1cccc(/N=C/2\SCC(=O)N2c3cccc(C)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L16 compound treatment 45818.1818 -476000.0 -2.2 34913.0435 -448000.0 -2.38 -3.2331 -0.9992 3118316 ChemDiv3_000962 COC(=O)CNC(c1ccccc1)c2cc(Br)ccc2NC(=O)CCN3CCOCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L17 compound treatment 593671.9577 71500.0 0.33 474463.4146 -8340.0 -0.04 0.202 0.6069 3020314 ChemDiv3_000963 CCCOC(=O)c1ccc(NC(=O)/C=C/c2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L18 compound treatment 458433.8983 -63700.0 -0.29 561434.3434 78600.0 0.42 0.0872 0.1708 3118317 ChemDiv3_000964 CCCCN1C(=O)/C(=C/N(C(=O)C)c2ccccc2)/SC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L19 compound treatment 534244.5255 12100.0 0.06 566939.2857 84100.0 0.45 0.355 0.7894 1677249 ChemDiv3_000965 CCc1cccc(C)c1NC(=O)C2COc3ccccc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L20 compound treatment 537925.0936 15800.0 0.07 519714.2857 36900.0 0.2 0.1899 0.9091 3118318 ChemDiv3_000966 COc1ccc(CNC=C2C(=O)CC(C)(C)CC2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L21 compound treatment 459043.3071 -63100.0 -0.29 509441.6058 26600.0 0.14 -0.1059 -0.3272 3118319 ChemDiv3_000967 Clc1ccc(/C=C/2\SC(=O)N(CC(=O)Nc3cccnc3)C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L22 compound treatment 469219.4245 -52900.0 -0.24 459635.0575 -23200.0 -0.12 -0.2595 -0.9495 3020315 ChemDiv3_000968 CN(/C(=N\S(=O)(=O)c1ccc(C)cc1)/c2ccccc2)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L23 mock treatment 590823.97 68700.0 0.32 485091.6031 2290.0 0.01 0.2325 0.7337 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 L24 mock treatment 603822.314 81700.0 0.38 486434.4569 3640.0 0.02 0.28 0.7423 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M01 compound treatment 433350.7853 -88800.0 -0.41 450068.1818 -32700.0 -0.17 -0.4123 -0.927 3118320 ChemDiv3_000969 OC(=O)c1ccc(/N=C/c2cn(Cc3ccccc3)c4ccccc24)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M02 compound treatment 601398.5507 79300.0 0.37 430846.1538 -52000.0 -0.28 0.0636 0.1389 3020316 ChemDiv3_000970 Fc1ccc(cc1)c2nc3cc(/N=C/C=C/c4ccc5OCOc5c4)ccc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M03 compound treatment 490017.0648 -32100.0 -0.15 442787.5458 -40000.0 -0.21 -0.2548 -0.9846 3118321 ChemDiv3_000971 COc1ccc2CC/C(=C\c3ccc(cc3)N(C)C)/C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M04 compound treatment 572247.0588 50100.0 0.23 513753.9683 31000.0 0.16 0.2795 0.986 1918339 ChemDiv3_000972 CC(C)(C)S(=O)(=O)c1ccc(s1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M05 compound treatment 540042.0168 17900.0 0.08 459920.9486 -22900.0 -0.12 -0.0275 -0.1871 1679374 ChemDiv3_000973 CCc1ccc(cc1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M06 compound treatment 513891.0506 -8260.0 -0.04 461111.1111 -21700.0 -0.12 -0.1083 -0.8935 3118322 ChemDiv3_000974 CCC1=C/C(=C\c2ccc3OCOc3c2)/C(=O)S1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M07 compound treatment 496967.6113 -25200.0 -0.12 458568.0751 -24200.0 -0.13 -0.173 -0.9987 3118323 ChemDiv3_000975 Brc1ccc2NC(=O)/C(=C/3\SC(=S)N(C3=O)c4cccc(Br)c4)/c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M08 compound treatment 560632.7869 38500.0 0.18 565800.6757 83000.0 0.44 0.4368 0.9202 1260425 ChemDiv3_000976 OC(=O)c1cncc(OC(=O)OCc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M09 compound treatment 541534.4262 19400.0 0.09 491458.1818 8660.0 0.05 0.0957 0.9521 1445337 ChemDiv3_000977 O=C(CCN1C(=O)c2ccccc2C1=O)Nc3ccc(cc3)S(=O)(=O)Nc4nccs4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M10 compound treatment 502812.5 -19300.0 -0.09 499831.7152 17000.0 0.09 8.0E-4 0.0065 1228370 ChemDiv3_000978 COc1ccc(cc1)S(=O)(=O)N2CCCCC2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M11 compound treatment 522560.0 412.0 0.0 437793.7743 -45000.0 -0.24 -0.1674 -0.7015 1353970 ChemDiv3_000979 CCS(=O)(=O)c1ccc(O)c(NC(=O)COc2ccc(OC)cc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M12 compound treatment 531090.5512 8940.0 0.04 457343.75 -25500.0 -0.14 -0.0663 -0.4697 3020317 ChemDiv3_000980 Brc1ccc(/C=N/c2nc3ccccc3n2CCN4CCCCC4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M13 compound treatment 460772.7273 -61400.0 -0.28 441541.3793 -41300.0 -0.22 -0.3549 -0.9919 1731333 ChemDiv3_000981 CCOC(=O)c1cccc(NC(=O)c2ccccc2Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M14 compound treatment 491057.7778 -31100.0 -0.14 432311.2033 -50500.0 -0.27 -0.2907 -0.9571 3020318 ChemDiv3_000982 CN(C)c1ccc(/C=N/c2ccc3n(cnc3c2)c4ccc(C)cc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M15 compound treatment 439934.4828 -82200.0 -0.38 497775.9336 15000.0 0.08 -0.2119 -0.5471 1678613 ChemDiv3_000983 CCOc1ccccc1C(=O)Nc2ccc(Cl)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M16 compound treatment 531758.1227 9610.0 0.04 497920.0 15100.0 0.08 0.088 0.9609 1685159 ChemDiv3_000984 CC1CC(C)CN(C1)C(=O)c2c(C)onc2c3ccccc3Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M17 compound treatment 539578.3582 17400.0 0.08 496248.0315 13400.0 0.07 0.1073 0.9982 3020319 ChemDiv3_000985 CC(NC(=O)/C=C/c1ccc2OCOc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M18 compound treatment 547501.845 25400.0 0.12 492131.1475 9330.0 0.05 0.1177 0.9268 3118324 ChemDiv3_000986 CCOc1ccc(OCCSc2nc(=O)cc(C)[nH]2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M19 compound treatment 551776.4228 29600.0 0.14 553125.8065 70300.0 0.37 0.3604 0.9072 1635077 ChemDiv3_000987 NC(=O)CCN1C(=O)c2ccccc2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M20 compound treatment 581468.3544 59300.0 0.27 463605.4688 -19200.0 -0.1 0.1215 0.4161 1419414 ChemDiv3_000988 C(CN1CCOCC1)Cc2ccc(COc3ccccc3)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M21 compound treatment 566457.9832 44300.0 0.2 513003.8023 30200.0 0.16 0.2578 0.9928 1606786 ChemDiv3_000989 COC(=O)c1ccccc1NC(=O)c2cccs2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M22 compound treatment 563371.0938 41200.0 0.19 459842.9752 -23000.0 -0.12 0.0483 0.2141 1273253 ChemDiv3_000990 CNS(=O)(=O)c1ccc-2c(c1)C(=NO)c3cc(ccc32)S(=O)(=O)NC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M23 mock treatment 574598.4848 52500.0 0.24 462609.8485 -20200.0 -0.11 0.0953 0.3603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 M24 mock treatment 517090.5512 -5060.0 -0.02 485827.5862 3030.0 0.02 -0.0051 -0.1813 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N01 compound treatment 588875.5187 66700.0 0.31 587928.2869 105000.0 0.56 0.6119 0.9607 1426304 ChemDiv3_000991 Cc1cc(C)cc(OC(=O)CCN2C(=O)c3ccccc3C2=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N02 compound treatment 743065.5738 221000.0 1.02 737895.4545 255000.0 1.35 1.6771 0.9902 3020320 ChemDiv3_000992 Brc1ccc(cc1)C2OCC(CO2)OC(=O)c3ccc(Br)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N03 compound treatment 625189.5735 103000.0 0.48 565941.4414 83100.0 0.44 0.6478 0.9993 1721013 ChemDiv3_000993 Clc1ccc(cc1Cl)C(=O)NCCc2nc3ccccc3[nH]2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N04 compound treatment 765460.251 243000.0 1.12 605606.1947 123000.0 0.65 1.254 0.9665 3020321 ChemDiv3_000994 Brc1ccc(cc1)S(=O)(=O)/N=C(\Nc2ccccc2)/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N05 compound treatment 586746.1538 64600.0 0.3 595819.2771 113000.0 0.6 0.6345 0.9479 1559580 ChemDiv3_000995 CCOC(=O)C1=C(C)N(C)C(=O)NC1c2ccccc2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N06 compound treatment 586528.0 64400.0 0.3 513806.7227 31000.0 0.16 0.3262 0.9612 3020344 ChemDiv3_000996 CSc1ccc(/C=c\2/sc3nc4c(C)c(C)ccc4n3c2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N07 compound treatment 586411.5226 64300.0 0.3 492507.6923 9710.0 0.05 0.246 0.8177 1921413 ChemDiv3_000997 CC(=O)Nc1ccc(NC(=O)/C=C/c2ccccc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N08 compound treatment 600810.4089 78700.0 0.36 541868.7943 59100.0 0.31 0.4781 0.9973 1649360 ChemDiv3_000998 CC(C)c1ccc(NC(=O)c2cccnc2Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N09 compound treatment 605013.1579 82900.0 0.38 631011.7188 148000.0 0.79 0.8261 0.9451 1551746 ChemDiv3_000999 CC(=O)Nc1nnc(CCS(=O)(=O)c2ccc(C)cc2)s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N10 compound treatment 593956.1753 71800.0 0.33 549826.2712 67000.0 0.36 0.4855 0.9994 3118325 ChemDiv3_001000 Oc1ccccc1NC(=S)NC(=O)/C=C/c2ccc(F)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N11 compound treatment 562263.1579 40100.0 0.18 545004.0 62200.0 0.33 0.3641 0.9626 3118597 ChemDiv3_001001 NC(=NS(=O)(=O)c1ccc(NC(=O)OC2CCCC2)cc1)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N12 compound treatment 568053.0035 45900.0 0.21 515255.3957 32500.0 0.17 0.2714 0.9947 1270195 ChemDiv3_001002 CC(N1C(=O)C2C3CC(C=C3)C2C1=O)C(=O)OCC(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N13 compound treatment 544928.5714 22800.0 0.11 525747.6636 42900.0 0.23 0.2354 0.9382 3118453 ChemDiv3_001003 O=S(=O)(/N=C(\OC1CCCCC1)/c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N14 compound treatment 510041.3534 -12100.0 -0.06 663925.4902 181000.0 0.96 0.6398 0.6649 1241887 ChemDiv3_001004 CCCOc1cccc(c1)C(=O)Nc2ccc(cc2)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N15 compound treatment 646955.1724 125000.0 0.58 499007.5188 16200.0 0.09 0.4678 0.8038 3020346 ChemDiv3_001005 COc1ccccc1N2C(=O)S/C(=C\c3ccccc3)/C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N16 compound treatment 512946.8085 -9200.0 -0.04 410598.3936 -72200.0 -0.38 -0.3008 -0.7807 1373892 ChemDiv3_001006 CC(=C)Cn1c(SCC(=O)NN)nc2ccccc2c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N17 compound treatment 465084.9421 -57100.0 -0.26 514956.1753 32200.0 0.17 -0.0655 -0.2088 1493653 ChemDiv3_001007 CC(C)c1ccccc1NC(=O)c2cc3ccccc3oc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N18 compound treatment 439810.6061 -82300.0 -0.38 428035.7143 -54800.0 -0.29 -0.4739 -0.9912 3118454 ChemDiv3_001008 CC(=O)N(/C=C/1\SC(=S)N(Cc2ccccc2)C1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N19 compound treatment 514283.8983 -7860.0 -0.04 438942.3077 -43900.0 -0.23 -0.1901 -0.8076 1232650 ChemDiv3_001009 CCOC(=O)c1cccc(NC(=O)CCOc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N20 compound treatment 527896.2963 5750.0 0.03 510796.1538 28000.0 0.15 0.1237 0.8204 3118455 ChemDiv3_001010 CC1(C)CC(=O)C(=CNCc2cccnc2)C(=O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N21 compound treatment 477931.7406 -44200.0 -0.2 435371.3235 -47400.0 -0.25 -0.3221 -0.9946 3118456 ChemDiv3_001011 CN1CCN(CC1)NC(=O)CN2C(=O)S/C(=C/c3ccc(Cl)cc3)/C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N22 compound treatment 419823.5294 -102000.0 -0.47 460130.4348 -22700.0 -0.12 -0.4187 -0.8598 1118985 ChemDiv3_001012 COc1ccccc1NC(=O)C2(CC3CC4CC(C3)C2)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N23 mock treatment 535323.8866 13200.0 0.06 536797.4138 54000.0 0.29 0.2455 0.8385 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 N24 mock treatment 530792.0 8640.0 0.04 438405.7377 -44400.0 -0.24 -0.1383 -0.5792 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O01 compound treatment 427480.3493 -94700.0 -0.44 392675.5556 -90100.0 -0.48 -0.6467 -0.999 3118457 ChemDiv3_001013 COC(=O)CNC(c1ccccc1)c2cc(Br)ccc2NC(=O)c3ccccc3Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O02 compound treatment 433986.6667 -88200.0 -0.41 488049.0196 5250.0 0.03 -0.2678 -0.6571 3020347 ChemDiv3_001014 OC(=O)c1ccc(cc1)c2ccc(/C=C/3\Sc4ccccc4C3=O)o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O03 compound treatment 619831.2757 97700.0 0.45 546916.6667 64100.0 0.34 0.559 0.9904 1433689 ChemDiv3_001015 COc1ccc(cc1OC)C2CC(=NN2C=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O04 compound treatment 546812.0 24700.0 0.11 510348.4321 27500.0 0.15 0.1838 0.9923 1216374 ChemDiv3_001016 CC1(C)CC(=CC(C)(C)N1)c2ccc(s2)C3=CC(C)(C)NC(C)(C)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O05 compound treatment 440981.8841 -81200.0 -0.37 390457.4468 -92300.0 -0.49 -0.611 -0.9912 1687051 ChemDiv3_001017 Oc1cccc(c1)c2nc3ccc4ccccc4c3c5CCCCc25 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O06 compound treatment 497855.4217 -24300.0 -0.11 400247.6636 -82600.0 -0.44 -0.3888 -0.8603 3020348 ChemDiv3_001018 CCc1cc2c[n+](sc2s1)C3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O07 compound treatment 535932.5843 13800.0 0.06 479032.491 -3770.0 -0.02 0.0308 0.4626 1282936 ChemDiv3_001019 Cc1cc(=O)oc2cc(OCC(=O)O)ccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O08 compound treatment 609127.451 87000.0 0.4 595140.9692 112000.0 0.6 0.705 0.9815 1606633 ChemDiv3_001020 CC(=O)Oc1cncc(c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O09 compound treatment 587155.0388 65000.0 0.3 478729.8246 -4070.0 -0.02 0.1967 0.6545 1192059 ChemDiv3_001021 O=C(NCc1ccccc1)C(Cc2ccccc2)N3C(=O)c4ccccc4C3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O10 compound treatment 563091.8367 40900.0 0.19 491195.4545 8400.0 0.04 0.165 0.8505 1475559 ChemDiv3_001022 COc1ccc(cc1)C(=O)NCC#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O11 compound treatment 481812.5 -40300.0 -0.19 401605.2632 -81200.0 -0.43 -0.436 -0.9295 1080178 ChemDiv3_001023 Clc1ccc(cc1)C(=O)NC(=S)Nc2ccccc2Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O12 compound treatment 631887.5 110000.0 0.51 544345.6221 61500.0 0.33 0.5887 0.9775 3118458 ChemDiv3_001024 Clc1ccc(/C=N/c2nc3ccccc3n2CC=C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O13 compound treatment 602111.6279 80000.0 0.37 571387.931 88600.0 0.47 0.593 0.9928 1649330 ChemDiv3_001025 O=C(CNC(=O)c1ccccc1)N2CCOCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O14 compound treatment 625504.6296 103000.0 0.48 511781.5126 29000.0 0.15 0.4457 0.89 3118459 ChemDiv3_001026 COc1ccccc1n2cnc3cc(/N=C/c4ccccc4O)ccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O15 compound treatment 567225.2252 45100.0 0.21 553166.0377 70400.0 0.37 0.4109 0.9618 1328150 ChemDiv3_001027 Cc1ccc(cc1)N(C2CS(=O)(=O)CC2OC(=O)c3ccccc3)C(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O16 compound treatment 542426.6667 20300.0 0.09 472810.2767 -9990.0 -0.05 0.0287 0.2667 1283075 ChemDiv3_001028 COc1ccc(NC(=O)CN2C(=O)c3ccccc3C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O17 compound treatment 529937.0079 7790.0 0.04 476008.4388 -6790.0 -0.04 -1.0E-4 -0.0014 3118460 ChemDiv3_001029 Cc1ccccc1NC(=O)/C=C/c2ccc3OCOc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O18 compound treatment 554274.7748 32100.0 0.15 551411.7647 68600.0 0.36 0.3621 0.9215 1317231 ChemDiv3_001030 NNC(=O)CNC(=O)C1COc2ccccc2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O19 compound treatment 544186.9159 22000.0 0.1 465518.1159 -17300.0 -0.09 0.0071 0.0516 1195157 ChemDiv3_001031 COc1ccc(CCNC(=O)C(C(C)C)N2C(=O)c3ccccc3C2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O20 compound treatment 533810.5727 11700.0 0.05 524505.6604 41700.0 0.22 0.1945 0.8541 3020350 ChemDiv3_001032 OC(=O)C/1=NN(C(=O)\C1=C/c2c[nH]c3ccccc23)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O21 compound treatment 557386.8313 35200.0 0.16 453951.1111 -28800.0 -0.15 0.0067 0.0301 1154870 ChemDiv3_001033 COc1ccc(NC(=O)COc2ccc(C)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O22 compound treatment 518986.1751 -3160.0 -0.01 463781.25 -19000.0 -0.1 -0.0816 -0.801 1195792 ChemDiv3_001034 CCNS(=O)(=O)c1ccc-2c(c1)C(=O)c3cc(ccc32)S(=O)(=O)NCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O23 mock treatment 512982.684 -9170.0 -0.04 555865.0794 73100.0 0.39 0.2441 0.6263 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 O24 mock treatment 519792.0792 -2360.0 -0.01 508905.3498 26100.0 0.14 0.0902 0.6496 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P01 compound treatment 520837.7193 -1310.0 -0.01 501061.674 18300.0 0.1 0.0642 0.6617 1266216 ChemDiv3_001035 Cc1cccc(C)c1OC(=O)CN2C(=O)c3ccccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P02 compound treatment 481853.3835 -40300.0 -0.19 495418.5022 12600.0 0.07 -0.0841 -0.4256 3118461 ChemDiv3_001036 Cc1ccccc1OCCn2c(S)nc3ccccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P03 compound treatment 539926.9231 17800.0 0.08 549975.0 67200.0 0.36 0.3099 0.8477 1270060 ChemDiv3_001037 O=C(NC1CCCC1)c2cc3nc(cc(c4ccccc4)n3n2)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P04 compound treatment 513342.6295 -8810.0 -0.04 494816.0 12000.0 0.06 0.0164 0.2164 3020351 ChemDiv3_001038 Cc1ccccc1N/C(=N\S(=O)(=O)c2ccccc2)/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P05 compound treatment 586232.6531 64100.0 0.3 423882.0225 -58900.0 -0.31 -0.012 -0.0279 1725017 ChemDiv3_001039 COc1ccc(CC(C)CC(=O)Nc2ccc(I)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P06 compound treatment 524718.254 2570.0 0.01 546192.8934 63400.0 0.34 0.2461 0.7316 1202851 ChemDiv3_001040 Nc1c(C#N)c(c(C#N)c2nc3ccccc3n12)c4ccccc4Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P07 compound treatment 341358.871 -181000.0 -0.83 372635.2459 -110000.0 -0.58 -1.0027 -0.9849 1528263 ChemDiv3_001041 COc1ccc(NCC(O)Cn2c3ccc(Cl)cc3c4cc(Cl)ccc24)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P08 compound treatment 518403.6364 -3740.0 -0.02 471989.0909 -10800.0 -0.06 -0.0528 -0.881 1730700 ChemDiv3_001042 Cc1ccnc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3Br)cc2)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P09 compound treatment 409784.5528 -112000.0 -0.52 404594.1423 -78200.0 -0.41 -0.6597 -0.9939 3020380 ChemDiv3_001043 COc1ccc-2c(c1)C(=NN)c3cc(OC)ccc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P10 compound treatment 48148.1482 -474000.0 -2.19 48867.6471 -434000.0 -2.3 -3.1731 -0.9997 3118462 ChemDiv3_001044 OC(=O)CCN1C(=O)/C(=C/c2ccc(o2)c3ccc(Cl)cc3Cl)/SC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P11 compound treatment 513893.1624 -8250.0 -0.04 497464.4351 14700.0 0.08 0.0281 0.3243 1544835 ChemDiv3_001045 CC(C)OC(=O)N1CCN(CC1)S(=O)(=O)c2ccc(C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P12 compound treatment 520962.5 -1190.0 -0.01 481610.6195 -1190.0 -0.01 -0.0083 -0.9975 3118463 ChemDiv3_001046 CCN1/C(=C\2/SC(=S)N(N)C2=O)/C=Cc3cc(C)ccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P13 compound treatment 479402.4896 -42700.0 -0.2 480934.6939 -1860.0 -0.01 -0.1464 -0.7416 3118464 ChemDiv3_001047 CCS(=O)(=O)CCc1nnc(NC(=O)Nc2cccc(c2)C(F)(F)F)s1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P14 compound treatment 486018.4332 -36100.0 -0.17 471153.5714 -11600.0 -0.06 -0.1615 -0.9088 1403310 ChemDiv3_001048 CCOc1ccc(NC(=O)c2cc3ccccc3o2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P15 compound treatment 476016.9492 -46100.0 -0.21 427954.1985 -54800.0 -0.29 -0.3561 -0.9882 3118465 ChemDiv3_001049 COc1ccc(/C=C/2\SC(=O)N(C2=O)c3ccc(C)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P16 compound treatment 460407.4074 -61700.0 -0.28 450673.7288 -32100.0 -0.17 -0.3218 -0.9699 3020381 ChemDiv3_001050 CN(C)c1ccc(/C=C/c2ccncc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P17 compound treatment 397388.2353 -125000.0 -0.58 447885.8268 -34900.0 -0.19 -0.5378 -0.8897 1724755 ChemDiv3_001051 CCc1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P18 compound treatment 410048.7805 -112000.0 -0.52 409975.0 -72800.0 -0.39 -0.6387 -0.9897 3020382 ChemDiv3_001052 CN1C(=O)/C(=C/Nc2ccccc2)/OC1=S 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P19 compound treatment 416137.8092 -106000.0 -0.49 420974.0741 -61800.0 -0.33 -0.5776 -0.9811 1157486 ChemDiv3_001053 Cc1cccc(NC(=O)CCOc2ccccc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P20 compound treatment 386677.305 -135000.0 -0.62 387381.2709 -95400.0 -0.51 -0.7996 -0.9945 1218521 ChemDiv3_001054 CCOP(=S)(OCC)SCSn1c(=O)oc2cc(Cl)ccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P21 compound treatment 389716.9118 -132000.0 -0.61 375947.5655 -107000.0 -0.57 -0.8326 -0.9993 3118466 ChemDiv3_001055 O=C/1N(C(=S)S\C1=C\c2cccs2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P22 compound treatment 381551.3699 -141000.0 -0.65 383636.6667 -99200.0 -0.53 -0.8304 -0.9946 3020383 ChemDiv3_001056 CC(Oc1ccc(Br)cc1)C(=O)NN 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P23 mock treatment 390704.3796 -131000.0 -0.61 396177.686 -86600.0 -0.46 -0.7535 -0.9907 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2003 P24 mock treatment 414226.2443 -108000.0 -0.5 416988.5496 -65800.0 -0.35 -0.5987 -0.9849 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A01 compound treatment 690792.2078 59100.0 0.27 611365.7407 19800.0 0.11 0.267 0.9145 ICBGEx2_000001 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A02 compound treatment 699031.9149 67300.0 0.31 425719.1011 -166000.0 -0.88 -0.4024 -0.4315 ICBGEx2_000002 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A03 compound treatment 653921.9512 22200.0 0.1 687437.1859 95900.0 0.51 0.4321 0.8326 ICBGEx2_000003 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A04 compound treatment 765239.6694 134000.0 0.62 705234.4498 114000.0 0.6 0.8618 0.9999 ICBGEx2_000004 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A05 compound treatment 705416.2679 73700.0 0.34 607770.4918 16300.0 0.09 0.3012 0.8593 ICBGEx2_000005 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A06 compound treatment 636835.5556 5100.0 0.02 603395.4545 11900.0 0.06 0.0612 0.9097 ICBGEx2_000006 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A07 compound treatment 456050.2092 -176000.0 -0.81 714745.3704 123000.0 0.65 -0.1107 -0.1064 ICBGEx2_000007 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A08 compound treatment 634491.9614 2760.0 0.01 753294.1176 162000.0 0.86 0.6157 0.7175 ICBGEx2_000008 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A09 compound treatment 471068.0628 -161000.0 -0.74 488287.2928 -103000.0 -0.55 -0.9111 -0.9889 ICBGEx2_000009 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A10 compound treatment 655967.2727 24200.0 0.11 718797.2973 127000.0 0.68 0.5564 0.8131 ICBGEx2_000010 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A11 compound treatment 508778.2258 -123000.0 -0.57 623794.5205 32300.0 0.17 -0.2799 -0.4725 ICBGEx2_000011 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A12 compound treatment 585845.0 -45900.0 -0.21 585064.3564 -6450.0 -0.03 -0.1738 -0.8109 ICBGEx2_000012 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A13 compound treatment 537855.4217 -93900.0 -0.43 689263.9594 97700.0 0.52 0.0605 0.0895 ICBGEx2_000013 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A14 compound treatment 657619.2308 25900.0 0.12 668228.0 76700.0 0.41 0.3721 0.8776 ICBGEx2_000014 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A15 compound treatment 587407.5829 -44300.0 -0.2 574492.1466 -17000.0 -0.09 -0.2084 -0.9325 ICBGEx2_000015 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A16 compound treatment 408347.032 -223000.0 -1.03 478032.5581 -113000.0 -0.6 -1.1541 -0.9673 ICBGEx2_000016 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A17 compound treatment 554202.5862 -77500.0 -0.36 539253.5211 -52300.0 -0.28 -0.4488 -0.9921 ICBGEx2_000017 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A18 compound treatment 709608.9965 77900.0 0.36 671944.0 80400.0 0.43 0.5556 0.9963 ICBGEx2_000018 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A19 compound treatment 623744.6809 -7990.0 -0.04 705109.4527 114000.0 0.6 0.4 0.6626 ICBGEx2_000019 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A20 compound treatment 609837.5796 -21900.0 -0.1 717155.2347 126000.0 0.67 0.3998 0.5932 ICBGEx2_000020 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A21 compound treatment 497752.5253 -134000.0 -0.62 512551.9481 -79000.0 -0.42 -0.7331 -0.9821 ICBGEx2_000021 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A22 compound treatment 402190.4762 -230000.0 -1.06 436313.1868 -155000.0 -0.82 -1.3306 -0.9923 ICBGEx2_000022 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A23 mock treatment 524794.3548 -107000.0 -0.49 1056941.176 465000.0 2.47 1.3968 0.5549 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 A24 mock treatment 995308.2902 364000.0 1.68 943452.6316 352000.0 1.87 2.5055 0.9986 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B01 compound treatment 646607.9295 14900.0 0.07 663500.0 72000.0 0.38 0.3185 0.821 ICBGEx2_000023 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B02 compound treatment 840095.2381 208000.0 0.96 859987.069 268000.0 1.42 1.6863 0.9817 ICBGEx2_000024 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B03 compound treatment 651151.0417 19400.0 0.09 615222.2222 23700.0 0.13 0.1522 0.9862 ICBGEx2_000025 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B04 compound treatment 723889.8305 92200.0 0.42 778346.8468 187000.0 0.99 1.0012 0.9286 ICBGEx2_000026 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B05 compound treatment 598146.789 -33600.0 -0.15 507178.4038 -84300.0 -0.45 -0.4258 -0.8996 ICBGEx2_000027 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B06 compound treatment 532039.548 -99700.0 -0.46 600988.024 9470.0 0.05 -0.2896 -0.6261 ICBGEx2_000028 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B07 compound treatment 670909.5023 39200.0 0.18 575658.2915 -15900.0 -0.08 0.0683 0.3426 ICBGEx2_000029 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B08 compound treatment 667546.1847 35800.0 0.17 693561.7021 102000.0 0.54 0.4995 0.8827 ICBGEx2_000030 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B09 compound treatment 746485.2321 115000.0 0.53 767470.852 176000.0 0.93 1.0341 0.9639 ICBGEx2_000031 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B10 compound treatment 568211.6183 -63500.0 -0.29 716632.0755 125000.0 0.66 0.2621 0.3613 ICBGEx2_000032 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B11 compound treatment 516915.493 -115000.0 -0.53 482884.2593 -109000.0 -0.58 -0.7818 -0.9991 ICBGEx2_000033 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B12 compound treatment 829603.1746 198000.0 0.91 628565.2174 37000.0 0.2 0.7842 0.8401 ICBGEx2_000034 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B13 compound treatment 442042.1053 -190000.0 -0.87 397676.7677 -194000.0 -1.03 -1.3456 -0.9968 ICBGEx2_000035 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B14 compound treatment 490383.6858 -141000.0 -0.65 841506.2241 250000.0 1.33 0.4766 0.3226 ICBGEx2_000036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B15 compound treatment 679625.4682 47900.0 0.22 634490.991 43000.0 0.23 0.3173 0.9999 ICBGEx2_000037 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B16 compound treatment 683288.1356 51600.0 0.24 613760.0 22200.0 0.12 0.2515 0.9477 ICBGEx2_000038 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B17 compound treatment 712551.4403 80800.0 0.37 541787.7358 -49700.0 -0.26 0.077 0.1687 ICBGEx2_000039 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B18 compound treatment 588443.9252 -43300.0 -0.2 696893.0481 105000.0 0.56 0.254 0.428 ICBGEx2_000040 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B19 compound treatment 607321.9697 -24400.0 -0.11 649528.1385 58000.0 0.31 0.138 0.4211 ICBGEx2_000041 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B20 compound treatment 601187.251 -30500.0 -0.14 620751.1962 29200.0 0.16 0.01 0.0479 ICBGEx2_000042 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B21 compound treatment 551904.943 -79800.0 -0.37 635226.087 43700.0 0.23 -0.0964 -0.2216 ICBGEx2_000043 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B22 compound treatment 721493.3333 89800.0 0.41 614432.7731 22900.0 0.12 0.3786 0.8777 ICBGEx2_000044 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B23 mock treatment 860358.2766 229000.0 1.05 552512.1951 -39000.0 -0.21 0.5992 0.5577 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 B24 mock treatment 744014.218 112000.0 0.52 580198.4733 -11300.0 -0.06 0.3237 0.621 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C01 compound treatment 66377.7778 -565000.0 -2.61 59209.3023 -532000.0 -2.82 -3.84 -0.9992 ICBGEx2_000045 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C02 compound treatment 430973.2143 -201000.0 -0.93 424900.9901 -167000.0 -0.88 -1.2796 -0.9997 ICBGEx2_000046 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C03 compound treatment 717827.2727 86100.0 0.4 688371.0692 96900.0 0.51 0.644 0.9919 ICBGEx2_000047 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C04 compound treatment 725196.4286 93500.0 0.43 553521.7391 -38000.0 -0.2 0.1623 0.341 ICBGEx2_000048 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C05 compound treatment 63477.2727 -568000.0 -2.62 51000.0 -541000.0 -2.87 -3.8802 -0.999 ICBGEx2_000049 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C06 compound treatment 662352.6786 30600.0 0.14 677728.6432 86200.0 0.46 0.4232 0.8843 ICBGEx2_000050 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C07 compound treatment 55509.8039 -576000.0 -2.66 60183.6735 -531000.0 -2.82 -3.8718 -0.9996 ICBGEx2_000051 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C08 compound treatment 638415.7303 6680.0 0.03 760924.8826 169000.0 0.9 0.6571 0.7309 ICBGEx2_000052 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C09 compound treatment 507326.5306 -124000.0 -0.57 643557.5221 52000.0 0.28 -0.2105 -0.3306 ICBGEx2_000053 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C10 compound treatment 637359.5041 5620.0 0.03 722795.0 131000.0 0.7 0.5107 0.7329 ICBGEx2_000054 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C11 compound treatment 664407.4074 32700.0 0.15 600802.0305 9290.0 0.05 0.1414 0.8918 ICBGEx2_000055 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C12 compound treatment 355862.069 -276000.0 -1.27 312264.3678 -279000.0 -1.48 -1.9469 -0.9971 ICBGEx2_000056 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C13 compound treatment 719359.1837 87600.0 0.4 662757.732 71200.0 0.38 0.5529 0.9994 ICBGEx2_000057 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C14 compound treatment 702709.0164 71000.0 0.33 714004.8309 122000.0 0.65 0.6908 0.9496 ICBGEx2_000058 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C15 compound treatment 574965.0 -56800.0 -0.26 575823.5294 -15700.0 -0.08 -0.244 -0.8881 ICBGEx2_000059 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C16 compound treatment 567994.6524 -63700.0 -0.29 658171.7172 66700.0 0.35 0.0421 0.0916 ICBGEx2_000060 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C17 compound treatment 62200.0 -570000.0 -2.63 65689.6552 -526000.0 -2.79 -3.8293 -0.9996 ICBGEx2_000061 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C18 compound treatment 632680.2974 945.0 0.0 785408.2569 194000.0 1.03 0.7303 0.7101 ICBGEx2_000062 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C19 compound treatment 687197.9167 55500.0 0.26 710876.7123 119000.0 0.63 0.6285 0.9205 ICBGEx2_000063 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C20 compound treatment 665430.1471 33700.0 0.16 567095.6522 -24400.0 -0.13 0.0183 0.0904 ICBGEx2_000064 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C21 compound treatment 595039.3701 -36700.0 -0.17 646731.2775 55200.0 0.29 0.0874 0.2584 ICBGEx2_000065 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C22 compound treatment 428041.8848 -204000.0 -0.94 509928.5714 -81600.0 -0.43 -0.9702 -0.9381 ICBGEx2_000066 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C23 mock treatment 628094.1704 -3640.0 -0.02 606414.8472 14900.0 0.08 0.044 0.5447 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 C24 mock treatment 775047.2222 143000.0 0.66 620798.2063 29300.0 0.16 0.5771 0.8501 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D01 compound treatment 704083.3333 72300.0 0.33 663765.8537 72200.0 0.38 0.5069 0.9976 ICBGEx2_000067 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D02 compound treatment 637985.0746 6250.0 0.03 680174.1294 88700.0 0.47 0.3529 0.749 ICBGEx2_000068 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D03 compound treatment 473541.8994 -158000.0 -0.73 470829.932 -121000.0 -0.64 -0.9685 -0.9979 ICBGEx2_000069 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D04 compound treatment 171413.0435 -460000.0 -2.12 291452.6316 -300000.0 -1.59 -2.6265 -0.9899 ICBGEx2_000070 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D05 compound treatment 553730.0 -78000.0 -0.36 603396.1353 11900.0 0.06 -0.2098 -0.5745 ICBGEx2_000071 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D06 compound treatment 443234.0426 -189000.0 -0.87 654873.0159 63400.0 0.34 -0.3771 -0.4046 ICBGEx2_000072 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D07 compound treatment 720887.0293 89200.0 0.41 671434.3434 79900.0 0.42 0.5904 0.9999 ICBGEx2_000073 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D08 compound treatment 603793.9914 -27900.0 -0.13 630771.4286 39300.0 0.21 0.0561 0.2291 ICBGEx2_000074 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D09 compound treatment 743560.8696 112000.0 0.52 771958.5062 180000.0 0.96 1.0414 0.9579 ICBGEx2_000075 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D10 compound treatment 693930.6569 62200.0 0.29 577146.9388 -14400.0 -0.08 0.1489 0.5018 ICBGEx2_000076 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D11 compound treatment 506931.9149 -125000.0 -0.58 441830.9859 -150000.0 -0.79 -0.9684 -0.9875 ICBGEx2_000077 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D12 compound treatment 405991.2281 -226000.0 -1.04 381205.6075 -210000.0 -1.12 -1.5249 -0.9994 ICBGEx2_000078 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D13 compound treatment 326326.7327 -305000.0 -1.41 326134.0206 -265000.0 -1.41 -1.9912 -1.0 ICBGEx2_000079 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D14 compound treatment 647917.6471 16200.0 0.07 480684.7826 -111000.0 -0.59 -0.3629 -0.6124 ICBGEx2_000080 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D15 compound treatment 622339.4834 -9400.0 -0.04 683900.8621 92400.0 0.49 0.3158 0.6421 ICBGEx2_000081 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D16 compound treatment 618688.8112 -13000.0 -0.06 645738.4615 54200.0 0.29 0.1608 0.5473 ICBGEx2_000082 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D17 compound treatment 555569.7211 -76200.0 -0.35 672862.3853 81300.0 0.43 0.0567 0.1019 ICBGEx2_000083 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D18 compound treatment 636971.4286 5240.0 0.02 516611.336 -74900.0 -0.4 -0.2639 -0.6629 ICBGEx2_000084 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D19 compound treatment 606200.0 -25500.0 -0.12 613060.9319 21500.0 0.11 -0.0025 -0.0151 ICBGEx2_000085 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D20 compound treatment 429645.8333 -202000.0 -0.93 405424.5283 -186000.0 -0.99 -1.3569 -0.9996 ICBGEx2_000086 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D21 compound treatment 695365.3846 63600.0 0.29 688850.3401 97300.0 0.52 0.5725 0.9642 ICBGEx2_000087 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D22 compound treatment 552340.6114 -79400.0 -0.37 568867.7249 -22600.0 -0.12 -0.3438 -0.8923 ICBGEx2_000088 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D23 mock treatment 701887.7551 70200.0 0.32 571402.7149 -20100.0 -0.11 0.1533 0.4501 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 D24 mock treatment 684836.7347 53100.0 0.24 515677.2908 -75800.0 -0.4 -0.1113 -0.2363 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E01 compound treatment 653037.9747 21300.0 0.1 616485.5769 25000.0 0.13 0.1631 0.9892 ICBGEx2_000089 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E02 compound treatment 785521.7391 154000.0 0.71 786646.5116 195000.0 1.03 1.2333 0.983 ICBGEx2_000090 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E03 compound treatment 823402.5974 192000.0 0.88 786132.1586 195000.0 1.03 1.3549 0.997 ICBGEx2_000091 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E04 compound treatment 733539.9061 102000.0 0.47 629115.6069 37600.0 0.2 0.473 0.9273 ICBGEx2_000092 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E05 compound treatment 530753.9683 -101000.0 -0.47 556460.733 -35100.0 -0.19 -0.4608 -0.9189 ICBGEx2_000093 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E06 compound treatment 633463.5193 1730.0 0.01 541243.6548 -50300.0 -0.27 -0.1829 -0.6857 ICBGEx2_000094 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E07 compound treatment 382400.0 -249000.0 -1.15 627063.6364 35500.0 0.19 -0.6797 -0.5834 ICBGEx2_000095 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E08 compound treatment 669678.5714 37900.0 0.17 677812.0 86300.0 0.46 0.4474 0.913 ICBGEx2_000096 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E09 compound treatment 466916.6667 -165000.0 -0.76 453892.3077 -138000.0 -0.73 -1.0536 -0.9998 ICBGEx2_000097 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E10 compound treatment 408620.6897 -223000.0 -1.03 560107.1429 -31400.0 -0.17 -0.8454 -0.811 ICBGEx2_000098 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E11 compound treatment 331572.973 -300000.0 -1.38 606071.0383 14600.0 0.08 -0.9242 -0.6666 ICBGEx2_000099 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E12 compound treatment 663608.871 31900.0 0.15 717100.4785 126000.0 0.67 0.5749 0.8429 ICBGEx2_000100 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E13 compound treatment 771848.4848 140000.0 0.65 653859.0308 62300.0 0.33 0.6907 0.9516 ICBGEx2_000101 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E14 compound treatment 534982.3789 -96800.0 -0.45 570843.318 -20700.0 -0.11 -0.393 -0.8554 ICBGEx2_000102 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E15 compound treatment 673853.5565 42100.0 0.19 557315.3846 -34200.0 -0.18 0.0091 0.0341 ICBGEx2_000103 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E16 compound treatment 600029.316 -31700.0 -0.15 738752.1368 147000.0 0.78 0.4488 0.5649 ICBGEx2_000104 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E17 compound treatment 554048.3871 -77700.0 -0.36 781846.7433 190000.0 1.01 0.4605 0.4299 ICBGEx2_000105 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E18 compound treatment 653019.0476 21300.0 0.1 494212.1212 -97300.0 -0.52 -0.2955 -0.5625 ICBGEx2_000106 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E19 compound treatment 634035.2941 2300.0 0.01 720836.3636 129000.0 0.69 0.4925 0.718 ICBGEx2_000107 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E20 compound treatment 718755.9055 87000.0 0.4 736746.6063 145000.0 0.77 0.8284 0.9538 ICBGEx2_000108 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E21 compound treatment 502362.2449 -129000.0 -0.6 653706.383 62200.0 0.33 -0.1886 -0.2767 ICBGEx2_000109 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E22 compound treatment 580599.1561 -51100.0 -0.24 681682.5397 90200.0 0.48 0.1714 0.3215 ICBGEx2_000110 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E23 mock treatment 631645.0704 -90.6 0.0 733497.561 142000.0 0.75 0.5322 0.7067 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 E24 mock treatment 705316.3842 73600.0 0.34 648162.5616 56600.0 0.3 0.4524 0.9982 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F01 compound treatment 543135.8025 -88600.0 -0.41 888801.6878 297000.0 1.58 0.826 0.5071 ICBGEx2_000111 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F02 compound treatment 149830.5085 -482000.0 -2.22 447131.5789 -144000.0 -0.77 -2.113 -0.8989 ICBGEx2_000112 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F03 compound treatment 621907.3171 -9830.0 -0.05 678826.087 87300.0 0.46 0.2954 0.6349 ICBGEx2_000113 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F04 compound treatment 838750.0 207000.0 0.95 764820.7547 173000.0 0.92 1.325 0.9998 ICBGEx2_000114 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F05 compound treatment 684866.6667 53100.0 0.25 765604.7619 174000.0 0.92 0.8262 0.8648 ICBGEx2_000115 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F06 compound treatment 347149.7585 -285000.0 -1.31 401018.8679 -190000.0 -1.01 -1.6425 -0.9917 ICBGEx2_000116 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F07 compound treatment 690115.5378 58400.0 0.27 646720.7207 55200.0 0.29 0.3974 0.9991 ICBGEx2_000117 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F08 compound treatment 464852.459 -167000.0 -0.77 594744.4444 3230.0 0.02 -0.5321 -0.6912 ICBGEx2_000118 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F09 compound treatment 631396.2963 -339.0 0.0 636815.261 45300.0 0.24 0.1688 0.7025 ICBGEx2_000119 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F10 compound treatment 545029.304 -86700.0 -0.4 658813.0435 67300.0 0.36 -0.0303 -0.0566 ICBGEx2_000120 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F11 compound treatment 752881.3559 121000.0 0.56 722201.7544 131000.0 0.69 0.8852 0.9943 ICBGEx2_000121 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F12 compound treatment 504916.6667 -127000.0 -0.58 621095.4774 29600.0 0.16 -0.3026 -0.4998 ICBGEx2_000122 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F13 compound treatment 615435.8974 -16300.0 -0.08 599776.699 8260.0 0.04 -0.0222 -0.2549 ICBGEx2_000123 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F14 compound treatment 540204.5455 -91500.0 -0.42 620957.7465 29400.0 0.16 -0.1881 -0.4178 ICBGEx2_000124 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F15 compound treatment 632392.2414 657.0 0.0 631151.0417 39600.0 0.21 0.1508 0.7172 ICBGEx2_000125 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F16 compound treatment 539548.5232 -92200.0 -0.43 508923.445 -82600.0 -0.44 -0.6104 -0.9999 ICBGEx2_000126 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F17 compound treatment 526080.6452 -106000.0 -0.49 608372.2944 16900.0 0.09 -0.2813 -0.5679 ICBGEx2_000127 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F18 compound treatment 402831.3725 -229000.0 -1.06 389623.8938 -202000.0 -1.07 -1.5036 -1.0 ICBGEx2_000128 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F19 compound treatment 641433.4471 9700.0 0.04 587890.1515 -3630.0 -0.02 0.018 0.3702 ICBGEx2_000129 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F20 compound treatment 589112.9568 -42600.0 -0.2 553878.2895 -37600.0 -0.2 -0.2802 -1.0 ICBGEx2_000130 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F21 compound treatment 511312.6935 -120000.0 -0.56 541831.5018 -49700.0 -0.26 -0.579 -0.942 ICBGEx2_000131 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F22 compound treatment 584732.7586 -47000.0 -0.22 562436.4407 -29100.0 -0.15 -0.2623 -0.9861 ICBGEx2_000132 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F23 mock treatment 595613.9241 -36100.0 -0.17 579342.1053 -12200.0 -0.06 -0.1635 -0.9149 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 F24 mock treatment 700024.6154 68300.0 0.31 548620.1923 -42900.0 -0.23 0.0618 0.1591 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G01 compound treatment 598054.0541 -33700.0 -0.16 584955.4455 -6560.0 -0.03 -0.1344 -0.8446 ICBGEx2_000133 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G02 compound treatment 609755.7604 -22000.0 -0.1 645025.0 53500.0 0.28 0.129 0.4281 ICBGEx2_000134 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G03 compound treatment 664943.128 33200.0 0.15 751795.9184 160000.0 0.85 0.7094 0.8213 ICBGEx2_000135 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G04 compound treatment 787147.6793 155000.0 0.72 620100.0 28600.0 0.15 0.614 0.8381 ICBGEx2_000136 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G05 compound treatment 665382.0755 33600.0 0.16 637240.7407 45700.0 0.24 0.2812 0.9767 ICBGEx2_000137 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G06 compound treatment 517504.4643 -114000.0 -0.53 535082.9268 -56400.0 -0.3 -0.5842 -0.9641 ICBGEx2_000138 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G07 compound treatment 495774.1935 -136000.0 -0.63 543026.7857 -48500.0 -0.26 -0.6252 -0.9226 ICBGEx2_000139 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G08 compound treatment 584712.4183 -47000.0 -0.22 605988.417 14500.0 0.08 -0.0991 -0.4306 ICBGEx2_000140 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G09 compound treatment 540147.0588 -91600.0 -0.42 541550.6073 -50000.0 -0.27 -0.4861 -0.9748 ICBGEx2_000141 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G10 compound treatment 528136.8421 -104000.0 -0.48 478941.8605 -113000.0 -0.6 -0.76 -0.9939 ICBGEx2_000142 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G11 compound treatment 620416.0 -11300.0 -0.05 671257.6923 79700.0 0.42 0.2622 0.6152 ICBGEx2_000143 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G12 compound treatment 586567.3077 -45200.0 -0.21 549363.2287 -42200.0 -0.22 -0.3054 -0.9994 ICBGEx2_000144 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G13 compound treatment 519488.2353 -112000.0 -0.52 530924.3243 -60600.0 -0.32 -0.5933 -0.9737 ICBGEx2_000145 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G14 compound treatment 460245.614 -171000.0 -0.79 491027.027 -100000.0 -0.53 -0.9361 -0.9816 ICBGEx2_000146 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G15 compound treatment 595448.8889 -36300.0 -0.17 554418.41 -37100.0 -0.2 -0.2575 -0.9967 ICBGEx2_000147 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G16 compound treatment 522918.2879 -109000.0 -0.5 523855.7047 -67700.0 -0.36 -0.6086 -0.9865 ICBGEx2_000148 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G17 compound treatment 535501.8727 -96200.0 -0.44 401966.9967 -190000.0 -1.01 -1.0247 -0.9324 ICBGEx2_000149 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G18 compound treatment 402324.4275 -229000.0 -1.06 381870.1923 -210000.0 -1.11 -1.5344 -0.9997 ICBGEx2_000150 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G19 compound treatment 557982.5328 -73800.0 -0.34 416845.7447 -175000.0 -0.93 -0.8956 -0.9075 ICBGEx2_000151 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G20 compound treatment 446397.9592 -185000.0 -0.85 449308.4112 -142000.0 -0.75 -1.1377 -0.9981 ICBGEx2_000152 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G21 compound treatment 529362.6374 -102000.0 -0.47 509727.6995 -81800.0 -0.43 -0.6406 -0.9991 ICBGEx2_000153 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G22 compound treatment 605476.1905 -26300.0 -0.12 611123.1527 19600.0 0.1 -0.0121 -0.0758 ICBGEx2_000154 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G23 mock treatment 602049.8084 -29700.0 -0.14 608359.6059 16800.0 0.09 -0.0336 -0.2058 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 G24 mock treatment 602703.9474 -29000.0 -0.13 457576.5766 -134000.0 -0.71 -0.597 -0.8258 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H01 compound treatment 353356.4356 -278000.0 -1.28 333704.0816 -258000.0 -1.37 -1.8747 -0.9995 ICBGEx2_000155 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H02 compound treatment 757666.6667 126000.0 0.58 793763.285 202000.0 1.07 1.1692 0.9585 ICBGEx2_000156 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H03 compound treatment 698436.019 66700.0 0.31 764032.5581 173000.0 0.92 0.8645 0.8956 ICBGEx2_000157 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H04 compound treatment 538519.4175 -93200.0 -0.43 440206.0302 -151000.0 -0.8 -0.8715 -0.9572 ICBGEx2_000158 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H05 compound treatment 569555.0239 -62200.0 -0.29 535919.8113 -55600.0 -0.29 -0.4113 -0.9999 ICBGEx2_000159 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H06 compound treatment 338268.0851 -293000.0 -1.35 389980.5825 -202000.0 -1.07 -1.7128 -0.9932 ICBGEx2_000160 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H07 compound treatment 610060.1504 -21700.0 -0.1 709121.9512 118000.0 0.62 0.3704 0.5863 ICBGEx2_000161 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H08 compound treatment 648094.4206 16400.0 0.08 702610.8597 111000.0 0.59 0.47 0.7912 ICBGEx2_000162 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H09 compound treatment 540600.0 -91100.0 -0.42 568439.3939 -23100.0 -0.12 -0.3837 -0.8766 ICBGEx2_000163 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H10 compound treatment 580150.0 -51600.0 -0.24 454879.5812 -137000.0 -0.72 -0.6807 -0.8924 ICBGEx2_000164 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H11 compound treatment 321225.8065 -311000.0 -1.43 348451.6129 -243000.0 -1.29 -1.9242 -0.9986 ICBGEx2_000165 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H12 compound treatment 624108.7719 -7630.0 -0.04 567348.6239 -24200.0 -0.13 -0.1155 -0.869 ICBGEx2_000166 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H13 compound treatment 598059.322 -33700.0 -0.16 561279.3296 -30200.0 -0.16 -0.2232 -0.9999 ICBGEx2_000167 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H14 compound treatment 416283.6879 -215000.0 -0.99 333216.2162 -258000.0 -1.37 -1.6713 -0.9876 ICBGEx2_000168 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H15 compound treatment 467848.6239 -164000.0 -0.76 492895.0 -98600.0 -0.52 -0.9043 -0.9838 ICBGEx2_000169 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H16 compound treatment 539895.6835 -91800.0 -0.42 507142.2764 -84400.0 -0.45 -0.6159 -0.9996 ICBGEx2_000170 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H17 compound treatment 568048.4429 -63700.0 -0.29 501403.9216 -90100.0 -0.48 -0.5456 -0.9727 ICBGEx2_000171 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H18 compound treatment 509149.1228 -123000.0 -0.57 483040.9836 -108000.0 -0.58 -0.8066 -1.0 ICBGEx2_000172 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H19 compound treatment 451571.8654 -180000.0 -0.83 520449.2754 -71100.0 -0.38 -0.854 -0.9361 ICBGEx2_000173 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H20 compound treatment 547240.0 -84500.0 -0.39 529049.4297 -62500.0 -0.33 -0.5098 -0.9967 ICBGEx2_000174 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H21 compound treatment 624714.2857 -7020.0 -0.03 439325.2033 -152000.0 -0.81 -0.5937 -0.7349 ICBGEx2_000175 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H22 compound treatment 337846.1538 -294000.0 -1.36 348752.4272 -243000.0 -1.29 -1.8688 -0.9997 ICBGEx2_000176 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H23 mock treatment 538636.3636 -93100.0 -0.43 480011.236 -112000.0 -0.59 -0.7218 -0.9876 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 H24 mock treatment 536822.7273 -94900.0 -0.44 500186.0465 -91300.0 -0.48 -0.652 -0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I01 compound treatment 541885.2459 -89900.0 -0.41 560988.8268 -30500.0 -0.16 -0.4075 -0.916 ICBGEx2_000177 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I02 compound treatment 532325.5814 -99400.0 -0.46 645495.283 54000.0 0.29 -0.1217 -0.2252 ICBGEx2_000178 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I03 compound treatment 565651.2605 -66100.0 -0.3 609847.2906 18300.0 0.1 -0.1467 -0.4587 ICBGEx2_000179 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I04 compound treatment 852866.6667 221000.0 1.02 708347.6395 117000.0 0.62 1.1593 0.9715 ICBGEx2_000180 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I05 compound treatment 547702.509 -84000.0 -0.39 621953.7037 30400.0 0.16 -0.1599 -0.3808 ICBGEx2_000181 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I06 compound treatment 539958.6777 -91800.0 -0.42 692724.4094 101000.0 0.54 0.0803 0.1175 ICBGEx2_000182 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I07 compound treatment 450070.4225 -182000.0 -0.84 89740.0 -502000.0 -2.66 -2.4743 -0.8868 ICBGEx2_000183 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I08 compound treatment 711014.5631 79300.0 0.37 545748.6631 -45800.0 -0.24 0.0869 0.1979 ICBGEx2_000184 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I09 compound treatment 651502.3041 19800.0 0.09 555690.9871 -35800.0 -0.19 -0.0699 -0.3317 ICBGEx2_000185 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I10 compound treatment 583890.2439 -47800.0 -0.22 631665.0246 40100.0 0.21 -0.0054 -0.0178 ICBGEx2_000186 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I11 compound treatment 213490.9091 -418000.0 -1.93 278178.5714 -313000.0 -1.66 -2.539 -0.9972 ICBGEx2_000187 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I12 compound treatment 695856.5022 64100.0 0.3 625264.4628 33700.0 0.18 0.3357 0.9711 ICBGEx2_000188 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I13 compound treatment 53086.9565 -579000.0 -2.67 57918.3674 -534000.0 -2.83 -3.8882 -0.9996 ICBGEx2_000189 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I14 compound treatment 583835.7488 -47900.0 -0.22 601760.9756 10200.0 0.05 -0.1178 -0.5177 ICBGEx2_000190 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I15 compound treatment 78673.4694 -553000.0 -2.55 69479.1667 -522000.0 -2.77 -3.7614 -0.9992 ICBGEx2_000191 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I16 compound treatment 464111.1111 -168000.0 -0.77 390759.0361 -201000.0 -1.06 -1.2996 -0.9876 ICBGEx2_000192 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I17 compound treatment 629722.2222 -2010.0 -0.01 567609.2437 -23900.0 -0.13 -0.0962 -0.7569 ICBGEx2_000193 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I18 compound treatment 536948.0 -94800.0 -0.44 498437.7358 -93100.0 -0.49 -0.6582 -0.9982 ICBGEx2_000194 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I19 compound treatment 592225.2252 -39500.0 -0.18 479340.1015 -112000.0 -0.59 -0.5496 -0.8832 ICBGEx2_000195 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I20 compound treatment 568900.5525 -62800.0 -0.29 661580.0866 70100.0 0.37 0.0579 0.1228 ICBGEx2_000196 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I21 compound treatment 680307.6923 48600.0 0.22 581577.2358 -9940.0 -0.05 0.1211 0.5263 ICBGEx2_000197 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I22 compound treatment 709527.3438 77800.0 0.36 587884.9206 -3630.0 -0.02 0.2401 0.6682 ICBGEx2_000198 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I23 mock treatment 541110.5528 -90600.0 -0.42 705062.7803 114000.0 0.6 0.1303 0.1778 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 I24 mock treatment 537074.3802 -94700.0 -0.44 542619.7917 -48900.0 -0.26 -0.4921 -0.9691 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J01 compound treatment 586164.7727 -45600.0 -0.21 556447.205 -35100.0 -0.19 -0.2801 -0.9981 ICBGEx2_000199 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J02 compound treatment 398770.6422 -233000.0 -1.07 431160.0 -160000.0 -0.85 -1.3611 -0.9933 ICBGEx2_000200 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J03 compound treatment 809715.0 178000.0 0.82 626138.8889 34600.0 0.18 0.7102 0.8444 ICBGEx2_000201 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J04 compound treatment 491990.991 -140000.0 -0.64 641595.6522 50100.0 0.27 -0.2679 -0.3843 ICBGEx2_000202 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J05 compound treatment 875718.3673 244000.0 1.13 808388.2353 217000.0 1.15 1.609 0.9999 ICBGEx2_000203 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J06 compound treatment 638979.7571 7240.0 0.03 593228.4264 1710.0 0.01 0.03 0.8678 ICBGEx2_000204 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J07 compound treatment 790151.2027 158000.0 0.73 612368.8525 20900.0 0.11 0.5948 0.805 ICBGEx2_000205 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J08 compound treatment 650079.646 18300.0 0.08 740691.0569 149000.0 0.79 0.6193 0.7783 ICBGEx2_000206 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J09 compound treatment 358617.6471 -273000.0 -1.26 415134.6154 -176000.0 -0.94 -1.5521 -0.9893 ICBGEx2_000207 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J10 compound treatment 255025.974 -377000.0 -1.74 59462.6866 -532000.0 -2.82 -3.2239 -0.9728 ICBGEx2_000208 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J11 compound treatment 695296.8037 63600.0 0.29 518336.8421 -73200.0 -0.39 -0.0672 -0.1381 ICBGEx2_000209 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J12 compound treatment 515546.798 -116000.0 -0.54 518205.8824 -73300.0 -0.39 -0.6538 -0.9876 ICBGEx2_000210 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J13 compound treatment 564290.3226 -67400.0 -0.31 575187.8173 -16300.0 -0.09 -0.2812 -0.8709 ICBGEx2_000211 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J14 compound treatment 739523.0126 108000.0 0.5 714174.0741 123000.0 0.65 0.8115 0.9912 ICBGEx2_000212 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J15 compound treatment 621309.9631 -10400.0 -0.05 613546.0993 22000.0 0.12 0.0486 0.3848 ICBGEx2_000213 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J16 compound treatment 460122.8814 -172000.0 -0.79 511912.1339 -79600.0 -0.42 -0.8582 -0.9567 ICBGEx2_000214 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J17 compound treatment 533416.0305 -98300.0 -0.45 436172.4138 -155000.0 -0.82 -0.9032 -0.9604 ICBGEx2_000215 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J18 compound treatment 78163.6364 -554000.0 -2.55 82375.0 -509000.0 -2.7 -3.7147 -0.9996 ICBGEx2_000216 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J19 compound treatment 372814.8148 -259000.0 -1.19 460304.7619 -131000.0 -0.7 -1.3364 -0.967 ICBGEx2_000217 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J20 compound treatment 89400.0 -542000.0 -2.5 467474.6835 -124000.0 -0.66 -2.2337 -0.8637 ICBGEx2_000218 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J21 compound treatment 629119.8157 -2620.0 -0.01 661755.0 70200.0 0.37 0.2549 0.6839 ICBGEx2_000219 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J22 compound treatment 618276.3636 -13500.0 -0.06 574493.0876 -17000.0 -0.09 -0.1077 -0.9833 ICBGEx2_000220 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J23 mock treatment 549926.2295 -81800.0 -0.38 646543.379 55000.0 0.29 -0.0604 -0.1266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 J24 mock treatment 567613.4454 -64100.0 -0.3 538330.0493 -53200.0 -0.28 -0.4086 -0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K01 compound treatment 595980.0 -35800.0 -0.16 682131.1475 90600.0 0.48 0.2233 0.4394 ICBGEx2_000221 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K02 compound treatment 736929.5154 105000.0 0.49 822865.5462 231000.0 1.23 1.2107 0.9176 ICBGEx2_000222 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K03 compound treatment 857146.9388 225000.0 1.04 762313.253 171000.0 0.91 1.3756 0.9976 ICBGEx2_000223 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K04 compound treatment 714603.3058 82900.0 0.38 586474.1784 -5040.0 -0.03 0.2513 0.656 ICBGEx2_000224 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K05 compound treatment 733974.359 102000.0 0.47 694504.2017 103000.0 0.55 0.7196 0.9973 ICBGEx2_000225 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K06 compound treatment 665368.2432 33600.0 0.16 666180.6723 74700.0 0.4 0.3897 0.9163 ICBGEx2_000226 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K07 compound treatment 435492.4623 -196000.0 -0.91 557219.3878 -34300.0 -0.18 -0.7686 -0.8326 ICBGEx2_000227 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K08 compound treatment 425780.4878 -206000.0 -0.95 461434.3891 -130000.0 -0.69 -1.1595 -0.9877 ICBGEx2_000228 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K09 compound treatment 743172.043 111000.0 0.51 425474.5763 -166000.0 -0.88 -0.2594 -0.2544 ICBGEx2_000229 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K10 compound treatment 385690.7216 -246000.0 -1.13 446439.1534 -145000.0 -0.77 -1.3464 -0.9821 ICBGEx2_000230 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K11 compound treatment 652285.1986 20500.0 0.09 626509.8814 35000.0 0.19 0.1983 0.9513 ICBGEx2_000231 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K12 compound treatment 782235.5372 150000.0 0.69 638150.0 46600.0 0.25 0.6657 0.9034 ICBGEx2_000232 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K13 compound treatment 639239.6313 7500.0 0.03 588331.6583 -3190.0 -0.02 0.0125 0.3252 ICBGEx2_000233 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K14 compound treatment 550792.0792 -80900.0 -0.37 623406.5421 31900.0 0.17 -0.1443 -0.3522 ICBGEx2_000234 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K15 compound treatment 644442.2442 12700.0 0.06 531669.2015 -59800.0 -0.32 -0.183 -0.567 ICBGEx2_000235 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K16 compound treatment 631419.3548 -316.0 0.0 550771.3178 -40700.0 -0.22 -0.1538 -0.7119 ICBGEx2_000236 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K17 compound treatment 657590.0383 25900.0 0.12 577735.786 -13800.0 -0.07 0.0326 0.2333 ICBGEx2_000237 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K18 compound treatment 517441.6667 -114000.0 -0.53 495804.3478 -95700.0 -0.51 -0.7317 -0.9998 ICBGEx2_000238 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K19 compound treatment 702216.5354 70500.0 0.33 643247.012 51700.0 0.27 0.4238 0.9964 ICBGEx2_000239 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K20 compound treatment 697330.0 65600.0 0.3 549464.9123 -42100.0 -0.22 0.0562 0.1495 ICBGEx2_000240 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K21 compound treatment 541057.2917 -90700.0 -0.42 646954.7511 55400.0 0.29 -0.0878 -0.1717 ICBGEx2_000241 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K22 compound treatment 407405.7971 -224000.0 -1.03 333500.0 -258000.0 -1.37 -1.6992 -0.9905 ICBGEx2_000242 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K23 mock treatment 585331.7757 -46400.0 -0.21 588936.9369 -2580.0 -0.01 -0.161 -0.7508 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 K24 mock treatment 625368.6869 -6370.0 -0.03 615376.8116 23900.0 0.13 0.0687 0.529 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L01 compound treatment 772897.0588 141000.0 0.65 706674.7573 115000.0 0.61 0.8922 0.9995 ICBGEx2_000243 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L02 compound treatment 625654.8223 -6080.0 -0.03 718000.0 126000.0 0.67 0.4545 0.677 ICBGEx2_000244 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L03 compound treatment 1064459.016 433000.0 2.0 882278.0083 291000.0 1.54 2.5016 0.9919 ICBGEx2_000245 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L04 compound treatment 817908.3665 186000.0 0.86 838223.9382 247000.0 1.31 1.5324 0.9791 ICBGEx2_000246 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L05 compound treatment 891504.0323 260000.0 1.2 780424.7788 189000.0 1.0 1.5556 0.9961 ICBGEx2_000247 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L06 compound treatment 539530.6122 -92200.0 -0.43 593626.2626 2110.0 0.01 -0.2928 -0.6883 ICBGEx2_000248 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L07 compound treatment 480608.2474 -151000.0 -0.7 424144.2308 -167000.0 -0.89 -1.1205 -0.9928 ICBGEx2_000249 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L08 compound treatment 721825.7576 90100.0 0.42 755634.3284 164000.0 0.87 0.9093 0.9427 ICBGEx2_000250 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L09 compound treatment 922547.619 291000.0 1.34 686896.2264 95400.0 0.51 1.306 0.9112 ICBGEx2_000251 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L10 compound treatment 569966.1836 -61800.0 -0.28 600237.1134 8720.0 0.05 -0.1687 -0.5846 ICBGEx2_000252 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L11 compound treatment 725051.7241 93300.0 0.43 673829.7872 82300.0 0.44 0.613 1.0 ICBGEx2_000253 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L12 compound treatment 719903.8462 88200.0 0.41 636780.6691 45300.0 0.24 0.4573 0.9684 ICBGEx2_000254 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L13 compound treatment 852316.1765 221000.0 1.02 756053.0612 165000.0 0.87 1.3364 0.9971 ICBGEx2_000255 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L14 compound treatment 485474.6544 -146000.0 -0.67 443155.6604 -148000.0 -0.79 -1.0334 -0.9971 ICBGEx2_000256 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L15 compound treatment 740263.8889 109000.0 0.5 616897.0588 25400.0 0.13 0.4491 0.8665 ICBGEx2_000257 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L16 compound treatment 713054.7945 81300.0 0.38 624371.4286 32900.0 0.17 0.3884 0.9392 ICBGEx2_000258 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L17 compound treatment 506408.6022 -125000.0 -0.58 556948.9796 -34600.0 -0.18 -0.5383 -0.8878 ICBGEx2_000259 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L18 compound treatment 583228.3737 -48500.0 -0.22 552435.9862 -39100.0 -0.21 -0.3048 -0.9993 ICBGEx2_000260 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L19 compound treatment 613341.6149 -18400.0 -0.08 665366.9065 73800.0 0.39 0.217 0.5414 ICBGEx2_000261 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L20 compound treatment 596798.3539 -34900.0 -0.16 583596.6387 -7920.0 -0.04 -0.1436 -0.8626 ICBGEx2_000262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L21 compound treatment 644129.7071 12400.0 0.06 519590.7336 -71900.0 -0.38 -0.2293 -0.5945 ICBGEx2_000263 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L22 compound treatment 649323.5294 17600.0 0.08 586190.4762 -5330.0 -0.03 0.0374 0.4352 ICBGEx2_000264 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L23 mock treatment 613246.2687 -18500.0 -0.09 635510.9489 44000.0 0.23 0.1047 0.4215 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 L24 mock treatment 580908.7452 -50800.0 -0.23 578000.0 -13500.0 -0.07 -0.2164 -0.883 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M01 compound treatment 620184.6847 -11600.0 -0.05 710047.2103 119000.0 0.63 0.4069 0.6449 ICBGEx2_000265 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M02 compound treatment 617663.7555 -14100.0 -0.06 607040.0 15500.0 0.08 0.0123 0.1176 ICBGEx2_000266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M03 compound treatment 768420.1681 137000.0 0.63 849147.619 258000.0 1.37 1.412 0.9383 ICBGEx2_000267 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M04 compound treatment 816164.1221 184000.0 0.85 721372.0 130000.0 0.69 1.0884 0.9945 ICBGEx2_000268 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M05 compound treatment 708011.3208 76300.0 0.35 709889.7638 118000.0 0.63 0.6927 0.9625 ICBGEx2_000269 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M06 compound treatment 584610.0917 -47100.0 -0.22 275303.0303 -316000.0 -1.68 -1.3396 -0.7921 ICBGEx2_000270 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M07 compound treatment 572373.2719 -59400.0 -0.27 640017.7778 48500.0 0.26 -0.0117 -0.0311 ICBGEx2_000271 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M08 compound treatment 87260.0 -544000.0 -2.51 114905.6604 -477000.0 -2.53 -3.563 -1.0 ICBGEx2_000272 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M09 compound treatment 660709.9237 29000.0 0.13 528493.1507 -63000.0 -0.33 -0.1419 -0.3941 ICBGEx2_000273 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M10 compound treatment 636123.8095 4390.0 0.02 692005.4945 100000.0 0.53 0.3912 0.7334 ICBGEx2_000274 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M11 compound treatment 601242.4242 -30500.0 -0.14 523040.9836 -68500.0 -0.36 -0.3563 -0.9147 ICBGEx2_000275 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M12 compound treatment 603067.3575 -28700.0 -0.13 529657.4586 -61900.0 -0.33 -0.3255 -0.9201 ICBGEx2_000276 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M13 compound treatment 688153.0249 56400.0 0.26 570829.8611 -20700.0 -0.11 0.1064 0.3768 ICBGEx2_000277 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M14 compound treatment 631938.8489 203.0 0.0 641483.1461 50000.0 0.27 0.1881 0.7096 ICBGEx2_000278 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M15 compound treatment 560056.338 -71700.0 -0.33 529877.1186 -61600.0 -0.33 -0.4649 -1.0 ICBGEx2_000279 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M16 compound treatment 481962.5 -150000.0 -0.69 421390.8046 -170000.0 -0.9 -1.1265 -0.9913 ICBGEx2_000280 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M17 compound treatment 641230.7692 9500.0 0.04 468946.8085 -123000.0 -0.65 -0.4287 -0.658 ICBGEx2_000281 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M18 compound treatment 589247.2527 -42500.0 -0.2 583126.2626 -8390.0 -0.04 -0.17 -0.8462 ICBGEx2_000282 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M19 compound treatment 560730.4965 -71000.0 -0.33 512739.4366 -78800.0 -0.42 -0.527 -0.9927 ICBGEx2_000283 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M20 compound treatment 569592.9204 -62100.0 -0.29 529441.1765 -62100.0 -0.33 -0.4355 -0.9976 ICBGEx2_000284 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M21 compound treatment 626711.8644 -5020.0 -0.02 555258.1818 -36300.0 -0.19 -0.1524 -0.7866 ICBGEx2_000285 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M22 compound treatment 599762.4521 -32000.0 -0.15 512741.8182 -78800.0 -0.42 -0.3997 -0.9021 ICBGEx2_000286 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M23 mock treatment 544073.3945 -87700.0 -0.4 484165.9574 -107000.0 -0.57 -0.6885 -0.9859 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 M24 mock treatment 551107.1429 -80600.0 -0.37 522077.6699 -69400.0 -0.37 -0.5234 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N01 compound treatment 747134.8837 115000.0 0.53 798068.8073 207000.0 1.1 1.151 0.945 ICBGEx2_000287 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N02 compound treatment 652204.4444 20500.0 0.09 730802.3952 139000.0 0.74 0.5891 0.791 ICBGEx2_000288 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N03 compound treatment 841111.9691 209000.0 0.97 879813.0435 288000.0 1.53 1.764 0.9754 ICBGEx2_000289 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N04 compound treatment 574510.7527 -57200.0 -0.26 411790.9091 -180000.0 -0.95 -0.8607 -0.8701 ICBGEx2_000290 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N05 compound treatment 438009.5238 -194000.0 -0.89 418981.6514 -173000.0 -0.92 -1.2788 -0.9999 ICBGEx2_000291 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N06 compound treatment 782658.6538 151000.0 0.7 542785.3403 -48700.0 -0.26 0.3094 0.4167 ICBGEx2_000292 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N07 compound treatment 668919.598 37200.0 0.17 603887.7005 12400.0 0.07 0.1676 0.9131 ICBGEx2_000293 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N08 compound treatment 715607.4766 83900.0 0.39 623323.8095 31800.0 0.17 0.3928 0.9308 ICBGEx2_000294 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N09 compound treatment 796224.1379 164000.0 0.76 604559.8291 13000.0 0.07 0.5853 0.7684 ICBGEx2_000295 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N10 compound treatment 960274.3682 329000.0 1.52 840631.1787 249000.0 1.32 2.0056 0.9977 ICBGEx2_000296 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N11 compound treatment 820641.4343 189000.0 0.87 670910.1124 79400.0 0.42 0.9138 0.9444 ICBGEx2_000297 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N12 compound treatment 547766.5198 -84000.0 -0.39 502509.009 -89000.0 -0.47 -0.6076 -0.9952 ICBGEx2_000298 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N13 compound treatment 789300.813 158000.0 0.73 677461.2069 85900.0 0.46 0.8361 0.9748 ICBGEx2_000299 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N14 compound treatment 458725.4902 -173000.0 -0.8 359515.7895 -232000.0 -1.23 -1.4343 -0.978 ICBGEx2_000300 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N15 compound treatment 474925.5319 -157000.0 -0.72 416518.8679 -175000.0 -0.93 -1.1677 -0.9924 ICBGEx2_000301 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N16 compound treatment 616994.8718 -14700.0 -0.07 635023.2558 43500.0 0.23 0.1151 0.4785 ICBGEx2_000302 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N17 compound treatment 865875.0 234000.0 1.08 800197.1831 209000.0 1.11 1.5462 0.9999 ICBGEx2_000303 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N18 compound treatment 623748.6631 -7990.0 -0.04 549601.0638 -41900.0 -0.22 -0.1833 -0.8132 ICBGEx2_000304 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N19 compound treatment 534870.1923 -96900.0 -0.45 510132.0755 -81400.0 -0.43 -0.6211 -0.9999 ICBGEx2_000305 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N20 compound treatment 654485.0498 22700.0 0.1 564074.4337 -27400.0 -0.15 -0.0287 -0.1602 ICBGEx2_000306 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N21 compound treatment 607967.1533 -23800.0 -0.11 485013.6054 -107000.0 -0.56 -0.4769 -0.8289 ICBGEx2_000307 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N22 compound treatment 461683.7607 -170000.0 -0.78 612018.2648 20500.0 0.11 -0.4776 -0.6033 ICBGEx2_000308 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N23 mock treatment 537585.1528 -94200.0 -0.43 498886.5979 -92600.0 -0.49 -0.6544 -0.9981 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 N24 mock treatment 576777.2926 -55000.0 -0.25 577454.1284 -14100.0 -0.07 -0.232 -0.878 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O01 compound treatment 418518.9873 -213000.0 -0.98 473226.4957 -118000.0 -0.63 -1.1389 -0.9765 ICBGEx2_000309 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O02 compound treatment 579738.5892 -52000.0 -0.24 629608.1081 38100.0 0.2 -0.0267 -0.0851 ICBGEx2_000310 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O03 compound treatment 590505.0 -41200.0 -0.19 571684.6847 -19800.0 -0.11 -0.2088 -0.961 ICBGEx2_000311 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O04 compound treatment 486133.3333 -146000.0 -0.67 513965.5172 -77600.0 -0.41 -0.7657 -0.9723 ICBGEx2_000312 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O05 compound treatment 652871.1111 21100.0 0.1 756108.7719 165000.0 0.87 0.6862 0.7812 ICBGEx2_000313 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O06 compound treatment 659511.7188 27800.0 0.13 592962.5 1450.0 0.01 0.096 0.7481 ICBGEx2_000314 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O07 compound treatment 828363.6364 197000.0 0.91 665468.75 74000.0 0.39 0.9185 0.9297 ICBGEx2_000315 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O08 compound treatment 649682.8194 17900.0 0.08 545227.4882 -46300.0 -0.25 -0.1151 -0.4442 ICBGEx2_000316 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O09 compound treatment 715311.4754 83600.0 0.39 600828.5714 9310.0 0.05 0.3075 0.7912 ICBGEx2_000317 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O10 compound treatment 661679.0698 29900.0 0.14 592106.4639 589.0 0.0 0.0999 0.7229 ICBGEx2_000318 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O11 compound treatment 678138.7755 46400.0 0.21 569533.0882 -22000.0 -0.12 0.0689 0.2826 ICBGEx2_000319 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O12 compound treatment 627857.7982 -3880.0 -0.02 573477.6786 -18000.0 -0.1 -0.0803 -0.825 ICBGEx2_000320 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O13 compound treatment 658506.5502 26800.0 0.12 610147.8599 18600.0 0.1 0.1572 0.9939 ICBGEx2_000321 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O14 compound treatment 562170.5882 -69600.0 -0.32 507466.2921 -84100.0 -0.45 -0.5421 -0.987 ICBGEx2_000322 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O15 compound treatment 402272.7273 -229000.0 -1.06 437322.2749 -154000.0 -0.82 -1.3266 -0.9919 ICBGEx2_000323 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O16 compound treatment 525017.7515 -107000.0 -0.49 440480.4469 -151000.0 -0.8 -0.9145 -0.9726 ICBGEx2_000324 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O17 compound treatment 608468.2927 -23300.0 -0.11 633456.4103 41900.0 0.22 0.0814 0.3297 ICBGEx2_000325 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O18 compound treatment 678928.0303 47200.0 0.22 654867.7686 63400.0 0.34 0.3915 0.9779 ICBGEx2_000326 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O19 compound treatment 641054.8523 9320.0 0.04 527665.1786 -63900.0 -0.34 -0.2091 -0.6125 ICBGEx2_000327 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O20 compound treatment 586779.4118 -45000.0 -0.21 539206.8966 -52300.0 -0.28 -0.3428 -0.9897 ICBGEx2_000328 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O21 compound treatment 651332.1168 19600.0 0.09 622594.7955 31100.0 0.16 0.1805 0.96 ICBGEx2_000329 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O22 compound treatment 584800.738 -46900.0 -0.22 557712.8378 -33800.0 -0.18 -0.2798 -0.9956 ICBGEx2_000330 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O23 mock treatment 515525.2101 -116000.0 -0.54 818100.5025 227000.0 1.2 0.4708 0.3578 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 O24 mock treatment 857031.25 225000.0 1.04 495343.2836 -96200.0 -0.51 0.374 0.3231 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P01 compound treatment 594506.4935 -37200.0 -0.17 726906.5934 135000.0 0.72 0.3864 0.5233 ICBGEx2_000331 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P02 compound treatment 369740.458 -262000.0 -1.21 305305.5556 -286000.0 -1.52 -1.9278 -0.9936 ICBGEx2_000332 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P03 compound treatment 696672.1311 64900.0 0.3 660005.4054 68500.0 0.36 0.4686 0.9954 ICBGEx2_000333 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P04 compound treatment 641380.0 9640.0 0.04 646793.9698 55300.0 0.29 0.2388 0.8052 ICBGEx2_000334 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P05 compound treatment 660612.3348 28900.0 0.13 676684.6473 85200.0 0.45 0.4136 0.8782 ICBGEx2_000335 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P06 compound treatment 538251.2563 -93500.0 -0.43 566079.2079 -25400.0 -0.13 -0.4002 -0.886 ICBGEx2_000336 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P07 compound treatment 862112.0332 230000.0 1.06 684254.3554 92700.0 0.49 1.099 0.9388 ICBGEx2_000337 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P08 compound treatment 722082.3529 90300.0 0.42 589606.8376 -1910.0 -0.01 0.2874 0.6897 ICBGEx2_000338 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P09 compound treatment 547764.7059 -84000.0 -0.39 420114.2857 -171000.0 -0.91 -0.9167 -0.9277 ICBGEx2_000339 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P10 compound treatment 417796.748 -214000.0 -0.99 413916.6667 -178000.0 -0.94 -1.3637 -0.9997 ICBGEx2_000340 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P11 compound treatment 670628.3186 38900.0 0.18 633206.0086 41700.0 0.22 0.2832 0.9946 ICBGEx2_000341 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P12 compound treatment 700668.1223 68900.0 0.32 649514.7059 58000.0 0.31 0.4423 0.9999 ICBGEx2_000342 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P13 compound treatment 634868.6869 3130.0 0.01 524963.9175 -66600.0 -0.35 -0.2394 -0.6776 ICBGEx2_000343 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P14 compound treatment 557587.9397 -74100.0 -0.34 508698.5646 -82800.0 -0.44 -0.5524 -0.9923 ICBGEx2_000344 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P15 compound treatment 625465.0206 -6270.0 -0.03 535611.6071 -55900.0 -0.3 -0.2301 -0.7724 ICBGEx2_000345 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P16 compound treatment 618047.0085 -13700.0 -0.06 661384.0304 69900.0 0.37 0.2174 0.5783 ICBGEx2_000346 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P17 compound treatment 708367.7686 76600.0 0.35 545833.9623 -45700.0 -0.24 0.0786 0.1833 ICBGEx2_000347 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P18 compound treatment 571137.4046 -60600.0 -0.28 523444.8819 -68100.0 -0.36 -0.4529 -0.992 ICBGEx2_000348 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P19 compound treatment 709748.9362 78000.0 0.36 541463.8783 -50100.0 -0.27 0.0667 0.1491 ICBGEx2_000349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P20 compound treatment 448009.009 -184000.0 -0.85 522542.0561 -69000.0 -0.37 -0.8578 -0.9295 ICBGEx2_000350 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P21 compound treatment 525209.1837 -107000.0 -0.49 425300.885 -166000.0 -0.88 -0.9708 -0.9619 ICBGEx2_000351 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P22 compound treatment 509441.6667 -122000.0 -0.56 542875.0 -48600.0 -0.26 -0.5812 -0.9372 ICBGEx2_000352 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P23 mock treatment 764949.6568 133000.0 0.61 764821.3508 173000.0 0.92 1.0844 0.9808 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2091 P24 mock treatment 804330.8458 173000.0 0.8 731520.8333 140000.0 0.74 1.0879 0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A01 compound treatment 581930.7359 -83900.0 -0.39 598912.5 -112000.0 -0.6 -0.6954 -0.978 ICBGEx2_000353 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A02 compound treatment 639441.4894 -26400.0 -0.12 495529.4118 -216000.0 -1.14 -0.8956 -0.7779 ICBGEx2_000354 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A03 compound treatment 727715.5556 61900.0 0.29 769193.6937 57800.0 0.31 0.4186 0.9994 ICBGEx2_000355 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A04 compound treatment 776480.3493 111000.0 0.51 964419.7531 253000.0 1.34 1.3098 0.9123 ICBGEx2_000356 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A05 compound treatment 613720.6704 -52100.0 -0.24 453848.0 -258000.0 -1.37 -1.1358 -0.8189 ICBGEx2_000357 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A06 compound treatment 562110.5528 -104000.0 -0.48 608375.0 -103000.0 -0.55 -0.7246 -0.9978 ICBGEx2_000358 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A07 compound treatment 789834.0249 124000.0 0.57 716091.7031 4700.0 0.02 0.422 0.7372 ICBGEx2_000359 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A08 compound treatment 806644.6281 141000.0 0.65 725905.4054 14500.0 0.08 0.5136 0.7854 ICBGEx2_000360 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A09 compound treatment 577407.4074 -88400.0 -0.41 666893.8547 -44500.0 -0.24 -0.4552 -0.9662 ICBGEx2_000361 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A10 compound treatment 766198.4436 100000.0 0.46 862617.7606 151000.0 0.8 0.8945 0.9659 ICBGEx2_000362 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A11 compound treatment 700991.3043 35200.0 0.16 736602.6201 25200.0 0.13 0.2092 0.9954 ICBGEx2_000363 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A12 compound treatment 582866.6667 -83000.0 -0.38 434621.0526 -277000.0 -1.47 -1.3086 -0.8626 ICBGEx2_000364 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A13 compound treatment 667359.8326 1540.0 0.01 875978.6325 165000.0 0.87 0.6223 0.7128 ICBGEx2_000365 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A14 compound treatment 680355.4688 14500.0 0.07 767889.3617 56500.0 0.3 0.2593 0.8444 ICBGEx2_000366 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A15 compound treatment 626942.623 -38900.0 -0.18 776532.0755 65100.0 0.35 0.1175 0.3019 ICBGEx2_000367 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A16 compound treatment 599313.9013 -66500.0 -0.31 637106.7961 -74300.0 -0.39 -0.4955 -0.9923 ICBGEx2_000368 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A17 compound treatment 427029.703 -239000.0 -1.1 425032.6087 -286000.0 -1.52 -1.8527 -0.9875 ICBGEx2_000369 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A18 compound treatment 797262.0087 131000.0 0.61 749760.6838 38400.0 0.2 0.5725 0.8954 ICBGEx2_000370 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A19 compound treatment 835041.0448 169000.0 0.78 846275.4717 135000.0 0.72 1.0577 0.9991 ICBGEx2_000371 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A20 compound treatment 758014.3369 92200.0 0.43 725597.7444 14200.0 0.08 0.3539 0.8196 ICBGEx2_000372 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A21 compound treatment 629878.453 -35900.0 -0.17 569990.0 -141000.0 -0.75 -0.6476 -0.843 ICBGEx2_000373 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A22 compound treatment 393837.6068 -272000.0 -1.25 659565.5738 -51800.0 -0.27 -1.0813 -0.8421 ICBGEx2_000374 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A23 mock treatment 1067231.771 401000.0 1.85 992755.2083 281000.0 1.49 2.3642 0.9943 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 A24 mock treatment 864924.8555 199000.0 0.92 580721.7391 -131000.0 -0.69 0.1592 0.1384 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B01 mock treatment 1165611.765 500000.0 2.3 1174029.499 463000.0 2.45 3.3649 0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B02 mock treatment 1295912.226 630000.0 2.91 605298.5075 -106000.0 -0.56 1.6568 0.5598 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B03 mock treatment 723979.2746 58200.0 0.27 658915.493 -52500.0 -0.28 -0.0072 -0.0186 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B04 mock treatment 799908.6538 134000.0 0.62 819882.8829 108000.0 0.58 0.8441 0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B05 mock treatment 760369.863 94500.0 0.44 794292.0792 82900.0 0.44 0.6192 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B06 mock treatment 669438.1443 3620.0 0.02 835544.6009 124000.0 0.66 0.4774 0.7248 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B07 mock treatment 646971.7514 -18900.0 -0.09 788888.3721 77500.0 0.41 0.2292 0.5455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B08 mock treatment 1045377.717 380000.0 1.75 878045.6274 167000.0 0.88 1.8627 0.9499 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B09 mock treatment 720175.3555 54400.0 0.25 574184.466 -137000.0 -0.73 -0.3374 -0.4383 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B10 mock treatment 770753.7688 105000.0 0.48 678394.8498 -33000.0 -0.18 0.2184 0.4244 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B11 mock treatment 948560.1093 283000.0 1.3 1076896.142 366000.0 1.94 2.2928 0.9814 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B12 mock treatment 1297333.333 632000.0 2.91 796205.0209 84800.0 0.45 2.3774 0.8068 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B13 mock treatment 935766.9617 270000.0 1.24 1090215.116 379000.0 2.01 2.301 0.9735 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B14 mock treatment 1168398.204 503000.0 2.32 1276558.209 565000.0 3.0 3.7585 0.9919 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B15 mock treatment 1001908.832 336000.0 1.55 1252389.503 541000.0 2.87 3.1249 0.9582 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B16 mock treatment 879470.9141 214000.0 0.99 1223251.323 512000.0 2.71 2.6164 0.9059 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B17 mock treatment 1117634.286 452000.0 2.08 870797.3684 159000.0 0.85 2.0712 0.9211 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B18 mock treatment 889407.2165 224000.0 1.03 951016.4835 240000.0 1.27 1.6278 0.9946 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B19 mock treatment 904695.5307 239000.0 1.1 958903.6458 248000.0 1.31 1.7072 0.9962 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B20 mock treatment 1033922.865 368000.0 1.7 1150617.801 439000.0 2.33 2.8476 0.9879 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B21 mock treatment 988339.9433 323000.0 1.49 763276.2148 51900.0 0.28 1.2463 0.8239 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B22 mock treatment 726013.6612 60200.0 0.28 669876.7123 -41500.0 -0.22 0.0406 0.1145 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B23 mock treatment 615521.5686 -50300.0 -0.23 701462.1514 -9930.0 -0.05 -0.2013 -0.8462 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 B24 mock treatment 723267.4772 57400.0 0.26 755554.9451 44200.0 0.23 0.3529 0.9981 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C01 compound treatment 589325.3589 -76500.0 -0.35 615682.4034 -95700.0 -0.51 -0.6084 -0.9842 ICBGEx2_000375 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C02 compound treatment 883042.8016 217000.0 1.0 915592.1569 204000.0 1.08 1.4742 0.9992 ICBGEx2_000376 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C03 compound treatment 687212.5 21400.0 0.1 845320.1754 134000.0 0.71 0.572 0.7976 ICBGEx2_000377 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C04 compound treatment 801892.3767 136000.0 0.63 885565.2174 174000.0 0.92 1.0969 0.9822 ICBGEx2_000378 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C05 compound treatment 819912.6214 154000.0 0.71 625506.2762 -85900.0 -0.46 0.1803 0.2137 ICBGEx2_000379 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C06 compound treatment 774949.1525 109000.0 0.5 751992.5094 40600.0 0.22 0.5081 0.9283 ICBGEx2_000380 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C07 compound treatment 456054.7945 -210000.0 -0.97 407761.9048 -304000.0 -1.61 -1.8228 -0.9703 ICBGEx2_000381 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C08 compound treatment 544564.9718 -121000.0 -0.56 664126.2136 -47300.0 -0.25 -0.5727 -0.9345 ICBGEx2_000382 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C09 compound treatment 758788.3817 93000.0 0.43 850336.1702 139000.0 0.74 0.8242 0.9668 ICBGEx2_000383 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C10 compound treatment 695887.8924 30100.0 0.14 771940.1709 60500.0 0.32 0.3251 0.9295 ICBGEx2_000384 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C11 compound treatment 675042.0168 9220.0 0.04 644701.8349 -66700.0 -0.35 -0.2201 -0.6177 ICBGEx2_000385 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C12 compound treatment 656585.3659 -9240.0 -0.04 718515.873 7120.0 0.04 -0.0034 -0.0601 ICBGEx2_000386 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C13 compound treatment 703025.7511 37200.0 0.17 662009.1743 -49400.0 -0.26 -0.0639 -0.2041 ICBGEx2_000387 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C14 compound treatment 697227.5132 31400.0 0.14 543122.2222 -168000.0 -0.89 -0.5287 -0.5847 ICBGEx2_000388 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C15 compound treatment 642730.9942 -23100.0 -0.11 620807.6923 -90600.0 -0.48 -0.4151 -0.8434 ICBGEx2_000389 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C16 compound treatment 621599.0566 -44200.0 -0.2 613540.0 -97900.0 -0.52 -0.5112 -0.9167 ICBGEx2_000390 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C17 compound treatment 717660.793 51800.0 0.24 792086.6142 80700.0 0.43 0.4717 0.9622 ICBGEx2_000391 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C18 compound treatment 601024.6914 -64800.0 -0.3 656912.6214 -54500.0 -0.29 -0.4156 -0.9999 ICBGEx2_000392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C19 compound treatment 724505.0505 58700.0 0.27 654354.1667 -57000.0 -0.3 -0.0226 -0.0556 ICBGEx2_000393 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C20 mock treatment 904278.7879 238000.0 1.1 643899.5434 -67500.0 -0.36 0.5244 0.4535 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C21 compound treatment 621762.5571 -44100.0 -0.2 588031.1284 -123000.0 -0.65 -0.6064 -0.885 ICBGEx2_000394 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C22 mock treatment 849809.1603 184000.0 0.85 724920.5607 13500.0 0.07 0.6507 0.7642 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C23 mock treatment 744414.8148 78600.0 0.36 799776.8924 88400.0 0.47 0.5878 0.9919 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 C24 mock treatment 796151.7857 130000.0 0.6 643654.8673 -67700.0 -0.36 0.1709 0.2441 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D01 mock treatment 1066079.47 400000.0 1.85 655180.9045 -56200.0 -0.3 1.0944 0.5853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D02 mock treatment 752673.7968 86900.0 0.4 856272.7273 145000.0 0.77 0.8266 0.9539 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D03 mock treatment 709286.4583 43500.0 0.2 1008061.29 297000.0 1.57 1.2544 0.7908 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D04 mock treatment 526255.1724 -140000.0 -0.64 645911.6279 -65500.0 -0.35 -0.7007 -0.9581 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D05 mock treatment 837712.5 172000.0 0.79 744067.5105 32700.0 0.17 0.6831 0.8418 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D06 mock treatment 709826.087 44000.0 0.2 844815.4506 133000.0 0.71 0.6439 0.8746 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D07 mock treatment 624299.5595 -41500.0 -0.19 730668.1034 19300.0 0.1 -0.0631 -0.2908 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D08 mock treatment 748470.8738 82600.0 0.38 816907.563 106000.0 0.56 0.6652 0.9825 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D09 mock treatment 747100.9174 81300.0 0.37 814570.8812 103000.0 0.55 0.652 0.983 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D10 mock treatment 759647.3214 93800.0 0.43 809404.7619 98000.0 0.52 0.6735 0.9958 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D11 mock treatment 1073370.607 408000.0 1.88 741791.4894 30400.0 0.16 1.443 0.765 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D12 mock treatment 803241.0714 137000.0 0.63 732556.3636 21200.0 0.11 0.5275 0.8196 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D13 mock treatment 965408.5366 300000.0 1.38 686230.4688 -25200.0 -0.13 0.8825 0.6358 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D14 mock treatment 697067.4603 31200.0 0.14 762833.3333 51400.0 0.27 0.2948 0.9555 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D15 mock treatment 719814.6067 54000.0 0.25 785846.4419 74500.0 0.39 0.4553 0.9753 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D16 mock treatment 962326.087 297000.0 1.37 863267.5325 152000.0 0.81 1.5365 0.9682 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D17 mock treatment 957272.7273 291000.0 1.34 1005462.766 294000.0 1.56 2.0533 0.9973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D18 mock treatment 546585.0622 -119000.0 -0.55 711393.5484 -2.35 0.0 -0.3888 -0.7071 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D19 mock treatment 572980.0 -92800.0 -0.43 594534.8837 -117000.0 -0.62 -0.741 -0.9837 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D20 mock treatment 610699.5516 -55100.0 -0.25 757791.6667 46400.0 0.25 -0.0057 -0.0162 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D21 mock treatment 580401.5444 -85400.0 -0.39 630880.9524 -80500.0 -0.43 -0.5805 -0.9992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D22 mock treatment 672933.8624 7110.0 0.03 648685.3448 -62700.0 -0.33 -0.212 -0.6343 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D23 mock treatment 707251.2821 41400.0 0.19 673020.6897 -38400.0 -0.2 -0.0088 -0.0316 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 D24 mock treatment 862454.2857 197000.0 0.91 582193.5484 -129000.0 -0.69 0.1566 0.1378 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E01 compound treatment 565324.1758 -100000.0 -0.46 578029.5567 -133000.0 -0.71 -0.8279 -0.979 ICBGEx2_000395 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E02 mock treatment 565410.0 -100000.0 -0.46 656780.4878 -54600.0 -0.29 -0.5323 -0.9745 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E03 compound treatment 517250.0 -149000.0 -0.69 551377.2455 -160000.0 -0.85 -1.0846 -0.9944 ICBGEx2_000396 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E04 mock treatment 613100.0 -52700.0 -0.24 718105.2632 6710.0 0.04 -0.1468 -0.5972 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E05 compound treatment 689703.7037 23900.0 0.11 844560.6695 133000.0 0.71 0.5773 0.8076 ICBGEx2_000397 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E06 mock treatment 706804.4444 41000.0 0.19 763148.4716 51800.0 0.27 0.3277 0.9834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E07 compound treatment 590520.4082 -75300.0 -0.35 611062.8019 -100000.0 -0.53 -0.6219 -0.9786 ICBGEx2_000398 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E08 mock treatment 650715.0 -15100.0 -0.07 832131.2057 121000.0 0.64 0.4036 0.6265 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E09 compound treatment 681531.25 15700.0 0.07 806910.5691 95500.0 0.51 0.4095 0.8001 ICBGEx2_000399 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E10 mock treatment 631650.2058 -34200.0 -0.16 745885.2459 34500.0 0.18 0.0179 0.0742 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E11 compound treatment 605372.6415 -60500.0 -0.28 619412.2449 -92000.0 -0.49 -0.5421 -0.9648 ICBGEx2_000400 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E12 mock treatment 838754.717 173000.0 0.8 1061267.176 350000.0 1.86 1.8761 0.9288 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E13 compound treatment 534770.1149 -131000.0 -0.6 587310.0437 -124000.0 -0.66 -0.8927 -0.9991 ICBGEx2_000401 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E14 mock treatment 757811.7647 92000.0 0.42 764467.8112 53100.0 0.28 0.499 0.9802 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E15 compound treatment 554867.1587 -111000.0 -0.51 739542.6621 28100.0 0.15 -0.2563 -0.4808 ICBGEx2_000402 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E16 mock treatment 640768.9655 -25100.0 -0.12 798531.0345 87100.0 0.46 0.2451 0.5145 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E17 compound treatment 534040.1786 -132000.0 -0.61 605399.2395 -106000.0 -0.56 -0.8273 -0.9992 ICBGEx2_000403 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E18 mock treatment 562576.1317 -103000.0 -0.48 755287.8788 43900.0 0.23 -0.1721 -0.3246 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E19 compound treatment 616316.2393 -49500.0 -0.23 710968.6275 -427.0 0.0 -0.163 -0.7141 ICBGEx2_000404 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E20 mock treatment 710712.9338 44900.0 0.21 799198.5294 87800.0 0.47 0.4757 0.9334 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E21 compound treatment 699927.1255 34100.0 0.16 625756.654 -85600.0 -0.45 -0.21 -0.4368 ICBGEx2_000405 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E22 mock treatment 761426.009 95600.0 0.44 731909.0909 20500.0 0.11 0.3887 0.8559 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E23 mock treatment 742970.3264 77100.0 0.36 676716.7382 -34700.0 -0.18 0.1215 0.3034 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 E24 mock treatment 674327.1375 8500.0 0.04 673460.3175 -37900.0 -0.2 -0.1145 -0.5588 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F01 mock treatment 1066444.444 401000.0 1.85 1113567.308 402000.0 2.13 2.8147 0.9974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F02 mock treatment 462560.9756 -203000.0 -0.94 635460.396 -75900.0 -0.4 -0.9476 -0.9288 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F03 mock treatment 573636.8715 -92200.0 -0.43 746540.9091 35100.0 0.19 -0.1688 -0.3636 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F04 mock treatment 683401.9139 17600.0 0.08 793172.4138 81800.0 0.43 0.364 0.825 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F05 mock treatment 734497.5124 68700.0 0.32 845030.303 134000.0 0.71 0.7251 0.9341 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F06 mock treatment 695042.5532 29200.0 0.13 902595.2381 191000.0 1.01 0.8124 0.7941 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F07 mock treatment 643920.1878 -21900.0 -0.1 722096.9163 10700.0 0.06 -0.0313 -0.2701 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F08 mock treatment 620228.4483 -45600.0 -0.21 861312.5 150000.0 0.8 0.4136 0.5028 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F09 mock treatment 679942.3077 14100.0 0.07 752958.0153 41600.0 0.22 0.2019 0.8784 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F10 mock treatment 687209.9237 21400.0 0.1 742748.9177 31400.0 0.17 0.1873 0.9689 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F11 mock treatment 613166.6667 -52700.0 -0.24 772973.2143 61600.0 0.33 0.0592 0.1456 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F12 mock treatment 748669.0909 82800.0 0.38 721328.6385 9930.0 0.05 0.3074 0.7971 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F13 mock treatment 607199.2754 -58600.0 -0.27 652934.5455 -58500.0 -0.31 -0.4104 -0.9977 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F14 mock treatment 644465.2174 -21400.0 -0.1 612936.8421 -98500.0 -0.52 -0.4389 -0.8259 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F15 mock treatment 592531.25 -73300.0 -0.34 746259.4142 34900.0 0.18 -0.1082 -0.281 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F16 mock treatment 767786.5169 102000.0 0.47 694757.8947 -16600.0 -0.09 0.2701 0.5645 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F17 mock treatment 573752.0891 -92100.0 -0.42 681378.6408 -30000.0 -0.16 -0.4128 -0.9104 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F18 mock treatment 712570.9677 46700.0 0.22 787282.392 75900.0 0.4 0.4371 0.9572 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F19 mock treatment 775100.0 109000.0 0.5 619617.6471 -91800.0 -0.49 0.0121 0.0173 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F20 mock treatment 904460.5911 239000.0 1.1 1131612.827 420000.0 2.23 2.3542 0.9471 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F21 mock treatment 587159.375 -78700.0 -0.36 586095.679 -125000.0 -0.66 -0.7265 -0.9595 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F22 mock treatment 614777.7778 -51000.0 -0.24 755202.7972 43800.0 0.23 -0.0022 -0.0065 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F23 mock treatment 645331.2303 -20500.0 -0.09 602875.0 -109000.0 -0.58 -0.4738 -0.8123 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 F24 mock treatment 598918.9189 -66900.0 -0.31 669617.6471 -41800.0 -0.22 -0.3749 -0.9868 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G01 compound treatment 529212.766 -137000.0 -0.63 587405.6604 -124000.0 -0.66 -0.9105 -0.9998 ICBGEx2_000406 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G02 mock treatment 582086.0215 -83700.0 -0.39 567822.5806 -144000.0 -0.76 -0.8115 -0.9505 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G03 compound treatment 421444.4444 -244000.0 -1.13 448631.1475 -263000.0 -1.39 -1.7824 -0.9944 ICBGEx2_000407 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G04 mock treatment 565163.8655 -101000.0 -0.46 671336.4486 -40100.0 -0.21 -0.4785 -0.9372 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G05 compound treatment 604281.9383 -61500.0 -0.28 620461.5385 -90900.0 -0.48 -0.5417 -0.968 ICBGEx2_000408 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G06 mock treatment 536242.1053 -130000.0 -0.6 675477.6786 -35900.0 -0.19 -0.5573 -0.8885 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G07 compound treatment 560489.083 -105000.0 -0.49 649820.1754 -61600.0 -0.33 -0.5744 -0.9813 ICBGEx2_000409 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G08 mock treatment 569057.377 -96800.0 -0.45 724710.9375 13300.0 0.07 -0.2656 -0.5879 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G09 compound treatment 427383.5125 -238000.0 -1.1 513471.0425 -198000.0 -1.05 -1.5198 -0.9997 ICBGEx2_000410 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G10 mock treatment 756228.8136 90400.0 0.42 914552.7157 203000.0 1.08 1.0567 0.9146 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G11 compound treatment 429544.186 -236000.0 -1.09 470976.6082 -240000.0 -1.28 -1.6722 -0.9969 ICBGEx2_000411 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G12 mock treatment 583472.2222 -82400.0 -0.38 686027.2727 -25400.0 -0.13 -0.3637 -0.9027 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G13 compound treatment 665018.6047 -804.0 0.0 579228.3465 -132000.0 -0.7 -0.4983 -0.7108 ICBGEx2_000412 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G14 mock treatment 596939.3939 -68900.0 -0.32 599359.375 -112000.0 -0.59 -0.6448 -0.957 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G15 compound treatment 484519.0476 -181000.0 -0.84 565374.3842 -146000.0 -0.77 -1.1389 -0.9993 ICBGEx2_000413 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G16 mock treatment 541035.2423 -125000.0 -0.58 587095.7447 -124000.0 -0.66 -0.8731 -0.9977 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G17 compound treatment 498255.9727 -168000.0 -0.77 579627.2401 -132000.0 -0.7 -1.0406 -0.9987 ICBGEx2_000414 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G18 mock treatment 580904.0 -84900.0 -0.39 515315.7895 -196000.0 -1.04 -1.0123 -0.9109 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G19 compound treatment 466885.1852 -199000.0 -0.92 512570.3125 -199000.0 -1.05 -1.3944 -0.9976 ICBGEx2_000415 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G20 mock treatment 599798.6348 -66000.0 -0.3 530627.3764 -181000.0 -0.96 -0.8933 -0.888 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G21 compound treatment 426678.1609 -239000.0 -1.1 430107.7844 -281000.0 -1.49 -1.8348 -0.9889 ICBGEx2_000416 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G22 mock treatment 528010.5634 -138000.0 -0.64 544316.2939 -167000.0 -0.89 -1.076 -0.9867 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G23 mock treatment 564206.2257 -102000.0 -0.47 597249.0272 -114000.0 -0.61 -0.7595 -0.992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 G24 mock treatment 566500.0 -99300.0 -0.46 570181.4947 -141000.0 -0.75 -0.8535 -0.9722 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H01 mock treatment 1014008.824 348000.0 1.61 971939.7993 261000.0 1.38 2.1126 0.9972 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H02 mock treatment 555625.6983 -110000.0 -0.51 605319.0476 -106000.0 -0.56 -0.7572 -0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H03 mock treatment 680357.5758 14500.0 0.07 663207.7295 -48200.0 -0.26 -0.1333 -0.5046 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H04 mock treatment 585456.8528 -80400.0 -0.37 700526.57 -10900.0 -0.06 -0.3028 -0.8074 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H05 mock treatment 809434.7826 144000.0 0.66 645334.7639 -66100.0 -0.35 0.2205 0.2944 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H06 mock treatment 609517.094 -56300.0 -0.26 654552.381 -56800.0 -0.3 -0.3968 -0.9972 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H07 mock treatment 532253.9683 -134000.0 -0.62 646016.6667 -65400.0 -0.35 -0.6808 -0.9631 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H08 mock treatment 583185.7143 -82600.0 -0.38 693872.807 -17500.0 -0.09 -0.3352 -0.8545 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H09 mock treatment 627848.3412 -38000.0 -0.18 647407.4074 -64000.0 -0.34 -0.3638 -0.9526 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H10 mock treatment 592504.717 -73300.0 -0.34 704431.6239 -6960.0 -0.04 -0.2652 -0.7797 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H11 mock treatment 613041.841 -52800.0 -0.24 592495.8678 -119000.0 -0.63 -0.618 -0.9143 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H12 mock treatment 729037.8788 63200.0 0.29 672491.5254 -38900.0 -0.21 0.0602 0.1686 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H13 mock treatment 631931.5068 -33900.0 -0.16 729713.0435 18300.0 0.1 -0.0418 -0.2272 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H14 mock treatment 672618.6047 6800.0 0.03 706064.1026 -5330.0 -0.03 0.0022 0.0513 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H15 mock treatment 856271.7087 190000.0 0.88 861784.5745 150000.0 0.8 1.1851 0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H16 mock treatment 608031.5315 -57800.0 -0.27 536090.9091 -175000.0 -0.93 -0.8459 -0.8746 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H17 mock treatment 870642.8571 205000.0 0.94 999899.0148 289000.0 1.53 1.7499 0.9731 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H18 mock treatment 541306.338 -125000.0 -0.57 546450.4132 -165000.0 -0.87 -1.0247 -0.9791 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H19 mock treatment 560510.4895 -105000.0 -0.49 517601.476 -194000.0 -1.03 -1.0702 -0.9414 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H20 mock treatment 577900.4329 -87900.0 -0.41 603182.0988 -108000.0 -0.57 -0.6926 -0.9855 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H21 mock treatment 568072.9167 -97700.0 -0.45 527823.1707 -184000.0 -0.97 -1.0072 -0.9388 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H22 mock treatment 535561.5142 -130000.0 -0.6 529691.1315 -182000.0 -0.96 -1.1063 -0.9741 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H23 mock treatment 596616.2791 -69200.0 -0.32 621117.6471 -90300.0 -0.48 -0.5643 -0.9806 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 H24 mock treatment 501553.9906 -164000.0 -0.76 513020.5479 -198000.0 -1.05 -1.2797 -0.987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I01 compound treatment 83580.6452 -582000.0 -2.69 97561.4035 -614000.0 -3.26 -4.2008 -0.9954 ICBGEx2_000417 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I02 mock treatment 794046.2633 128000.0 0.59 643273.1707 -68100.0 -0.36 0.1626 0.2347 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I03 compound treatment 557994.152 -108000.0 -0.5 701331.6327 -10100.0 -0.05 -0.3894 -0.7785 ICBGEx2_000418 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I04 mock treatment 664880.9524 -942.0 0.0 809913.6364 98500.0 0.52 0.3664 0.7012 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I05 compound treatment 798195.3125 132000.0 0.61 790771.0843 79400.0 0.42 0.7294 0.9835 ICBGEx2_000419 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I06 mock treatment 670396.5517 4570.0 0.02 800176.2115 88800.0 0.47 0.3479 0.738 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I07 compound treatment 696363.2653 30500.0 0.14 746526.3158 35100.0 0.19 0.2313 0.9905 ICBGEx2_000420 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I08 mock treatment 619215.4472 -46600.0 -0.21 843939.1304 133000.0 0.7 0.3451 0.4695 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I09 compound treatment 65347.8261 -600000.0 -2.77 75895.8333 -636000.0 -3.37 -4.3415 -0.9952 ICBGEx2_000421 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I10 mock treatment 565222.2222 -101000.0 -0.46 923044.2478 212000.0 1.12 0.4657 0.3834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I11 compound treatment 51737.7049 -614000.0 -2.83 59921.5686 -651000.0 -3.46 -4.4458 -0.9951 ICBGEx2_000422 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I12 mock treatment 657332.0 -8490.0 -0.04 661589.2116 -49800.0 -0.26 -0.2145 -0.8031 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I13 compound treatment 566331.4286 -99500.0 -0.46 577136.8421 -134000.0 -0.71 -0.828 -0.9774 ICBGEx2_000423 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I14 mock treatment 480556.196 -185000.0 -0.85 716516.4835 5120.0 0.03 -0.5849 -0.6843 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I15 compound treatment 550641.791 -115000.0 -0.53 570529.4118 -141000.0 -0.75 -0.9039 -0.986 ICBGEx2_000424 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I16 mock treatment 634160.9756 -31700.0 -0.15 651200.6803 -60200.0 -0.32 -0.329 -0.9371 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I17 compound treatment 536908.4746 -129000.0 -0.59 642405.9406 -69000.0 -0.37 -0.6791 -0.9728 ICBGEx2_000425 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I18 mock treatment 524501.6502 -141000.0 -0.65 758647.0588 47300.0 0.25 -0.2836 -0.4062 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I19 compound treatment 593313.4328 -72500.0 -0.33 671322.5806 -40100.0 -0.21 -0.3867 -0.9761 ICBGEx2_000426 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I20 mock treatment 583775.1004 -82000.0 -0.38 597846.1538 -114000.0 -0.6 -0.6934 -0.9749 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I21 compound treatment 59228.0702 -607000.0 -2.8 77140.3509 -634000.0 -3.36 -4.3568 -0.9958 ICBGEx2_000427 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I22 mock treatment 615441.1765 -50400.0 -0.23 765717.6471 54300.0 0.29 0.0394 0.1066 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I23 mock treatment 630432.1608 -35400.0 -0.16 719277.3723 7880.0 0.04 -0.0858 -0.5095 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 I24 mock treatment 595972.093 -69900.0 -0.32 590332.0896 -121000.0 -0.64 -0.6818 -0.9491 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J01 mock treatment 1212579.58 547000.0 2.52 1271951.923 561000.0 2.97 3.8853 0.9966 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J02 mock treatment 1385711.712 720000.0 3.32 616235.5556 -95200.0 -0.5 1.9906 0.5928 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J03 mock treatment 1013165.049 347000.0 1.6 668383.4951 -43000.0 -0.23 0.9713 0.6003 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J04 mock treatment 616439.5604 -49400.0 -0.23 618114.8325 -93300.0 -0.49 -0.5109 -0.938 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J05 mock treatment 644516.7464 -21300.0 -0.1 627880.0 -83500.0 -0.44 -0.3827 -0.8435 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J06 mock treatment 648154.5894 -17700.0 -0.08 681860.262 -29500.0 -0.16 -0.1684 -0.9536 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J07 mock treatment 690954.7511 25100.0 0.12 776923.0769 65500.0 0.35 0.3277 0.8945 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J08 mock treatment 684688.0342 18900.0 0.09 658683.3333 -52700.0 -0.28 -0.1362 -0.4651 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J09 mock treatment 618218.9055 -47600.0 -0.22 1080438.889 369000.0 1.96 1.2289 0.6239 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J10 mock treatment 608403.7559 -57400.0 -0.26 794722.4335 83300.0 0.44 0.1253 0.2432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J11 mock treatment 710892.7203 45100.0 0.21 771656.3877 60300.0 0.32 0.373 0.9783 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J12 mock treatment 647360.2941 -18500.0 -0.09 609284.585 -102000.0 -0.54 -0.4432 -0.8083 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J13 mock treatment 571252.1739 -94600.0 -0.44 617848.8372 -93500.0 -0.5 -0.6592 -0.9979 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J14 mock treatment 479323.4323 -186000.0 -0.86 578968.1275 -132000.0 -0.7 -1.1048 -0.9949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J15 mock treatment 524108.7719 -142000.0 -0.65 599251.0823 -112000.0 -0.59 -0.8827 -0.9989 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J16 mock treatment 532000.0 -134000.0 -0.62 606583.3333 -105000.0 -0.56 -0.8295 -0.9986 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J17 mock treatment 583420.712 -82400.0 -0.38 562389.9614 -149000.0 -0.79 -0.8276 -0.9437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J18 mock treatment 491450.3546 -174000.0 -0.8 499840.1487 -212000.0 -1.12 -1.3621 -0.9866 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J19 mock treatment 599907.1429 -65900.0 -0.3 593638.1579 -118000.0 -0.62 -0.6566 -0.9452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J20 mock treatment 495954.8387 -170000.0 -0.78 525882.8452 -186000.0 -0.98 -1.2497 -0.9936 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J21 mock treatment 681181.8182 15400.0 0.07 587393.7008 -124000.0 -0.66 -0.415 -0.6273 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J22 mock treatment 604503.0864 -61300.0 -0.28 516968.0851 -194000.0 -1.03 -0.9292 -0.8689 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J23 mock treatment 565385.2459 -100000.0 -0.46 542695.4887 -169000.0 -0.89 -0.9602 -0.953 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 J24 mock treatment 549263.1579 -117000.0 -0.54 525344.086 -186000.0 -0.99 -1.0779 -0.9592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K01 compound treatment 575115.5779 -90700.0 -0.42 598705.6075 -113000.0 -0.6 -0.7184 -0.9848 ICBGEx2_000428 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K02 mock treatment 679724.7706 13900.0 0.06 632188.4817 -79200.0 -0.42 -0.2517 -0.5923 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K03 compound treatment 867713.2075 202000.0 0.93 917765.9574 206000.0 1.09 1.4323 0.9968 ICBGEx2_000429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K04 mock treatment 591372.3404 -74500.0 -0.34 780972.093 69600.0 0.37 0.0182 0.036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K05 compound treatment 704736.4017 38900.0 0.18 771937.0079 60500.0 0.32 0.354 0.9622 ICBGEx2_000430 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K06 mock treatment 639109.4527 -26700.0 -0.12 708358.2677 -3040.0 -0.02 -0.0985 -0.7928 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K07 compound treatment 74629.6296 -591000.0 -2.73 73729.1667 -638000.0 -3.38 -4.3194 -0.9943 ICBGEx2_000431 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K08 mock treatment 600176.2115 -65600.0 -0.3 705755.8685 -5640.0 -0.03 -0.2352 -0.7732 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K09 compound treatment 548135.1351 -118000.0 -0.54 613372.7273 -98000.0 -0.52 -0.7514 -0.9998 ICBGEx2_000432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K10 mock treatment 613214.2857 -52600.0 -0.24 686471.3805 -24900.0 -0.13 -0.265 -0.9592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K11 compound treatment 604746.6667 -61100.0 -0.28 663656.7657 -47700.0 -0.25 -0.3782 -0.9986 ICBGEx2_000433 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K12 mock treatment 658424.9084 -7400.0 -0.03 687522.9008 -23900.0 -0.13 -0.1137 -0.8667 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K13 compound treatment 615521.9512 -50300.0 -0.23 629354.8387 -82000.0 -0.44 -0.4717 -0.9566 ICBGEx2_000434 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K14 mock treatment 743690.3409 77900.0 0.36 871199.5134 160000.0 0.85 0.8533 0.9269 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K15 compound treatment 599940.7666 -65900.0 -0.3 643006.5789 -68400.0 -0.36 -0.4713 -0.9961 ICBGEx2_000435 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K16 mock treatment 659892.2414 -5930.0 -0.03 604709.4595 -107000.0 -0.57 -0.4195 -0.7404 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K17 compound treatment 530931.8885 -135000.0 -0.62 666293.3333 -45100.0 -0.24 -0.609 -0.9138 ICBGEx2_000436 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K18 mock treatment 540702.4221 -125000.0 -0.58 621352.518 -90000.0 -0.48 -0.7457 -0.9956 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K19 compound treatment 570036.2903 -95800.0 -0.44 442801.2821 -269000.0 -1.42 -1.3197 -0.8848 ICBGEx2_000437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K20 mock treatment 608734.9398 -57100.0 -0.26 642745.614 -68700.0 -0.36 -0.4436 -0.9873 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K21 compound treatment 573211.8056 -92600.0 -0.43 631165.3846 -80200.0 -0.43 -0.6029 -1.0 ICBGEx2_000438 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K22 mock treatment 673584.2294 7760.0 0.04 667635.0148 -43800.0 -0.23 -0.1388 -0.5911 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K23 mock treatment 623480.7018 -42300.0 -0.2 699108.1081 -12300.0 -0.07 -0.1842 -0.8946 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 K24 mock treatment 598302.4194 -67500.0 -0.31 593184.466 -118000.0 -0.63 -0.6635 -0.9478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L01 mock treatment 1003527.624 338000.0 1.56 1018543.307 307000.0 1.63 2.2532 0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L02 mock treatment 671968.5864 6150.0 0.03 629447.9167 -81900.0 -0.43 -0.2873 -0.6596 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L03 mock treatment 1356122.616 690000.0 3.18 1247555.882 536000.0 2.84 4.2619 0.9984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L04 mock treatment 723761.9048 57900.0 0.27 647450.2165 -63900.0 -0.34 -0.0509 -0.1179 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L05 mock treatment 856347.1503 191000.0 0.88 807980.8612 96600.0 0.51 0.9835 0.967 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L06 mock treatment 659732.6733 -6090.0 -0.03 663938.2239 -47500.0 -0.25 -0.1978 -0.7812 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L07 mock treatment 677675.9259 11900.0 0.05 811205.1282 99800.0 0.53 0.413 0.776 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L08 mock treatment 712561.7021 46700.0 0.22 829372.0 118000.0 0.63 0.5949 0.8988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L09 mock treatment 682167.4009 16300.0 0.08 793116.2791 81700.0 0.43 0.3598 0.8178 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L10 mock treatment 624530.4348 -41300.0 -0.19 632559.0551 -78800.0 -0.42 -0.4303 -0.9366 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L11 mock treatment 622910.5691 -42900.0 -0.2 666415.9664 -45000.0 -0.24 -0.3086 -0.9957 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L12 mock treatment 648082.9493 -17700.0 -0.08 747859.7786 36500.0 0.19 0.0789 0.3758 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L13 mock treatment 710123.4043 44300.0 0.2 809026.0223 97600.0 0.52 0.5106 0.9173 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L14 mock treatment 566892.4303 -98900.0 -0.46 668681.9788 -42700.0 -0.23 -0.4828 -0.9478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L15 mock treatment 564736.2205 -101000.0 -0.47 575577.7778 -136000.0 -0.72 -0.839 -0.9778 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L16 mock treatment 610473.4694 -55300.0 -0.26 587738.0074 -124000.0 -0.66 -0.6443 -0.9154 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L17 mock treatment 594508.5911 -71300.0 -0.33 571651.4085 -140000.0 -0.74 -0.7567 -0.9331 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L18 mock treatment 560511.3636 -105000.0 -0.49 550287.3134 -161000.0 -0.85 -0.9476 -0.9641 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L19 mock treatment 655323.1198 -10500.0 -0.05 692578.6517 -18800.0 -0.1 -0.1048 -0.9448 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L20 mock treatment 990408.313 325000.0 1.5 1169995.037 459000.0 2.43 2.7784 0.9728 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L21 mock treatment 599971.5909 -65900.0 -0.3 517975.0623 -193000.0 -1.03 -0.9402 -0.8787 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L22 mock treatment 613913.0435 -51900.0 -0.24 579909.6774 -131000.0 -0.7 -0.6624 -0.8984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L23 mock treatment 555958.6466 -110000.0 -0.51 567076.7196 -144000.0 -0.77 -0.8995 -0.9799 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 L24 mock treatment 629615.0628 -36200.0 -0.17 527667.8967 -184000.0 -0.97 -0.8071 -0.8164 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M01 compound treatment 611310.3448 -54500.0 -0.25 596671.0526 -115000.0 -0.61 -0.608 -0.9235 ICBGEx2_000439 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M02 mock treatment 610181.3472 -55600.0 -0.26 618095.6938 -93300.0 -0.49 -0.5314 -0.9532 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M03 compound treatment 648490.6542 -17300.0 -0.08 766058.8235 54700.0 0.29 0.1485 0.4937 ICBGEx2_000440 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M04 mock treatment 777418.41 112000.0 0.51 715288.8087 3890.0 0.02 0.3785 0.7349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M05 compound treatment 656748.8987 -9070.0 -0.04 663519.3798 -47900.0 -0.25 -0.2091 -0.8127 ICBGEx2_000441 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M06 mock treatment 713554.2169 47700.0 0.22 666934.8659 -44500.0 -0.24 -0.0111 -0.0344 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M07 compound treatment 587299.6255 -78500.0 -0.36 597311.7409 -114000.0 -0.61 -0.6839 -0.9699 ICBGEx2_000442 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M08 mock treatment 884250.6143 218000.0 1.01 1023446.602 312000.0 1.66 1.8826 0.9717 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M09 compound treatment 708578.1818 42800.0 0.2 813612.2449 102000.0 0.54 0.5228 0.9062 ICBGEx2_000443 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M10 mock treatment 575437.9845 -90400.0 -0.42 655244.1315 -56200.0 -0.3 -0.5053 -0.9864 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M11 compound treatment 537678.8991 -128000.0 -0.59 563061.2245 -148000.0 -0.79 -0.9742 -0.9901 ICBGEx2_000444 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M12 mock treatment 574801.9802 -91000.0 -0.42 559746.988 -152000.0 -0.8 -0.8656 -0.954 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M13 compound treatment 524934.3284 -141000.0 -0.65 750388.3495 39000.0 0.21 -0.3132 -0.4593 ICBGEx2_000445 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M14 mock treatment 588028.8462 -77800.0 -0.36 565961.8321 -145000.0 -0.77 -0.7991 -0.9393 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M15 compound treatment 569734.8993 -96100.0 -0.44 603536.3322 -108000.0 -0.57 -0.7179 -0.992 ICBGEx2_000446 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M16 mock treatment 550895.9276 -115000.0 -0.53 565716.895 -146000.0 -0.77 -0.9211 -0.9831 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M17 compound treatment 492127.5168 -174000.0 -0.8 754361.1111 43000.0 0.23 -0.4053 -0.4866 ICBGEx2_000447 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M18 mock treatment 644384.2593 -21400.0 -0.1 584292.6829 -127000.0 -0.67 -0.5466 -0.8022 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M19 compound treatment 621089.404 -44700.0 -0.21 627030.03 -84400.0 -0.45 -0.4623 -0.9382 ICBGEx2_000448 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M20 mock treatment 573358.6626 -92500.0 -0.43 516793.2203 -195000.0 -1.03 -1.0314 -0.9235 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M21 compound treatment 553702.8112 -112000.0 -0.52 515000.0 -196000.0 -1.04 -1.1022 -0.9478 ICBGEx2_000449 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M22 mock treatment 599761.0063 -66100.0 -0.3 550084.8708 -161000.0 -0.86 -0.8204 -0.9033 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M23 mock treatment 557397.2125 -108000.0 -0.5 515753.9936 -196000.0 -1.04 -1.0873 -0.944 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 M24 mock treatment 582708.7379 -83100.0 -0.38 599810.8108 -112000.0 -0.59 -0.6895 -0.9779 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N01 mock treatment 1068123.457 402000.0 1.86 674987.395 -36400.0 -0.19 1.1753 0.6301 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N02 mock treatment 1175178.977 509000.0 2.35 1186231.214 475000.0 2.52 3.4418 0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N03 mock treatment 965306.7847 299000.0 1.38 815650.4854 104000.0 0.55 1.3676 0.9193 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N04 mock treatment 676318.8406 10500.0 0.05 867034.8259 156000.0 0.83 0.6179 0.7473 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N05 mock treatment 700921.9512 35100.0 0.16 719447.5806 8050.0 0.04 0.1447 0.8641 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N06 mock treatment 687575.3425 21800.0 0.1 708024.3902 -3370.0 -0.02 0.0583 0.572 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N07 mock treatment 970100.4785 304000.0 1.4 772256.0976 60900.0 0.32 1.2205 0.8476 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N08 mock treatment 794222.6891 128000.0 0.59 1156292.876 445000.0 2.36 2.0873 0.8579 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N09 mock treatment 1015390.313 350000.0 1.61 1216555.256 505000.0 2.68 3.0345 0.9704 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N10 mock treatment 1072696.602 407000.0 1.88 1157837.15 446000.0 2.37 3.0012 0.9934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N11 mock treatment 614081.9672 -51700.0 -0.24 901638.7283 190000.0 1.01 0.5448 0.5254 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N12 mock treatment 654224.6696 -11600.0 -0.05 638779.661 -72600.0 -0.39 -0.3102 -0.7976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N13 mock treatment 650066.3265 -15800.0 -0.07 723091.7031 11700.0 0.06 -0.0075 -0.0787 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N14 mock treatment 608352.6316 -57500.0 -0.27 997116.1473 286000.0 1.52 0.8842 0.5747 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N15 mock treatment 995335.1499 330000.0 1.52 994694.517 283000.0 1.5 2.137 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N16 mock treatment 624582.1596 -41200.0 -0.19 594532.0197 -117000.0 -0.62 -0.5728 -0.8834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N17 mock treatment 574453.8462 -91400.0 -0.42 623289.7196 -88100.0 -0.47 -0.6284 -0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N18 mock treatment 568295.1542 -97500.0 -0.45 590174.6725 -121000.0 -0.64 -0.7727 -0.9847 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N19 mock treatment 561576.779 -104000.0 -0.48 505479.8535 -206000.0 -1.09 -1.1122 -0.9321 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N20 mock treatment 863075.5668 197000.0 0.91 994952.0202 284000.0 1.5 1.7067 0.971 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N21 mock treatment 665539.4737 -283.0 0.0 488888.4758 -223000.0 -1.18 -0.8354 -0.7079 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N22 mock treatment 540117.8344 -126000.0 -0.58 604889.2857 -107000.0 -0.56 -0.8094 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N23 mock treatment 599536.3322 -66300.0 -0.31 516346.1538 -195000.0 -1.03 -0.9477 -0.8785 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 N24 mock treatment 558698.1132 -107000.0 -0.49 786669.0821 75300.0 0.4 -0.067 -0.1055 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O01 compound treatment 592079.6813 -73700.0 -0.34 637040.146 -74400.0 -0.39 -0.5193 -0.9973 ICBGEx2_000450 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O02 mock treatment 542387.5598 -123000.0 -0.57 619231.8182 -92200.0 -0.49 -0.7482 -0.9971 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O03 compound treatment 734193.4156 68400.0 0.32 736954.3726 25600.0 0.14 0.3188 0.9289 ICBGEx2_000451 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O04 mock treatment 613053.5714 -52800.0 -0.24 673985.1485 -37400.0 -0.2 -0.3124 -0.9949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O05 compound treatment 616129.6296 -49700.0 -0.23 519333.3333 -192000.0 -1.02 -0.8824 -0.8451 ICBGEx2_000452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O06 mock treatment 581076.1421 -84700.0 -0.39 642201.7167 -69200.0 -0.37 -0.5359 -0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O07 compound treatment 633041.3534 -32800.0 -0.15 865393.1624 154000.0 0.82 0.4707 0.5666 ICBGEx2_000453 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O08 mock treatment 524854.3689 -141000.0 -0.65 657217.0213 -54200.0 -0.29 -0.6629 -0.9326 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O09 compound treatment 589130.0 -76700.0 -0.35 705586.4979 -5810.0 -0.03 -0.2719 -0.7658 ICBGEx2_000454 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O10 mock treatment 533928.5714 -132000.0 -0.61 653185.9296 -58200.0 -0.31 -0.6484 -0.9506 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O11 compound treatment 647871.7949 -18000.0 -0.08 684324.8175 -27100.0 -0.14 -0.1601 -0.9658 ICBGEx2_000455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O12 mock treatment 692885.9649 27100.0 0.12 853664.1221 142000.0 0.75 0.6218 0.813 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O13 compound treatment 694939.0244 29100.0 0.13 706114.5038 -5280.0 -0.03 0.0751 0.5478 ICBGEx2_000456 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O14 mock treatment 986051.2129 320000.0 1.48 1064025.21 353000.0 1.87 2.3668 0.9932 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O15 compound treatment 547140.0 -119000.0 -0.55 562360.3604 -149000.0 -0.79 -0.946 -0.9839 ICBGEx2_000457 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O16 mock treatment 556278.3505 -110000.0 -0.51 541636.3636 -170000.0 -0.9 -0.9939 -0.9627 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O17 compound treatment 556521.1726 -109000.0 -0.5 655206.0811 -56200.0 -0.3 -0.5672 -0.9686 ICBGEx2_000458 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O18 mock treatment 501439.0244 -164000.0 -0.76 587079.8722 -124000.0 -0.66 -1.0023 -0.9976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O19 compound treatment 552312.253 -114000.0 -0.52 578000.0 -133000.0 -0.71 -0.8704 -0.989 ICBGEx2_000459 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O20 mock treatment 567980.5825 -97800.0 -0.45 962673.5751 251000.0 1.33 0.6234 0.443 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O21 compound treatment 570687.2964 -95100.0 -0.44 622329.8611 -89100.0 -0.47 -0.6443 -0.9993 ICBGEx2_000460 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O22 mock treatment 491568.0934 -174000.0 -0.8 931352.9412 220000.0 1.17 0.2567 0.1812 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O23 mock treatment 867733.5025 202000.0 0.93 1077752.577 366000.0 1.94 2.0324 0.9432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 O24 mock treatment 867836.1446 202000.0 0.93 856232.2275 145000.0 0.77 1.202 0.9954 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P01 mock treatment 962046.5116 296000.0 1.37 937786.3248 226000.0 1.2 1.815 0.9979 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P02 mock treatment 1017075.145 351000.0 1.62 1020764.873 309000.0 1.64 2.3057 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P03 mock treatment 721482.9268 55700.0 0.26 1095209.974 384000.0 2.04 1.621 0.79 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P04 mock treatment 673415.0 7590.0 0.04 926994.7368 216000.0 1.14 0.8334 0.7284 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P05 mock treatment 623873.1707 -41900.0 -0.19 850610.2941 139000.0 0.74 0.3853 0.5048 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P06 mock treatment 559263.6816 -107000.0 -0.49 976218.8366 265000.0 1.4 0.6457 0.4339 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P07 mock treatment 1159372.781 494000.0 2.28 1025278.515 314000.0 1.66 2.7866 0.9882 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P08 mock treatment 536240.8377 -130000.0 -0.6 975463.6119 264000.0 1.4 0.5678 0.3729 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P09 mock treatment 545960.199 -120000.0 -0.55 1058627.397 347000.0 1.84 0.9114 0.474 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P10 mock treatment 517118.5567 -149000.0 -0.69 927304.3478 216000.0 1.15 0.3248 0.2434 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P11 mock treatment 939862.069 274000.0 1.26 975184.2818 264000.0 1.4 1.883 0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P12 mock treatment 896842.1053 231000.0 1.07 1105424.731 394000.0 2.09 2.2311 0.9511 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P13 mock treatment 566839.6226 -99000.0 -0.46 932131.2336 221000.0 1.17 0.5051 0.4019 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P14 mock treatment 1066041.667 400000.0 1.85 954532.0856 243000.0 1.29 2.217 0.9846 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P15 mock treatment 531887.2549 -134000.0 -0.62 1035379.404 324000.0 1.72 0.7783 0.4262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P16 mock treatment 896718.8264 231000.0 1.06 853704.9608 142000.0 0.75 1.2867 0.9858 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P17 mock treatment 850388.1748 185000.0 0.85 909485.9335 198000.0 1.05 1.3448 0.9945 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P18 mock treatment 887040.404 221000.0 1.02 913591.3978 202000.0 1.07 1.4797 0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P19 mock treatment 958945.1372 293000.0 1.35 990850.1229 279000.0 1.48 2.0039 0.9989 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P20 mock treatment 923049.6454 257000.0 1.19 1050049.628 339000.0 1.8 2.1089 0.9797 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P21 mock treatment 798098.3982 132000.0 0.61 806654.8463 95300.0 0.51 0.7886 0.9956 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P22 mock treatment 767318.7773 101000.0 0.47 963823.6607 252000.0 1.34 1.2777 0.9008 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P23 mock treatment 765535.0877 99700.0 0.46 780500.0 69100.0 0.37 0.5843 0.9937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2092 P24 mock treatment 750680.1802 84900.0 0.39 798410.5505 87000.0 0.46 0.6031 0.9966 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A01 mock treatment 565447.619 -58300.0 -0.27 595808.8235 -66900.0 -0.35 -0.4408 -0.9906 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A02 mock treatment 530532.0197 -93200.0 -0.43 602414.4144 -60300.0 -0.32 -0.5299 -0.9894 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A03 compound treatment 586532.7103 -37200.0 -0.17 737375.0 74700.0 0.4 0.1589 0.368 3076292 SMP2_000001 C[C@H](CCCC(C)(C)O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A04 compound treatment 966005.7307 342000.0 1.58 1008695.652 346000.0 1.84 2.4139 0.9972 170 SMP2_000002 CCCCCCCC[C@@H](O)/C=C/C=C/C=C\[C@@H](O)CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A05 compound treatment 750935.4839 127000.0 0.59 676560.7477 13900.0 0.07 0.4669 0.7896 3076293 SMP2_000003 CN(C)CC/C=C/1\c2ccccc2CC(O)c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A06 compound treatment 510357.9767 -113000.0 -0.52 695198.1132 32500.0 0.17 -0.2477 -0.45 2153 SMP2_000004 C[C@@H]1[C@@H](OC(=O)/C=C/C=C/c2ccccc2)[C@@]3(OC4(O[C@@H]3[C@@H]5[C@@H]6O[C@]6(CO)[C@@H](O)[C@@]7(O)[C@@H](C=C(C)C7=O)[C@@]15O4)c8ccccc8)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A07 compound treatment 78317.0732 -545000.0 -2.52 75325.5814 -587000.0 -3.12 -3.9814 -0.9944 3471112 SMP2_000005 CCOC(=O)CCC(=O)OC1C(CC(C)OC1OC2C(C)C(OC3CC(C)(OC)C(O)C(C)O3)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C(C)CC2(C)O)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A08 compound treatment 740192.6606 116000.0 0.54 700629.3103 37900.0 0.2 0.5221 0.9102 2199 SMP2_000006 CC(C(C)c1ccc(O)cn1)C(N)C(=O)NC([C@H]2O[C@H]([C@@H](O)[C@H]2O)N3C=CC(=O)CC3=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A09 compound treatment 678127.9621 54400.0 0.25 695914.1414 33200.0 0.18 0.302 0.985 698 SMP2_000007 NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A10 compound treatment 581818.1818 -41900.0 -0.19 545850.5155 -117000.0 -0.62 -0.5748 -0.8855 3199281 SMP2_000008 CC(=C[C@@H](O)C1=C[C@@H](O)[C@@H]2O[C@@H]2C1=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A11 compound treatment 581849.7653 -41900.0 -0.19 638824.7423 -23900.0 -0.13 -0.226 -0.979 1001979 SMP2_000009 NCCC[C@H](N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A12 compound treatment 653598.1735 29900.0 0.14 518820.6278 -144000.0 -0.76 -0.4421 -0.5702 3199282 SMP2_000010 C[C@@H]1[C@@H](OC(=O)C)[C@]2(OC(=O)C)[C@H]([C@@H]3C=C(CO)C[C@]4(O)[C@@H](C=C(C)C4=O)[C@]13O)C2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A13 compound treatment 634818.6275 11100.0 0.05 613025.7732 -49700.0 -0.26 -0.1501 -0.5592 1497 SMP2_000011 NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)C2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)[C@H](N)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A14 compound treatment 672227.2727 48500.0 0.22 592208.3333 -70500.0 -0.37 -0.1061 -0.2436 1000212 SMP2_000012 C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A15 compound treatment 84000.0 -540000.0 -2.49 85148.9362 -578000.0 -3.06 -3.926 -0.9947 3199283 SMP2_000013 COC1/C=C\OC2(C)Oc3c(C2=O)c4c(O)cc(NC(=O)\C(=C/C=C\C(C)C(O)C(C)C(O)C(C)C(OC(=O)C)C1C)\C)c(O)c4c(O)c3C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A16 compound treatment 468533.0396 -155000.0 -0.72 594941.1765 -67700.0 -0.36 -0.7601 -0.9492 2267 SMP2_000014 CO[C@H]1[C@H](O)C(O)[C@@H](OC1CO)n2c3c(Cl)cccc3c4c5C(=O)NC(=O)c5c6c7cccc(Cl)c7[nH]c6c24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A17 compound treatment 82702.1277 -541000.0 -2.49 137911.1111 -525000.0 -2.78 -3.7324 -0.9985 706 SMP2_000015 Nc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3n2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A18 compound treatment 757391.7051 134000.0 0.62 661333.3333 -1360.0 -0.01 0.4308 0.6988 1098997 SMP2_000016 CCC1(O)C(=O)OCc2c1cc3-c4nc5ccccc5cc4Cn3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A19 compound treatment 659973.7991 36300.0 0.17 530624.4131 -132000.0 -0.7 -0.3771 -0.5236 1001956 SMP2_000017 CC(C)C1N(C)c2cccc3[nH]cc(CC(CO)NC1=O)c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A20 compound treatment 618676.8559 -5040.0 -0.02 631269.6078 -31400.0 -0.17 -0.1343 -0.798 1912779 SMP2_000018 CC(NC(=O)c1ccccc1/N=C/c2c(O)ccc3ccccc23)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A21 compound treatment 691403.0612 67700.0 0.31 569138.6139 -93600.0 -0.5 -0.1301 -0.222 230 SMP2_000019 CCCCCC(=O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A22 compound treatment 406773.5849 -217000.0 -1.0 473521.5054 -189000.0 -1.0 -1.4169 -1.0 464 SMP2_000020 CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A23 compound treatment 588344.186 -35400.0 -0.16 562647.343 -100000.0 -0.53 -0.4905 -0.8837 548 SMP2_000021 N[C@H]1C[C@H]([C@H](O)[C@@H]1O)n2cc(I)c3c(N)ncnc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 A24 compound treatment 556119.8157 -67600.0 -0.31 630544.6009 -32100.0 -0.17 -0.341 -0.9597 3199284 SMP2_000022 C/C(=C/CNc1ncnc2[nH]cnc12)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B01 mock treatment 596883.1776 -26800.0 -0.12 745881.8182 83200.0 0.44 0.2245 0.4899 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B02 mock treatment 817120.603 193000.0 0.89 718346.1538 55700.0 0.3 0.8394 0.8935 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B03 compound treatment 827689.9563 204000.0 0.94 859582.2222 197000.0 1.04 1.4036 0.9986 1001866 SMP2_000023 NC(CCCNC(=N)N)C(=O)CC(Cc1ccccc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B04 compound treatment 755762.5571 132000.0 0.61 743940.0922 81200.0 0.43 0.7353 0.9857 3076299 SMP2_000024 C[C@@H]1CCOC(=O)/C=C\C=C/C(=O)O[C@@H]2C[C@@H]3OC4C=C(C)CCC4(COC(=O)[C@H]1O)[C@]2(C)[C@@]53CO5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B05 compound treatment 869631.1111 246000.0 1.13 476965.251 -186000.0 -0.99 0.1054 0.0701 3199377 SMP2_000025 CO[C@@H]1C[C@H](C)O[C@@H](CC[C@H](C)[C@H](O)[C@H](C)[C@H]2OC(=O)/C(=C/C[C@H](O)C[C@H]3O[C@@H](CC=C3)C[C@H](OC)[C@@H](C)[C@@H](O)C[C@@H](O)[C@H](C)[C@H](OC(=O)/C(=C/C[C@H](O)C[C@H]4O[C@@H](CC=C4)C[C@H](OC)[C@@H](C)[C@@H](O)C[C@@H](O)[C@@H]2C)/C)[C@@H](C)[C@@H](O)[C@@H](C)CC[C@@H]5C[C@@H](C[C@H](C)O5)OC)/C)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B06 compound treatment 788837.6068 165000.0 0.76 772232.3651 110000.0 0.58 0.9493 0.9911 3076300 SMP2_000026 CC1(C)C(O)C2(C)CCC1C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B07 compound treatment 715759.1837 92000.0 0.42 842815.8996 180000.0 0.96 0.9757 0.9333 3199378 SMP2_000027 CC(CO)C1CC(O)C2(C)OC3CC4OC5CC6(C)OC7CCC8OC9CC%10(C)OC%11C(CC%10OC9CC(C)C8OC7CC6OC5(C)CC=CC4OC3CC2O1)OC(=O)C=C%11C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B08 compound treatment 693880.597 70200.0 0.32 582660.0 -80000.0 -0.42 -0.0713 -0.1337 3076301 SMP2_000028 Cn1cc(C[C@@H](N)C(=O)O)c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B09 compound treatment 91622.6415 -532000.0 -2.45 59352.9412 -603000.0 -3.2 -3.9979 -0.9914 28 SMP2_000029 CNc1ccc2oc(C[C@@H]3OC4(CC[C@@H]3C)O[C@H](C(C)C(=O)c5ccc[nH]5)[C@H](C)C[C@H]4C)nc2c1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B10 compound treatment 486241.3793 -137000.0 -0.63 537155.0 -126000.0 -0.67 -0.9191 -0.9997 3199379 SMP2_000030 CC(C)CC(CO)NC(=O)C(CCC(=O)N)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(CCC(=O)N)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(CCC(=O)N)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B11 compound treatment 648072.9614 24400.0 0.11 610087.3786 -52600.0 -0.28 -0.1179 -0.3918 2006 SMP2_000031 O[C@H]1C2OC2[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B12 compound treatment 464067.4603 -160000.0 -0.74 551603.6866 -111000.0 -0.59 -0.9372 -0.9939 3076303 SMP2_000032 CN(C)c1nc2c(Br)c(Br)c(Br)c(Br)c2[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B13 compound treatment 722190.2439 98500.0 0.45 584801.3245 -77900.0 -0.41 0.029 0.0472 3076304 SMP2_000033 CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C/2\C(=O)Nc3ccc(Cl)cc23)c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B14 compound treatment 571954.7739 -51800.0 -0.24 776930.8511 114000.0 0.61 0.2597 0.3987 1000114 SMP2_000034 CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B15 compound treatment 672444.4444 48700.0 0.22 654404.9587 -8290.0 -0.04 0.1278 0.5583 277 SMP2_000035 OC[C@H]1O[C@H]([C@H](O)[C@H]1O)n2cnc3cc(Cl)c(Cl)cc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B16 compound treatment 580052.8634 -43700.0 -0.2 498325.1232 -164000.0 -0.87 -0.7588 -0.8481 3076306 SMP2_000036 CC(=O)c1ccc(cc1O)N2CCOCC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B17 compound treatment 61808.5106 -562000.0 -2.59 74942.3077 -588000.0 -3.12 -4.0367 -0.9958 2095622 SMP2_000037 CC(=CCC/C(=C/CC/C(=C/Cc1c(O)c2ccccc2oc1=O)/C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B18 compound treatment 680607.7586 56900.0 0.26 495169.2913 -168000.0 -0.89 -0.4428 -0.4779 1670 SMP2_000038 Nc1nc2n(COC(CO)CO)cnc2c(=O)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B19 compound treatment 698589.2857 74900.0 0.35 404342.2053 -258000.0 -1.37 -0.7248 -0.5129 2090 SMP2_000039 CCOC(=O)C(C#N)C1C(=C(N)Oc2ccc(Br)cc12)C(=O)OCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B20 compound treatment 566575.7576 -57100.0 -0.26 568188.4058 -94500.0 -0.5 -0.5408 -0.9549 1096696 SMP2_000040 Oc1ccc(cc1CC=C)c2cc(CC=C)ccc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B21 compound treatment 636761.9048 13000.0 0.06 600334.7826 -62400.0 -0.33 -0.1913 -0.5691 3199380 SMP2_000041 NC1=NC(=O)/C(=C\2/CCNC(=O)c3[nH]c(Br)cc23)/N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B22 compound treatment 463239.1304 -160000.0 -0.74 229726.0274 -433000.0 -2.3 -2.1471 -0.8899 2137 SMP2_000042 Oc1cc(O)c2c(=O)cc(oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B23 compound treatment 586950.6726 -36800.0 -0.17 594207.3733 -68500.0 -0.36 -0.3767 -0.9398 3104545 SMP2_000043 CC1CC(C)/C=C(/C)\CC(C)C(=O)NC(C)C(=O)N(C)C(Cc2c(Br)[nH]c3ccccc23)C(=O)NC(CC(=O)O1)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 B24 compound treatment 363040.0 -261000.0 -1.2 302535.3535 -360000.0 -1.91 -2.2008 -0.9751 907437 SMP2_000044 CCCCCCCCCCCCC(=O)N1CCCCC1CNC(=O)[C@@H](N)CCCCN 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C01 mock treatment 505430.8511 -118000.0 -0.55 643563.3803 -19100.0 -0.1 -0.4574 -0.8245 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C02 mock treatment 756981.4815 133000.0 0.61 694244.3439 31600.0 0.17 0.5529 0.8681 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C03 compound treatment 573664.8352 -50000.0 -0.23 691398.6486 28700.0 0.15 -0.0555 -0.2008 907417 SMP2_000045 COc1cc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CCc2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C04 compound treatment 802370.2128 179000.0 0.82 739027.6498 76300.0 0.4 0.8689 0.9465 180 SMP2_000046 CCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SCC(N)C(=O)NCC(=O)O)[C@@H](O)CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C05 compound treatment 55975.6098 -568000.0 -2.62 59577.7778 -603000.0 -3.2 -4.1133 -0.9951 3199382 SMP2_000047 C[C@@H]1CCC2[C@H](C[C@]3(C)C(=CCC4[C@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)C2[C@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C06 compound treatment 81609.7561 -542000.0 -2.5 68849.0566 -594000.0 -3.15 -3.995 -0.9935 3104900 SMP2_000048 C/C(=C\CCC1C=CC(OC1O)C2=CC(=O)OC2O)/CCC3=C(C)CCCC3(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C07 compound treatment 439085.2018 -185000.0 -0.85 396700.0 -266000.0 -1.41 -1.5997 -0.9708 907313 SMP2_000049 Oc1c(I)cc2c(Oc3c(I)c(O)c(I)cc3C42OC(=O)c5ccccc54)c1I 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C08 compound treatment 690863.4146 67100.0 0.31 665396.3964 2710.0 0.01 0.2291 0.7391 3076308 SMP2_000050 CCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCCCCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C09 compound treatment 763978.0702 140000.0 0.65 733113.1222 70400.0 0.37 0.7215 0.9659 1002910 SMP2_000051 OC(C(O)C(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C10 compound treatment 615414.2259 -8300.0 -0.04 653148.5149 -9540.0 -0.05 -0.0629 -0.9905 453 SMP2_000052 COc1cccc(c1N)c2cc(=O)c3ccccc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C11 compound treatment 696323.9437 72600.0 0.33 655613.5266 -7080.0 -0.04 0.2102 0.6239 3199383 SMP2_000053 C[C@@H]1C[C@H]2[C@@H](CC[C@@H]3C[C@@H](O)CC[C@@]32C)[C@]45O[C@@H]5C[C@@H](C14)c6ccc(=O)oc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C12 compound treatment 71341.4634 -552000.0 -2.55 70142.8571 -593000.0 -3.14 -4.0236 -0.9946 3199384 SMP2_000054 CC[C@H]1OC(=O)C[C@@H](O)C[C@@H](OC[C@]2(C)OC(C)[C@@H](O[C@@]3(C)C[C@@](C)(O)[C@@H](O)C(C)O3)[C@H](C2O)N(C)C)[C@@H](CC=O)C[C@@H](C)C(=O)/C=C\C(=C/C1CO[C@@H]4OC(C)[C@@H](O)[C@H](OC)C4OC)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C13 compound treatment 725333.3333 102000.0 0.47 719913.0435 57200.0 0.3 0.546 0.9779 3076309 SMP2_000055 C[C@]12CC[C@H](C3CCC(C)(C)OC3)[C@@]2(C)[C@H](O)C[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5[C@@H](O)C[C@]41C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C14 compound treatment 663526.0417 39800.0 0.18 758901.2876 96200.0 0.51 0.4907 0.9047 222 SMP2_000056 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C15 compound treatment 210039.2157 -414000.0 -1.91 136980.3922 -526000.0 -2.79 -3.3206 -0.9829 3076310 SMP2_000057 CC1(C)CC[C@H](F)[C@@]2(CO[C@@]3(O)[C@H](O)[C@H]12)[C@@H]4CC[C@@H]5[C@@H](O)[C@@]43C(=O)C5=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C16 compound treatment 665215.1899 41500.0 0.19 550403.5874 -112000.0 -0.6 -0.2858 -0.4569 3199385 SMP2_000058 OC[C@@H]1C[C@H](N[C@@H]2C=C(CO)[C@@H](O)[C@H](O)[C@H]2O)C(O)C(O)[C@@H]1O[C@@H]3OC(CO)[C@@H](O)[C@H](O)[C@@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C17 compound treatment 751558.6854 128000.0 0.59 552467.2489 -110000.0 -0.58 0.0035 0.0042 1448 SMP2_000059 OC(=O)c1cc(N=Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C18 compound treatment 662285.7143 38600.0 0.18 568664.8936 -94000.0 -0.5 -0.2269 -0.4285 31 SMP2_000060 CCCCCCCCCCCCCCC[C@H](O)[C@@H](N)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C19 compound treatment 640072.6257 16400.0 0.08 654218.543 -8470.0 -0.04 0.0216 0.2457 95 SMP2_000061 CCCCCC(O)/C=C/C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C20 compound treatment 38057.4713 -586000.0 -2.7 33627.2727 -629000.0 -3.34 -4.2691 -0.9945 2065223 SMP2_000062 CN(C)c1ccc(cc1)C(O)(c2ccccc2)c3ccc(cc3)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C21 compound treatment 690478.4483 66800.0 0.31 674798.2063 12100.0 0.06 0.2631 0.8366 3199386 SMP2_000063 CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)/C(=C\C=C/[C@H](O)[C@@H](OC(=O)N)/C(=C\[C@H](C)[C@H]1O)/C)/C)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C22 compound treatment 807621.2766 184000.0 0.85 736185.022 73500.0 0.39 0.8753 0.9378 2041 SMP2_000064 OC(=O)CNC(=O)C(CS)Cc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C23 compound treatment 646492.3858 22800.0 0.11 616140.3509 -46500.0 -0.25 -0.1003 -0.3738 3076311 SMP2_000065 COc1cc2ccnc3cc[nH]c(c1OC)c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 C24 compound treatment 650857.1429 27100.0 0.13 583937.7778 -78800.0 -0.42 -0.2068 -0.4744 907566 SMP2_000066 C/C(=C\CNc1ncnc2n(cnc12)C3OC(CO)[C@@H](O)[C@H]3O)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D01 mock treatment 652160.9756 28400.0 0.13 780263.6364 118000.0 0.62 0.5337 0.8375 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D02 mock treatment 667687.1795 44000.0 0.2 757000.0 94300.0 0.5 0.4971 0.921 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D03 compound treatment 106424.2424 -517000.0 -2.39 143000.0 -520000.0 -2.76 -3.6359 -0.9974 3199387 SMP2_000067 CCC1/C=C(/C)\CC(C)CC(OC)C2OC(O)(C(C)CC2OC)C(=O)C(=O)N3CCCCC3C(=O)OC(C(C)C(O)CC1=O)/C(=C/C4CCC(O)C(C4)OC)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D04 compound treatment 707434.7826 83700.0 0.39 721778.3019 59100.0 0.31 0.4946 0.9946 907555 SMP2_000068 CC1=C[C@H]2O[C@@H]3C[C@@H](O)C(C)(C43CO4)[C@@]2(CO)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D05 compound treatment 437612.6761 -186000.0 -0.86 370185.4305 -293000.0 -1.55 -1.7039 -0.961 1962 SMP2_000069 CN(CC[C@H](N)CC(=O)N[C@H]1C=C[C@H](O[C@@H]1C(=O)O)n2ccc(N)nc2=O)C(=N)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D06 compound treatment 668657.0248 44900.0 0.21 798889.8305 136000.0 0.72 0.6574 0.8747 852250 SMP2_000070 C1CCC(NC1)c2cccnc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D07 compound treatment 748876.0684 125000.0 0.58 729258.7719 66600.0 0.35 0.6578 0.9722 3076314 SMP2_000071 O[C@@H]1C=CC(Br)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D08 compound treatment 92777.7778 -531000.0 -2.45 106203.7037 -556000.0 -2.95 -3.8184 -0.9957 3076315 SMP2_000072 OC[C@H]1O[C@H](C[C@@H]1O)n2cc(I)c(O)nc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D09 compound treatment 712721.3115 89000.0 0.41 497942.623 -165000.0 -0.87 -0.3276 -0.3394 3199389 SMP2_000073 CCCCCCCc1c(C)c(O)cc2c3ccccc3[nH]c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D10 compound treatment 733116.9355 109000.0 0.5 628664.1509 -34000.0 -0.18 0.2291 0.4276 3199390 SMP2_000074 COc1ccc(cc1)C(O)(C2CC2)c3cncnc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D11 compound treatment 589704.9808 -34000.0 -0.16 563395.6835 -99300.0 -0.53 -0.4833 -0.8795 832324 SMP2_000075 COc1cc(OC)c2c(=O)c(C)c(CC[C@@H](C)[C@@H](C)[C@@H](C)[C@@H](C)/C=C/C=C/C(=C/C)/C)oc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D12 compound treatment 664594.7137 40900.0 0.19 595091.3462 -67600.0 -0.36 -0.1202 -0.2968 2085117 SMP2_000076 COc1ccc(OC)c2c(=S)c3ccccc3[nH]c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D13 compound treatment 683472.8682 59800.0 0.28 739721.4612 77000.0 0.41 0.4838 0.9816 251 SMP2_000077 Nc1ncnc2n(cnc12)C3(CO)OC(=C)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D14 compound treatment 66404.2553 -557000.0 -2.57 66630.4348 -596000.0 -3.16 -4.0529 -0.9947 2007 SMP2_000078 CO[C@@H]1[C@@H](OC(=O)c2ccc(C)[nH]2)[C@@H](O)[C@H](CC1(C)C)Oc3ccc4CC(NC(=O)c5[nH]cc(CC(=O)Nc6cc7ccc(O[C@@H]8OC(C)(C)[C@H](OC)[C@@H](OC(=O)c9ccc(C)[nH]9)[C@H]8O)c(C)c7oc6=O)c5C)C(=O)Oc4c3C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D15 compound treatment 164673.0769 -459000.0 -2.12 267433.9623 -395000.0 -2.1 -2.9793 -1.0 751 SMP2_000079 COc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D16 compound treatment 414416.6667 -209000.0 -0.97 409463.1148 -253000.0 -1.34 -1.6322 -0.9869 3076316 SMP2_000080 Oc1cc(ccc1C(=O)c2ccccc2)N3CCOCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D17 compound treatment 645113.0435 21400.0 0.1 597121.0938 -65600.0 -0.35 -0.1761 -0.4872 3076317 SMP2_000081 CO[C@@H]1C[C@@H](CC[C@H]1O)/C=C(\C)/[C@H]2OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@]4(O)O[C@H](C[C@H](C[C@@H](C)C\C(=C/[C@@H](CC=C)C(=O)C[C@H](O)[C@H]2C)\C)OC)[C@H](C[C@H]4C)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D18 compound treatment 527485.9438 -96200.0 -0.44 101093.0233 -562000.0 -2.98 -2.4201 -0.8036 1392 SMP2_000082 CNC(C)[C@@H]1CC[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@@H]3OC[C@](C)(O)[C@H](NC)[C@H]3O)[C@H]2O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D19 compound treatment 617329.0598 -6390.0 -0.03 598337.6623 -64400.0 -0.34 -0.2622 -0.7653 610 SMP2_000083 O=S(=O)(N1CCCNCC1)c2cccc3cnccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D20 compound treatment 712979.2746 89300.0 0.41 630948.1132 -31700.0 -0.17 0.172 0.3868 3076318 SMP2_000084 Oc1nccc2c(cccc12)S(=O)(=O)N3CCCNCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D21 compound treatment 596682.243 -27000.0 -0.12 509125.6039 -154000.0 -0.81 -0.6641 -0.8059 616 SMP2_000085 COc1cc(O)c2c(=O)c(OC)c3CC(C)C(C(=O)C)c4c(OC)c(=O)c5c(O)cc(OC)c6c1c2c3c4c56 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D22 compound treatment 596482.3529 -27200.0 -0.13 468966.9421 -194000.0 -1.03 -0.8154 -0.7877 1096695 SMP2_000086 Oc1ccc(CC=C)cc1c2cc(CC=C)ccc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D23 compound treatment 633933.9623 10200.0 0.05 658037.1901 -4650.0 -0.02 0.0159 0.2984 3176136 SMP2_000087 C[C@@H]1C2NCC(C)C[C@H]2O[C@@]31CCC4C5CC=C6CC(O)CCC6(C)C5C(=O)C4=C3C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 D24 compound treatment 542239.819 -81500.0 -0.38 655910.6383 -6780.0 -0.04 -0.2911 -0.7713 3076319 SMP2_000088 Nc1nc(OCC2CCCCC2)c3[nH]cnc3n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E01 mock treatment 525787.8788 -97900.0 -0.45 541846.89 -121000.0 -0.64 -0.7726 -0.9853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E02 mock treatment 578700.9804 -45000.0 -0.21 609735.4497 -53000.0 -0.28 -0.3454 -0.9889 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E03 compound treatment 675059.4059 51300.0 0.24 802423.6453 140000.0 0.74 0.6915 0.8888 445 SMP2_000089 NC(=O)c1cccc(N)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E04 compound treatment 720647.0588 96900.0 0.45 572371.9512 -90300.0 -0.48 -0.0226 -0.0346 1057045 SMP2_000090 COC(=O)c1ccc(O)c2nc3c(C=O)c(O)cc(O)c3nc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E05 compound treatment 685383.3333 61700.0 0.28 720636.3636 57900.0 0.31 0.4184 0.9992 1949 SMP2_000091 NOC(=O)C1=CC(=C(c2ccc(O)c(c2)C(=O)ON)c3ccc(O)c(c3)C(=O)ON)C=CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E06 compound treatment 559513.6364 -64200.0 -0.3 787657.4074 125000.0 0.66 0.2593 0.3572 2180 SMP2_000092 COc1ccc(CNc2nc(NCc3ccc(OC)cc3)c4ncn(C(C)C)c4n2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E07 compound treatment 402542.8571 -221000.0 -1.02 442677.5701 -220000.0 -1.17 -1.5464 -0.9977 1020463 SMP2_000093 Oc1cc2ccc(=O)oc2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E08 compound treatment 614937.5 -8780.0 -0.04 699868.7783 37200.0 0.2 0.1108 0.5505 3076699 SMP2_000094 CN1CCC[C@H]1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E09 compound treatment 429709.0909 -194000.0 -0.89 617234.4828 -45500.0 -0.24 -0.8031 -0.8667 1694 SMP2_000095 Oc1ccc(cc1)c2sc3cc(O)ccc3c2C(=O)c4ccc(OCCN5CCCCC5)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E10 compound treatment 558232.0442 -65500.0 -0.3 710957.7465 48300.0 0.26 -0.0325 -0.0821 2345 SMP2_000096 Nc1ncnc2n(ccc12)[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E11 compound treatment 573752.4272 -50000.0 -0.23 646690.2174 -16000.0 -0.08 -0.2229 -0.9079 3199487 SMP2_000097 C[C@@H]1CC[C@@]2(C[C@H](C)C3C(=CCC4[C@@]3(C)C[C@@H](O)C5[C@](C)(CO)[C@@H](O)[C@H](O)C[C@]45C)C2[C@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E12 compound treatment 636378.7234 12700.0 0.06 770542.8571 108000.0 0.57 0.4458 0.7753 2240 SMP2_000098 CC(C)C[C@H](NP(=O)(O)OC1OC(C)C(O)C(O)C1O)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E13 compound treatment 677995.7447 54300.0 0.25 749463.964 86800.0 0.46 0.5025 0.959 1000145 SMP2_000099 NC[C@@H]1O[C@H](O[C@H]2[C@@H](O)[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4N)O[C@@H]2CO)[C@H](N)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E14 compound treatment 518483.871 -105000.0 -0.49 695572.4138 32900.0 0.17 -0.2198 -0.4263 267 SMP2_000100 CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)C=CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E15 compound treatment 548334.6457 -75400.0 -0.35 616524.7934 -46200.0 -0.24 -0.419 -0.9853 1114632 SMP2_000101 CC1OC(OCC2OC(Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)c(O)c5)C(O)C(O)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E16 compound treatment 603180.0948 -20500.0 -0.09 571072.3404 -91600.0 -0.49 -0.4106 -0.8293 1000121 SMP2_000102 C/C(=C\CO)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E17 compound treatment 737904.3478 114000.0 0.53 644643.5644 -18000.0 -0.1 0.3047 0.5692 1599897 SMP2_000103 O=c1n2CCc3c([nH]c4ccccc34)-c2nc5ccccc15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E18 compound treatment 645995.5357 22300.0 0.1 708804.0 46100.0 0.24 0.2456 0.9258 2354 SMP2_000104 COc1ccc2C3C4[C@H](CC(C)(C)OO[C@H](C=C(C)C)N4c2c1)N5C(=O)[C@@H]6CCCN6C(=O)[C@]5(O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E19 compound treatment 654455.3571 30700.0 0.14 671278.8845 8590.0 0.05 0.1325 0.8895 1001870 SMP2_000105 C/C(=C/C(=O)O)/C=C/[C@@]1(O)C(=CC(=O)CC1(C)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E20 compound treatment 760627.907 137000.0 0.63 547299.2701 -115000.0 -0.61 0.0137 0.0156 296 SMP2_000106 Nc1ncnc2N(=CNc21)C3CCCO3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E21 compound treatment 473804.3478 -150000.0 -0.69 522750.0 -140000.0 -0.74 -1.0137 -0.9994 600 SMP2_000107 COC(=O)/C=C/c1cc(O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E22 compound treatment 48770.8333 -575000.0 -2.65 59837.2093 -603000.0 -3.2 -4.1358 -0.9957 2327 SMP2_000108 CCC(C)C1NC2C=Cc3c(cc(nc3C2O)C(=O)OC(C)C(NCC(=O)c4csc(n4)C(NC(=O)c5csc(n5)/C(=C\C)/NC(=O)C(NC(=O)c6csc(n6)C7(CCC(=NC7)c8nc(cs8)C(=O)NC(=C)C(=O)NC(=C)C(=O)N)NC(=C)C(C)NC(=O)C(=C)NCC(C)NC1=O)C(C)O)C(C)(O)C(C)O)c9nccs9)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E23 compound treatment 395527.6382 -228000.0 -1.05 530394.2857 -132000.0 -0.7 -1.2403 -0.9806 3076759 SMP2_000109 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)NC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 E24 compound treatment 621615.942 -2100.0 -0.01 620342.6966 -42300.0 -0.22 -0.1657 -0.7369 3199491 SMP2_000110 C/C=C/C1OC2=C(C(=O)C[C@H](C)O2)C(=O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F01 mock treatment 754000.0 130000.0 0.6 717504.6296 54800.0 0.29 0.6304 0.9445 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F02 mock treatment 613676.9231 -10000.0 -0.05 755707.9208 93000.0 0.49 0.3161 0.638 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F03 compound treatment 633288.4615 9570.0 0.04 753009.5238 90300.0 0.48 0.37 0.769 907179 SMP2_000111 C/C(=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C1=C(C)C(=O)C(O)CC1(C)C)/C=C/C=C(\C)/C=C/C2=C(C)C(=O)C(O)CC2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F04 compound treatment 695839.196 72100.0 0.33 636892.6554 -25800.0 -0.14 0.1384 0.3849 3076760 SMP2_000112 COc1cc(O)c2c3oc4cc(O)c(O)cc4c3c(=O)oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F05 compound treatment 683521.3675 59800.0 0.28 830347.6395 168000.0 0.89 0.8238 0.8848 328 SMP2_000113 C/C=C(/C)\C=C\1/CN=C2N(CCC2(O)C1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F06 compound treatment 677675.5556 54000.0 0.25 724234.4498 61500.0 0.33 0.4068 0.991 3076761 SMP2_000114 CNCC/C=C/1\c2ccccc2CC(O)c3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F07 compound treatment 609103.3058 -14600.0 -0.07 733881.5166 71200.0 0.38 0.2194 0.5719 3199493 SMP2_000115 CCC/C=C/C=C/C(=O)O[C@H]1\C(=C\C(=O)OC)\C[C@H]2C[C@@H](OC(=O)C[C@H](O)C[C@H]3C[C@H](OC(=O)C)C(C)(C)[C@](O)(C[C@@H]4C/C(=C/C(=O)OC)/C[C@@H](O4)/C=C\C(C)(C)[C@]1(O)O2)O3)[C@@H](C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F08 compound treatment 568510.5485 -55200.0 -0.25 580478.7234 -82200.0 -0.44 -0.4883 -0.9672 1046629 SMP2_000116 Nc1cc2c3ccccc3ccc2c4ccccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F09 compound treatment 348296.875 -275000.0 -1.27 294659.5745 -368000.0 -1.95 -2.2784 -0.9783 1037664 SMP2_000117 CSCS(=O)CC(CO)NC(=O)C=Cc1c(C)nc(O)nc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F10 compound treatment 649247.8992 25500.0 0.12 757576.9231 94900.0 0.5 0.4391 0.8496 1943 SMP2_000118 CN[C@H]1[C@@H](O)[C@H]2O[C@H](O[C@@H]3[C@@H](N)C[C@@H](N)[C@H](O)[C@H]3O)[C@H](N)C[C@@H]2O[C@@H]1O[C@@]4(C)O[C@H](CO)[C@@H](N)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F11 compound treatment 633905.4545 10200.0 0.05 594434.3891 -68300.0 -0.36 -0.2228 -0.6102 3199494 SMP2_000119 CC[C@@H]1C[C@@]1(NC(=O)C2=C[C@H](CC)C[C@H]3[C@@H]2CCC3=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F12 compound treatment 102562.5 -521000.0 -2.4 72625.0 -590000.0 -3.13 -3.9125 -0.9915 1320 SMP2_000120 C[C@]1(CC[C@]2(C)CC[C@]3(C)C4=CC=C5C=C(O)C(=O)C=C5[C@]4(C)CC[C@@]3(C)[C@@H]2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F13 compound treatment 673830.0395 50100.0 0.23 781848.3755 119000.0 0.63 0.6103 0.9069 745 SMP2_000121 CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F14 compound treatment 103470.5882 -520000.0 -2.4 141647.0588 -521000.0 -2.76 -3.6506 -0.9975 2008 SMP2_000122 CC1=C(SCCO)C(=O)c2ccccc2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F15 compound treatment 653117.6471 29400.0 0.14 644927.2727 -17800.0 -0.09 0.0293 0.1772 3199495 SMP2_000123 CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](N)COP(=O)(O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F16 compound treatment 527766.2338 -95900.0 -0.44 525765.7658 -137000.0 -0.73 -0.8264 -0.9718 3076763 SMP2_000124 Oc1ccc2c(Oc3cc(O)ccc3C42OC(=O)c5ccc(Nc6nc(Cl)nc(Cl)n6)cc54)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F17 compound treatment 553355.6485 -70400.0 -0.32 679619.8347 16900.0 0.09 -0.1659 -0.4929 1433 SMP2_000125 CS(=O)(=O)c1ccc(cc1)[C@@H](O)[C@@H](CO)NC(=O)C(Cl)Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F18 compound treatment 710383.6207 86700.0 0.4 640441.6058 -22200.0 -0.12 0.1992 0.4779 1100216 SMP2_000126 CC(=CCCC(C)(OC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O)C3CCC4(C)C3C(O)CC5C6(C)CCC(OC7OC(CO)C(O)C(O)C7OC8OC(CO)C(O)C(O)C8O)C(C)(C)C6CCC54C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F19 compound treatment 623940.5405 226.0 0.0 665850.0 3160.0 0.02 0.0126 0.7497 3000453 SMP2_000127 C[C@@H]1CC2OC(=O)C(=C)C2[C@H](O)[C@@]3(C)[C@H]1C=CC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F20 compound treatment 578681.8182 -45000.0 -0.21 651207.3733 -11500.0 -0.06 -0.1899 -0.8775 3060680 SMP2_000128 Oc1ccccc1N2CC=C(NC2=O)c3cccc(c3)[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F21 compound treatment 530336.9176 -93400.0 -0.43 582527.027 -80200.0 -0.43 -0.6051 -1.0 1907753 SMP2_000129 CC[C@@H]1[C@H](C)C[C@@H]2[C@H]3C[C@H]4CCC(=O)C5=C(O)[C@H](CCCNC(=O)/C=C\C[C@@H]4[C@H]3C=C[C@@H]12)NC5=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F22 compound treatment 67215.6863 -556000.0 -2.57 49388.8889 -613000.0 -3.25 -4.1149 -0.9931 1001972 SMP2_000130 CCCC[C@@H](C)/C=C(\C)/C=C(\C)/C(=O)NC1=C[C@@](O)(\C=C\C=C\C=C\C(=O)NC2=C(O)CCC2=O)[C@@H]3O[C@@H]3C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F23 compound treatment 57309.0909 -566000.0 -2.61 67866.6667 -595000.0 -3.15 -4.0779 -0.9956 3076765 SMP2_000131 CO[C@H]1[C@@H](CC(=O)O[C@H](C)C/C=C\C=C/[C@H](O)[C@H](C)C[C@H](CC=O)[C@@H]1O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(=O)CC(C)C)[C@H](C)O3)[C@@H]([C@H]2O)N(C)C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 F24 compound treatment 550869.3694 -72800.0 -0.34 682747.7477 20100.0 0.11 -0.1623 -0.4606 288 SMP2_000132 C[C@@H]1Cc2c(Cl)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G01 mock treatment 528873.7374 -94800.0 -0.44 536521.1268 -126000.0 -0.67 -0.7825 -0.9788 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G02 mock treatment 587388.601 -36300.0 -0.17 603191.1765 -59500.0 -0.32 -0.3416 -0.9561 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G03 compound treatment 566343.75 -57400.0 -0.26 582425.641 -80300.0 -0.43 -0.4881 -0.9738 2407 SMP2_000133 CN1C(=C(O)c2ccccc2S1(=O)=O)C(=O)Nc3ncc(C)s3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G04 compound treatment 49800.0 -574000.0 -2.65 65857.1429 -597000.0 -3.17 -4.1099 -0.996 907364 SMP2_000134 CCC(C(=O)NC/C=C\C=C(\C)/C(OC)C(C)C1OC(\C=C/C=C\C=C(\C)/C(=O)c2c(O)cc[nH]c2=O)C(O)C1O)C3(O)OC(\C=C/C=C\C)C(C)(C)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G05 compound treatment 423351.3514 -200000.0 -0.92 514436.1233 -148000.0 -0.79 -1.2094 -0.9968 1978 SMP2_000135 OC(=O)/C=C/c1ccc(O)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G06 compound treatment 82928.5714 -541000.0 -2.49 88756.0976 -574000.0 -3.04 -3.916 -0.9951 3076766 SMP2_000136 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)[N+](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G07 compound treatment 501864.2534 -122000.0 -0.56 534761.3169 -128000.0 -0.68 -0.8771 -0.9956 1117 SMP2_000137 Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)cnc2[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G08 compound treatment 587764.2276 -36000.0 -0.17 641366.2551 -21300.0 -0.11 -0.1972 -0.9826 313 SMP2_000138 CCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=O)CCCCCCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G09 compound treatment 561658.5366 -62100.0 -0.29 622395.0617 -40300.0 -0.21 -0.3535 -0.9897 3076819 SMP2_000139 COCC(=O)c1ncn-2c1[C@@H]3CCNC3C(=O)c4cc(OC)ccc42 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G10 compound treatment 466027.907 -158000.0 -0.73 476338.0282 -186000.0 -0.99 -1.2131 -0.9886 3199591 SMP2_000140 CCCCCCCCCC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@@H]3C=C(C)C(=O)[C@]3(O)CC(=C[C@H]2[C@@H]4C(C)(C)[C@@]41OC(=O)CCCCCCCCC)COC(=O)Cc5ccc(O)c(OC)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G11 compound treatment 576721.4612 -47000.0 -0.22 658508.7719 -4180.0 -0.02 -0.1689 -0.7754 939 SMP2_000141 Cc1cccc(Nc2ccccc2C(=O)O)c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G12 compound treatment 90860.4651 -533000.0 -2.46 487727.2727 -175000.0 -0.93 -2.3938 -0.9113 3076821 SMP2_000142 CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](N)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G13 compound treatment 592685.259 -31000.0 -0.14 541885.7143 -121000.0 -0.64 -0.5543 -0.8442 1012954 SMP2_000143 OC(Cc1ccncc1)C(Cl)(Cl)Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G14 compound treatment 527175.0973 -96500.0 -0.45 554187.5 -109000.0 -0.58 -0.7217 -0.992 4637 SMP2_000144 C[C@@H]1C[C@]2(OC(=O)C)[C@H]([C@@H]3C=C(CO)C[C@@]4(O)[C@@H](C=C(C)C4=O)[C@@]13O)C2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G15 compound treatment 608350.3937 -15400.0 -0.07 610194.5946 -52500.0 -0.28 -0.247 -0.8596 942 SMP2_000145 OC(=O)c1ccccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G16 compound treatment 557166.0232 -66500.0 -0.31 525835.8779 -137000.0 -0.73 -0.7303 -0.9266 3199592 SMP2_000146 CCCC[C@]1(CC[C@]2(CC[C@H](C)[C@@H](C/C=C(\C)/C=C/[C@H](O)[C@@H](C)/C=C/C(=O)O)O2)O[C@H]1\C=C\C(=C\C(=O)O)\C)OC(=O)CCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G17 compound treatment 528086.9565 -95600.0 -0.44 334554.6218 -328000.0 -1.74 -1.5425 -0.8591 1011013 SMP2_000147 Nc1ccc2nc3ccc(N)cc3[s+]c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G18 compound treatment 525133.3333 -98600.0 -0.45 516324.3243 -146000.0 -0.78 -0.8704 -0.9675 3076824 SMP2_000148 NC(=O)OCC1N=C(N)N2CCC(O)(O)C32NC(=NC13)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G19 compound treatment 458869.3878 -165000.0 -0.76 492800.0 -170000.0 -0.9 -1.1747 -0.9964 3199593 SMP2_000149 COc1cc(ccc1O)[C@H]2Oc3cc(ccc3O[C@H]2CO)[C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G20 compound treatment 557557.3123 -66200.0 -0.31 510454.5455 -152000.0 -0.81 -0.7867 -0.9114 3185114 SMP2_000150 CC[C@]1(C=CCN2CC[C@]3([C@H]4N(C)c5cc(OC)ccc53)[C@@H]21)[C@@H](OC(=O)C)[C@]4(O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G21 compound treatment 548139.3035 -75600.0 -0.35 542595.7447 -120000.0 -0.64 -0.6969 -0.9597 3199594 SMP2_000151 C[C@@H]1[C@@H](O)[C@]2(O)[C@H]([C@@H]3C=C(CO)C[C@@]4(O)[C@@H](C=C(C)C4=O)[C@@]13O)C2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G22 compound treatment 563071.4286 -60600.0 -0.28 501878.9238 -161000.0 -0.85 -0.8009 -0.8922 3076825 SMP2_000152 NC(=O)C1CCCN1C(=O)C(Cc2c[nH]cn2)NC(=O)C3CCC(=O)N3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G23 compound treatment 70872.3404 -553000.0 -2.55 96400.0 -566000.0 -3.0 -3.9266 -0.9967 1095351 SMP2_000153 COC1=C(Br)C(O)C(O)(CC#N)C=C1Br 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 G24 compound treatment 432493.617 -191000.0 -0.88 451963.4703 -211000.0 -1.12 -1.4139 -0.9931 3 SMP2_000154 Oc1ccc(/C=C(\C#N)/C(=O)NCc2ccccc2)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H01 mock treatment 650091.3706 26400.0 0.12 657525.1142 -5170.0 -0.03 0.0666 0.5345 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H02 mock treatment 590714.2857 -33000.0 -0.15 647790.0 -14900.0 -0.08 -0.1635 -0.9534 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H03 compound treatment 736323.0088 113000.0 0.52 704190.0 41500.0 0.22 0.5229 0.927 3199595 SMP2_000155 CCC(C)C(NC(=O)C1CC(=O)NCC(=O)NC(Cc2ccccc2)C(=O)NC(C(C)CC)C(=O)NCC(=O)NC(Cc3c[nH]c4ccccc34)C(=O)NCC(=O)NC(CC(=O)N)C(=O)N1)C(=O)NC(Cc5ccccc5)C(=O)NCC(=O)NC(Cc6c[nH]cn6)C(=O)NC(Cc7ccc(O)cc7)C(=O)NC(CO)C(=O)NCC(=O)NC(CC(=O)O)C(=O)NC(Cc8ccccc8)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H04 compound treatment 71142.8571 -553000.0 -2.55 93517.8571 -569000.0 -3.02 -3.9366 -0.9964 1303231 SMP2_000156 CN(C)CC(O)Cn1c2ccc(Br)cc2c3cc(Br)ccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H05 compound treatment 531878.7879 -91800.0 -0.42 701426.5403 38700.0 0.21 -0.1542 -0.3276 3076826 SMP2_000157 Nc1ccccc1NC(=O)CCCCCCC(=O)Nc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H06 compound treatment 670365.2174 46700.0 0.22 679674.6032 17000.0 0.09 0.2158 0.9253 3076827 SMP2_000158 OC[C@H]1CC2CCN1CC2C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H07 compound treatment 325316.129 -298000.0 -1.38 418372.549 -244000.0 -1.3 -1.8894 -0.9995 3199596 SMP2_000159 OC(=O)c1cc(/C=C/c2ccc(/C=C/c3ccc(O)c(c3)C(=O)O)c(Br)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H08 compound treatment 78382.9787 -545000.0 -2.51 69509.0909 -593000.0 -3.15 -4.003 -0.9938 1088673 SMP2_000160 CC(C)C1NC(=O)C(NC(=O)c2cc(N)c(C)c3oc4c(C)c(=O)c(N)c(C(=O)NC5C(C)OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C6CCCN6C(=O)C(NC5=O)C(C)C)c4nc23)C(C)OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C7CCCN7C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H09 compound treatment 570522.8216 -53200.0 -0.25 628835.8209 -33900.0 -0.18 -0.3004 -0.9882 3069011 SMP2_000161 NCCC(=O)NCCc1c[nH]cn1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H10 compound treatment 552160.804 -71600.0 -0.33 682233.2016 19500.0 0.1 -0.16 -0.4627 1025 SMP2_000162 CC(C)CC(=O)OC1C(O[C@@H]2C[C@H]([C@H]3CC[C@]4(C[C@@H]5CC[C@H]4[C@]3(C)C2)[C@@H](O)C5=C)C(=O)O)OC(CO)C(OS(=O)(=O)O)C1OS(=O)(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H11 compound treatment 609602.8708 -14100.0 -0.07 583881.7204 -78800.0 -0.42 -0.3416 -0.8075 1018447 SMP2_000163 Oc1ccc2c(c1)oc3c2c(=O)oc4cc(O)ccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H12 compound treatment 567718.75 -56000.0 -0.26 590004.9505 -72700.0 -0.39 -0.4552 -0.981 1000068 SMP2_000164 CC1=C(N2[C@H](SC1)C(NC(=O)C(N)c3ccccc3)C2=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H13 compound treatment 686269.2308 62600.0 0.29 534803.4188 -128000.0 -0.68 -0.2757 -0.374 526 SMP2_000165 C[C@@H](O)[C@@H]1O[C@H]1/C=C/[C@@H]2O[C@H]2[C@H](O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H14 compound treatment 397500.0 -226000.0 -1.04 515305.0 -147000.0 -0.78 -1.2904 -0.9899 460 SMP2_000166 CCC1NC(=O)C([C@H](O)[C@H](C)C/C=C/C)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)C(C)NC(=O)C(CC(C)C)N(C)C(=O)C(NC(=O)C(CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H15 compound treatment 583979.5918 -39700.0 -0.18 551882.5758 -111000.0 -0.59 -0.5452 -0.8855 907301 SMP2_000167 CCC(C)C(O)C(C)C(=O)C(C)/C=C(\C)/CC(C)C1OC(=O)C1CC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H16 compound treatment 507206.8966 -117000.0 -0.54 514384.058 -148000.0 -0.79 -0.9361 -0.9827 3076266 SMP2_000168 CO[C@@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H17 compound treatment 532688.6447 -91000.0 -0.42 582582.9787 -80100.0 -0.42 -0.5973 -1.0 1001938 SMP2_000169 COC[C@H]1CC[C@H]2[C@@H](C)[C@@H](O)[C@H](OC3OC(COC(C)(C)C=C)[C@H](O)C(OC(=O)C)[C@@H]3O)C4=C(CC(O)[C@]4(C)C=C12)C(C)COC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H18 compound treatment 70980.3922 -553000.0 -2.55 49064.5161 -614000.0 -3.25 -4.1038 -0.9927 829 SMP2_000170 CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)c3c(C)cc4c(C(C)C)c(O)c(O)c(C=O)c4c3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H19 compound treatment 501230.4688 -122000.0 -0.56 592961.8321 -69700.0 -0.37 -0.6609 -0.9789 2334 SMP2_000171 C/C(=C\1/C(=O)NC(Cc2ccccc2)C1=O)/Nc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H20 compound treatment 567294.9153 -56400.0 -0.26 503448.2759 -159000.0 -0.84 -0.7812 -0.8839 2109 SMP2_000172 OCc1c[nH]c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H21 compound treatment 489833.9768 -134000.0 -0.62 473502.2026 -189000.0 -1.0 -1.1461 -0.9728 2106 SMP2_000173 COC1=CC(=O)C(=C(C[C@]2(C)[C@@H](C)CC[C@@]3(C)[C@H]2CCCC3=C)C1=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H22 compound treatment 602132.3529 -21600.0 -0.1 622391.1111 -40300.0 -0.21 -0.2215 -0.9395 1260 SMP2_000174 N[C@@H](Cc1ccc(cc1)N(CCCl)CCCl)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H23 compound treatment 455350.2304 -168000.0 -0.78 475988.3268 -187000.0 -0.99 -1.2492 -0.9928 3076270 SMP2_000175 C[C@]12C=Cc3occc3C2CC[C@]4(C[C@H]5CCC41)C[C@]5(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 H24 compound treatment 521930.0 -102000.0 -0.47 534300.5464 -128000.0 -0.68 -0.8134 -0.9835 3199601 SMP2_000176 CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(N)CSSCC(NC(=O)C(CC(=O)N)NC(=O)C(CCC(=O)N)NC1=O)C(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)NCC(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I01 mock treatment 552531.7073 -71200.0 -0.33 606310.6796 -56400.0 -0.3 -0.4436 -0.9989 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I02 mock treatment 599365.9794 -24300.0 -0.11 668375.0 5680.0 0.03 -0.0581 -0.4995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I03 compound treatment 815025.3807 191000.0 0.88 657147.3684 -5540.0 -0.03 0.6031 0.6832 3076271 SMP2_000177 OC(=O)/C=C/c1c[nH]c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I04 compound treatment 80119.0476 -544000.0 -2.51 68785.7143 -594000.0 -3.15 -4.0001 -0.9936 3199602 SMP2_000178 C/C(=C\CCC1=CC(=O)OC1O)/CC/C=C(\C)/CCC2=C(C)CCCC2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I05 compound treatment 42915.2542 -581000.0 -2.68 23167.8322 -640000.0 -3.39 -4.2925 -0.9932 1135 SMP2_000179 OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I06 compound treatment 679582.4742 55900.0 0.26 601384.2105 -61300.0 -0.33 -0.0477 -0.1151 252 SMP2_000180 CCCCCCOC(=O)[C@]1(O)C[C@H]2O[C@@]1(C)n3c4ccccc4c5c6CNC(=O)c6c7c8ccccc8n2c7c35 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I07 compound treatment 741581.1966 118000.0 0.54 527158.1395 -136000.0 -0.72 -0.124 -0.1375 3076272 SMP2_000181 COC(=O)C1=CO[C@@H](O[C@@H]2OC(CO)[C@H](O)[C@@H](O)[C@H]2O)[C@H]3[C@@H]1CC=C3CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I08 compound treatment 712322.87 88600.0 0.41 679436.1233 16700.0 0.09 0.3518 0.8412 3199603 SMP2_000182 CCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=O)CCCCCCCCCCCCCCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I09 compound treatment 609550.4202 -14200.0 -0.07 635833.3333 -26900.0 -0.14 -0.1469 -0.9375 2129 SMP2_000183 OCC(O)C1OC(=O)C(=C1O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I10 compound treatment 469515.4185 -154000.0 -0.71 604711.1111 -58000.0 -0.31 -0.7203 -0.9297 3199692 SMP2_000184 CCCCCCCCC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@@H]3C=C(C)C(=O)[C@]3(O)CC(=C[C@H]2[C@@H]4C(C)(C)[C@@]41OC(=O)CCCCCCCC)COC(=O)Cc5ccc(O)c(OC)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I11 compound treatment 472260.0733 -151000.0 -0.7 449011.7188 -214000.0 -1.13 -1.2953 -0.973 1865 SMP2_000185 Clc1cccc(Nc2nnc(c3ccccc3)c4ccccc24)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I12 mock treatment 551064.7482 -72600.0 -0.34 646199.2188 -16500.0 -0.09 -0.2988 -0.8628 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I13 compound treatment 740092.3695 116000.0 0.54 585995.8506 -76700.0 -0.41 0.0919 0.1364 3472730 SMP2_000186 CC12CCC3C(CC=C4CC(O)CCC34C)C2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I14 compound treatment 538070.632 -85600.0 -0.39 530862.9032 -132000.0 -0.7 -0.7737 -0.9634 3076274 SMP2_000187 Oc1ccc(cc1)C2COc3cc(O)ccc3C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I15 compound treatment 247217.3913 -376000.0 -1.74 478735.5372 -184000.0 -0.98 -1.9176 -0.9629 2288 SMP2_000188 CC(=CCC(O)C1=CC(=O)c2c(O)ccc(O)c2C1=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I16 compound treatment 567531.1355 -56200.0 -0.26 534172.7941 -129000.0 -0.68 -0.6652 -0.9122 3199693 SMP2_000189 COC(C(C)C1CC(O)C2(C)OC2/C=C\C(C)C3CC(CC(=O)O3)CC4OC4C(=O)O1)C(=CC=CC(=Cc5coc(C)n5)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I17 compound treatment 562290.0763 -61400.0 -0.28 548157.0881 -115000.0 -0.61 -0.6299 -0.9397 1025605 SMP2_000190 OCCN(CCO)CCO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I18 compound treatment 511890.0 -112000.0 -0.52 491853.6585 -171000.0 -0.91 -1.0054 -0.9643 3060146 SMP2_000191 Oc1ccc(cc1)c2nc(c([nH]2)c3ccc(F)cc3)c4ccncc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I19 compound treatment 593684.8739 -30000.0 -0.14 649626.4591 -13100.0 -0.07 -0.1469 -0.9488 1874 SMP2_000192 Oc1cccc2c(O)nccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I20 compound treatment 513948.2072 -110000.0 -0.51 555396.4758 -107000.0 -0.57 -0.7603 -0.9983 1080610 SMP2_000193 COc1ccc(O)c2c(=O)c3c(OC)cc4OC5OC=CC5c4c3oc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I21 compound treatment 572306.383 -51400.0 -0.24 538366.0714 -124000.0 -0.66 -0.6339 -0.9046 2290 SMP2_000194 C[C@]1(CC(N)CCC(N)C(=O)O)O[C@](C)([C@@H](O)[C@H]1O)n2cnc3c(N)ncnc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I22 compound treatment 91150.9434 -533000.0 -2.46 109867.9245 -553000.0 -2.93 -3.81 -0.9961 3076167 SMP2_000195 CC(C)C1OC(=O)C2=CCCN2C(=O)c3coc(CC(=O)C[C@H](O)/C=C(/C)\C=C/CNC(=O)\C=C/C1C)n3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I23 compound treatment 508144.7368 -116000.0 -0.53 448164.1791 -215000.0 -1.14 -1.1814 -0.9403 1077786 SMP2_000196 CC(C)CC1N2C(=O)C(NC(=O)C3CN(C)C4Cc5c[nH]c6cccc(C4=C3)c56)(OC2(O)C7CCCN7C1=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 I24 compound treatment 64071.4286 -560000.0 -2.58 66577.7778 -596000.0 -3.16 -4.0607 -0.9949 325 SMP2_000197 N/C(=C(/C#N)\C(=C(/N)\Sc1ccccc1N)\C#N)/Sc2ccccc2N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J01 mock treatment 636170.8333 12500.0 0.06 723447.0046 60800.0 0.32 0.2685 0.8202 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J02 mock treatment 614909.5238 -8800.0 -0.04 727105.7692 64400.0 0.34 0.2129 0.6187 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J03 compound treatment 729386.9347 106000.0 0.49 631414.5299 -31300.0 -0.17 0.2273 0.4415 3076170 SMP2_000198 OC[C@@H]1[C@@H](O)[C@H](O)[C@H]2[C@@H](O)CCN12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J04 compound treatment 686694.5607 63000.0 0.29 669942.029 7250.0 0.04 0.2326 0.7938 677 SMP2_000199 C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc2ccncc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J05 compound treatment 777132.1586 153000.0 0.71 628474.5763 -34200.0 -0.18 0.372 0.5092 2060246 SMP2_000200 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H](C/C=C/3\[C@H](O)COC3=O)C(=C)CCC12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J06 compound treatment 572752.2523 -51000.0 -0.24 629146.4646 -33500.0 -0.18 -0.292 -0.9906 414 SMP2_000201 CC1CNCCN1S(=O)(=O)c2cccc3cnccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J07 compound treatment 588898.2301 -34800.0 -0.16 691502.5126 28800.0 0.15 -0.0055 -0.0247 1972 SMP2_000202 COC(=O)/C(=C\Nc1ccc(Oc2ccccc2OC(C)C)nc1)/NC(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J08 compound treatment 638991.3043 15300.0 0.07 810266.3934 148000.0 0.78 0.6033 0.7676 3189311 SMP2_000203 CC(=O)OCC1=C(N2[C@H](SC1)[C@H](N)C2=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J09 compound treatment 65327.8688 -558000.0 -2.58 50056.1798 -613000.0 -3.25 -4.1185 -0.9934 2109607 SMP2_000204 CC(C)c1cc2CC[C@H]3C(C)(C)CCC[C@]3(C(=O)O)c2c(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J10 compound treatment 411659.7938 -212000.0 -0.98 526855.7214 -136000.0 -0.72 -1.2009 -0.9887 1960 SMP2_000205 CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J11 compound treatment 517881.4815 -106000.0 -0.49 673718.4874 11000.0 0.06 -0.3038 -0.6179 3199694 SMP2_000206 CC1[C@H]2NC[C@@H](C)C[C@H]2O[C@@]31CC[C@H]4[C@@H]5CC=C6C[C@@H](O)CC[C@]6(C)[C@H]5CC4=C3C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J12 compound treatment 56409.0909 -567000.0 -2.62 46642.8571 -616000.0 -3.27 -4.1604 -0.9939 874122 SMP2_000207 COc1c(O)c2c(=O)cc3OCOc4cc(O)c5c(=O)c(OC)c(CC(C)O)c6c(c1CC(C)O)c2c3c4c56 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J13 compound treatment 583860.7595 -39900.0 -0.18 885560.8696 223000.0 1.18 0.7059 0.5901 1301 SMP2_000208 OCCN(CCO)c1nc(N2CCCCC2)c3nc(nc(N4CCCCC4)c3n1)N(CCO)CCO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J14 compound treatment 734073.3591 110000.0 0.51 582323.3083 -80400.0 -0.43 0.0585 0.0881 1001900 SMP2_000209 Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J15 compound treatment 607517.9856 -16200.0 -0.07 589211.5385 -73500.0 -0.39 -0.3284 -0.8276 2056 SMP2_000210 CC(C)CC(NC(=O)NC(C1CCNC(=N1)N)C(=O)NC(CCC(=O)N)C(=O)NC(C)C=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J16 compound treatment 687153.8462 63400.0 0.29 582097.4359 -80600.0 -0.43 -0.0954 -0.1842 599 SMP2_000211 Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J17 compound treatment 515905.9829 -108000.0 -0.5 463004.2553 -200000.0 -1.06 -1.1005 -0.9406 162 SMP2_000212 CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J18 compound treatment 473515.0376 -150000.0 -0.69 489475.6554 -173000.0 -0.92 -1.1394 -0.9903 3076285 SMP2_000213 CN1C(=O)/C(=C/2\Nc3ccccc3\C2=N\O)/c4ccc(Br)cc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J19 compound treatment 625439.2857 1730.0 0.01 488345.5882 -174000.0 -0.92 -0.6483 -0.701 3199695 SMP2_000214 CC1O[C@@H](O[C@H]2C[C@@H](C=O)C3C(CCC4C3CC[C@]5(C)[C@H](CC[C@]45O)c6ccc(=O)oc6)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O[C@@H]7OC(CO)[C@@H](O)[C@@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J20 compound treatment 524841.8803 -98900.0 -0.46 544251.9685 -118000.0 -0.63 -0.7666 -0.9876 3076287 SMP2_000215 COc1cc(O)c(CC=C(C)C)c2OC(CC(=O)c12)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J21 compound treatment 336928.5714 -287000.0 -1.32 77844.8276 -585000.0 -3.1 -3.1286 -0.9278 2411 SMP2_000216 NCC1O[C@@H](O[C@@H]2[C@H](N)C[C@@H](N)C(O[C@H]3OC(CO)[C@@H](O)[C@@H](N)[C@H]3O)C2O)[C@H](N)C[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J22 compound treatment 56500.0 -567000.0 -2.62 54627.1186 -608000.0 -3.23 -4.1302 -0.9946 3199697 SMP2_000217 CCC(=O)O[C@H]1C(C)O[C@](C)(C[C@]1(C)O)O[C@@H]2C(C)O[C@@H](CO[C@@H]3[C@@H](C)[C@@H](CC(=O)O[C@H](C)C/C=C\C=C/[C@H](O)[C@H](C)C[C@@H]3CC(=O)C)OC(=O)CC)[C@H](O)[C@@H]2N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J23 compound treatment 64461.5385 -559000.0 -2.58 58413.0435 -604000.0 -3.21 -4.09 -0.9942 3076290 SMP2_000218 C[C@@H]1[C@H](O)[C@@H](C)[C@H]2O[C@@H]1CC[C@H](C)/C=C(/C)\C[C@@H](C)C[C@H](C)[C@]3(O)OC4=C(C)C(=O)C(=C2C4=C3)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 J24 compound treatment 492814.3939 -131000.0 -0.6 512398.4375 -150000.0 -0.8 -0.9905 -0.9906 3199698 SMP2_000219 CC(NC(=O)C(NC(=O)c1nc(nc(N)c1C)C(CC(=O)N)NCC(N)C(=O)N)C(OC2OC(CO)C(O)C(O)C2(C)OC3OC(CO)C(O)C(O)(C3O)C(=O)N)c4cnc[nH]4)C(O)C(C)C(=O)NC(C(=O)C)C(=O)NCCC5=NC(CS5)c6nc(cs6)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K01 mock treatment 588782.9787 -34900.0 -0.16 617066.6667 -45600.0 -0.24 -0.285 -0.9804 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K02 mock treatment 696850.4673 73100.0 0.34 713437.7682 50700.0 0.27 0.4288 0.9938 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K03 compound treatment 541018.7793 -82700.0 -0.38 636108.4337 -26600.0 -0.14 -0.3694 -0.9084 3076443 SMP2_000220 CC(C)CCC[C@@H](C)C1CCC2C3C(O)C=C4CC(O)CCC4(C)C3CCC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K04 compound treatment 614136.9863 -9580.0 -0.04 671572.5806 8880.0 0.05 0.0021 0.0322 25 SMP2_000221 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)COP(=O)(O)OCC[N+](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K05 compound treatment 639916.3498 16200.0 0.07 668165.1376 5470.0 0.03 0.0734 0.9152 3076448 SMP2_000222 CCC1=CC2C[C@@H]3c4[nH]c5ccccc5c4CCN(C2)[C@@]31C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K06 compound treatment 70512.1951 -553000.0 -2.55 146095.2381 -517000.0 -2.74 -3.7414 -0.9994 309 SMP2_000223 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K07 compound treatment 75867.9245 -548000.0 -2.53 93058.8235 -570000.0 -3.02 -3.9229 -0.996 1000097 SMP2_000224 Cc1c(C)c2OC(C)(COc3ccc(CC4SC(=O)NC4=O)cc3)CCc2c(C)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K08 compound treatment 456976.7442 -167000.0 -0.77 525880.2817 -137000.0 -0.73 -1.0568 -0.9996 2113458 SMP2_000225 CCC(=O)NCCc1c2scnc2c3nccc4c5ccccc5[nH]c1c43 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K09 compound treatment 625995.7627 2280.0 0.01 631845.3039 -30800.0 -0.16 -0.1082 -0.6603 3076491 SMP2_000226 CCCCCCCCCCCCCCCC(=O)OCC(O)[C@H]1OC(=O)C(=C1O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K10 compound treatment 612827.4112 -10900.0 -0.05 680382.4701 17700.0 0.09 0.0309 0.2899 3184 SMP2_000227 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@@H]2O/C(=C\CCCC(=O)O)/C[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K11 compound treatment 63302.3256 -560000.0 -2.58 53912.2807 -609000.0 -3.23 -4.1107 -0.9939 1313 SMP2_000228 Oc1ccc(Cl)cc1C(=O)Nc2ccc(cc2Cl)[N+](=O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K12 compound treatment 550717.4721 -73000.0 -0.34 532744.898 -130000.0 -0.69 -0.7254 -0.9457 3199699 SMP2_000229 CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(O)ccc4[nH]3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K13 compound treatment 635211.0727 11500.0 0.05 649133.9713 -13600.0 -0.07 -0.0134 -0.1495 2709 SMP2_000230 Cc1ncc(CO)c(CO)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K14 compound treatment 621433.1551 -2280.0 -0.01 608988.5057 -53700.0 -0.28 -0.2088 -0.7327 3076498 SMP2_000231 CC1CC2OC2/C=C\C=C/C(=O)Cc3c(Cl)c(O)cc(O)c3C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K15 compound treatment 542556.1798 -81200.0 -0.37 547048.913 -116000.0 -0.61 -0.6984 -0.9719 3076544 SMP2_000232 CCN(CC)CCCC(C)Nc1nc(C)cc(Nc2ccc3nc(C)cc(N)c3c2)n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K16 compound treatment 452372.2944 -171000.0 -0.79 516837.6963 -146000.0 -0.77 -1.1058 -0.9999 633 SMP2_000233 OC(=O)c1cc(ccc1O)N(Cc2ccccc2O)Cc3ccccc3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K17 compound treatment 566920.6349 -56800.0 -0.26 605316.0173 -57400.0 -0.3 -0.4004 -0.9972 3199700 SMP2_000234 CC1OC2OC3[C@@H](O)[C@@H](O)CO[C@H]3OC(=O)[C@@]45CCC(C)(C)C[C@H]5C6=CC[C@@H]7[C@@]8(C)C[C@H](O)[C@H](O[C@@H]9OC(CO)[C@@H](O)[C@H](O)C9O[C@@H]%10OC[C@@H](OC(=O)C[C@](C)(O)CC(=O)O[C@@H]1C(O[C@@H]%11OC[C@@H](O)[C@H](O)C%11O)[C@@H]2O)C(O)C%10O)[C@@](C)(CO)[C@@H]8CC[C@@]7(C)[C@]6(C)CC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K18 compound treatment 523504.0323 -100000.0 -0.46 544960.9375 -118000.0 -0.62 -0.7683 -0.989 3076548 SMP2_000235 NC1N=CC(=N1)[C@H]2[C@H](CNC(=O)c3cc(Br)c[nH]3)[C@@H](CNC(=O)c4cc(Br)c[nH]4)[C@@H]2C5=NC(N)N=C5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K19 compound treatment 582225.5193 -41500.0 -0.19 563519.7133 -99200.0 -0.53 -0.5072 -0.9062 3076550 SMP2_000236 CCCCC[C@H](O)[C@H](SCC(N)C(=O)O)/C=C/C=C/C=C\C/C=C\CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K20 compound treatment 548693.0233 -75000.0 -0.35 754830.5085 92100.0 0.49 0.1009 0.1686 3199701 SMP2_000237 CO[C@@H]1C[C@H](C)O[C@@H](CC[C@H](C)[C@H](O)[C@H](C)[C@H]2OC(=O)/C=C\C(=C/C[C@@H](O)C[C@@H]3CCC[C@@H](C[C@H](OC)[C@@H](C)[C@@H](O)C[C@@H](O)[C@H](C)[C@H](OC(=O)/C=C\C(=C/C[C@@H](O)C[C@@H]4CCC[C@@H](CC(OC)[C@@H](C)[C@@H](O)C[C@@H](O)[C@@H]2C)O4)\C)[C@@H](C)[C@@H](O)[C@@H](C)CC[C@H]5C[C@@H](C[C@H](C)O5)OC)O3)\C)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K21 compound treatment 556895.6522 -66800.0 -0.31 621599.0099 -41100.0 -0.22 -0.372 -0.9856 3076553 SMP2_000238 CC(C)CCC[C@@H](C)[C@H]1C[C@H](O)C2=C3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K22 compound treatment 460553.719 -163000.0 -0.75 215619.7183 -447000.0 -2.37 -2.2088 -0.8879 2329 SMP2_000239 C[C@@H]1C[C@@]2(OC3(Cc4ccccc4)O[C@@H]2[C@@H]5C=C(COC(=O)Cc6ccc(O)cc6)C[C@@]7(O)[C@@H](C=C(C)C7=O)[C@@]15O3)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K23 compound treatment 558348.5714 -65400.0 -0.3 542825.0 -120000.0 -0.64 -0.6627 -0.9419 1000035 SMP2_000240 O=C1c2ccccc2-c3n[nH]c4cccc1c34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 K24 compound treatment 417594.0594 -206000.0 -0.95 458804.1958 -204000.0 -1.08 -1.4368 -0.9979 1100080 SMP2_000241 OCC1OC(C(O)C1O)n2cccnc2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L01 mock treatment 761686.6359 138000.0 0.64 733508.9286 70800.0 0.38 0.7155 0.9684 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L02 mock treatment 770570.0483 147000.0 0.68 737158.4158 74500.0 0.39 0.7582 0.9671 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L03 compound treatment 911610.0 288000.0 1.33 866439.8148 204000.0 1.08 1.703 0.9948 155 SMP2_000242 CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC[C@@H](NC[C@@H](N)CS)C(C)C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L04 compound treatment 637013.2743 13300.0 0.06 754469.7674 91800.0 0.49 0.3876 0.7899 410 SMP2_000243 CC(=N)NCc1cccc(CN)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L05 compound treatment 802268.0 179000.0 0.82 818503.7879 156000.0 0.83 1.1666 1.0 1000029 SMP2_000244 CSCCC(NC(=O)C(CC(C)C)NC(=O)C(Cc1c[nH]cn1)NC(=O)CNC(=O)C(NC(=O)C(C)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCC(=O)N)NC(=O)C(CC(=O)N)NC(=O)CNC(=O)C(CC(C)C)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCC(=O)N)NC(=O)C4CCC(=O)N4)C(C)C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L06 compound treatment 648613.2813 24900.0 0.11 693763.6364 31100.0 0.16 0.1977 0.9844 3199703 SMP2_000245 CCC1OC2(C[C@@H]3CC(C/C=C(/C)\C(O[C@@H]4C[C@@H](C)C(O[C@H]5C[C@H](OC)C(O)[C@H](C)O5)[C@H](C4)OC)C(C)\C=C/C=C\6/COC7C6[C@@H](C=C(C)[C@H]7O)C(=O)O3)O2)C=CC1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L07 compound treatment 690776.8924 67100.0 0.31 713561.4754 50900.0 0.27 0.4095 0.9977 3076615 SMP2_000246 COC1/C=C\C=C(\C)/Cc2cc(OC)c(Cl)c(c2)N(C)C(=O)CC(OC(=O)C(C)C)C3(C)OC3C(C)C4CC1(O)NC(=O)O4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L08 compound treatment 737605.4054 114000.0 0.53 706198.9529 43500.0 0.23 0.5346 0.9318 3199793 SMP2_000247 CCN1C[C@]2(COC)CCC(OC)[C@]3(C4C[C@@]5(O)[C@H](OC(=O)c6ccc(OC)cc6)C4[C@](C[C@H]5OC)(OC(=O)C)[C@H]7[C@H](OC)C32)[C@@H]71 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L09 compound treatment 165567.0103 -458000.0 -2.11 107190.4762 -555000.0 -2.95 -3.5774 -0.9867 1983 SMP2_000248 CC(C)c1cc2C3CC4C(C)(C)CCCC4(C(=O)O3)c2c(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L10 compound treatment 791863.6364 168000.0 0.78 875230.0469 213000.0 1.13 1.3454 0.9833 3199794 SMP2_000249 C[C@@H]1C[C@H]2[C@@H](CC[C@@H]3C[C@@H](O)CC[C@@]32C)[C@]45O[C@@H]5[C@H](OC(=O)C)[C@@H](C14)c6ccc(=O)oc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L11 compound treatment 642851.145 19100.0 0.09 759622.0472 96900.0 0.51 0.4259 0.8165 3199795 SMP2_000250 CC1C2C(Cc3ccccc3)NC(=O)C24C(/C=C\CC(C)CC(C)(O)/C=C\C4O)C(O)C1=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L12 compound treatment 667592.9825 43900.0 0.2 764529.6804 102000.0 0.54 0.525 0.9102 964 SMP2_000251 CN(C)N=Nc1[nH]cnc1C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L13 compound treatment 38700.0 -585000.0 -2.7 48431.3726 -614000.0 -3.26 -4.2115 -0.9956 3076672 SMP2_000252 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)C(O)C2O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L14 compound treatment 282452.381 -341000.0 -1.57 268271.7391 -394000.0 -2.09 -2.5921 -0.9902 1001931 SMP2_000253 C[C@@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]2CC[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L15 compound treatment 644514.5985 20800.0 0.1 653906.367 -8780.0 -0.05 0.0349 0.3271 831956 SMP2_000254 COc1c(O)ccc2c1cc([N+](=O)[O-])c3c(cc4OCOc4c23)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L16 compound treatment 525498.0695 -98200.0 -0.45 595964.4444 -66700.0 -0.35 -0.5705 -0.9926 604 SMP2_000255 Oc1c(Br)cc(/C=C\2/C3C=C(I)C=CC3NC2=O)cc1Br 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L17 compound treatment 660656.0 36900.0 0.17 615929.6875 -46800.0 -0.25 -0.0549 -0.1825 3199797 SMP2_000256 C[C@@]1([C@H]2[C@H](C(=O)O)[C@]3(CC4CC[C@H]3[C@@]52CC[C@@H]1O)CC4=C)C(=O)O5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L18 compound treatment 45367.3469 -578000.0 -2.67 61644.4444 -601000.0 -3.19 -4.1402 -0.9961 604 SMP2_000257 Oc1c(Br)cc(/C=C\2/C3C=C(I)C=CC3NC2=O)cc1Br 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L19 compound treatment 855524.6305 232000.0 1.07 654478.6885 -8210.0 -0.04 0.7251 0.6777 97 SMP2_000258 CCCCC/C=C\C[C@@H]1O[C@H]1\C=C\C(O)C/C=C\CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L20 compound treatment 570488.806 -53200.0 -0.25 515198.6063 -147000.0 -0.78 -0.7267 -0.8864 3199798 SMP2_000259 CC1CC(OC2C(O)C(O)C(O)C(O)C2O)C(N)CC1NC(=N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L21 compound treatment 547687.2727 -76000.0 -0.35 513612.1495 -149000.0 -0.79 -0.807 -0.933 2108 SMP2_000260 COc1cc2C/C(=C\c3cc(C)c(O)c(C)c3)/C(=O)c2c(N)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L22 compound treatment 523250.0 -100000.0 -0.46 553403.1621 -109000.0 -0.58 -0.7375 -0.9938 440 SMP2_000261 COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3cccs3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L23 compound treatment 58111.1111 -566000.0 -2.61 65058.8235 -598000.0 -3.17 -4.0858 -0.9953 1201 SMP2_000262 COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 L24 compound treatment 444737.8277 -179000.0 -0.83 436307.3394 -226000.0 -1.2 -1.4327 -0.9833 648 SMP2_000263 Oc1cc(O)cc(/C=C/c2ccc(O)c(O)c2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M01 mock treatment 563347.6395 -60400.0 -0.28 549718.0617 -113000.0 -0.6 -0.6206 -0.9392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M02 mock treatment 632957.5472 9240.0 0.04 739480.0 76800.0 0.41 0.3181 0.7769 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M03 compound treatment 597952.9412 -25800.0 -0.12 498478.4314 -164000.0 -0.87 -0.6999 -0.7962 549 SMP2_000264 Nc1ncnc2nc(cc(c3cccc(Br)c3)c12)c4ccc(nc4)N5CCOCC5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M04 compound treatment 556059.0717 -67700.0 -0.31 602361.3861 -60300.0 -0.32 -0.4469 -0.9999 1092656 SMP2_000265 CC1OC(CC(=O)O)CC2=C1C(=O)c3c(O)cccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M05 compound treatment 785338.29 162000.0 0.75 700295.082 37600.0 0.2 0.6681 0.8659 1000067 SMP2_000266 NC(C(=O)NC1[C@H]2SCC(=C(N2C1=O)C(=O)O)Cl)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M06 compound treatment 59619.0476 -564000.0 -2.6 61000.0 -602000.0 -3.19 -4.0961 -0.9949 535 SMP2_000267 ONC(=O)CCCN1C(=O)c2cccc3cccc(C1=O)c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M07 compound treatment 503028.0374 -121000.0 -0.56 562635.9649 -100000.0 -0.53 -0.7688 -0.9997 3177114 SMP2_000268 CN(C)c1cc2c(Nc3ccc4n(Cc5ccccc5)ncc4c3)ncnc2cn1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M08 compound treatment 105771.3178 -518000.0 -2.39 114221.374 -548000.0 -2.91 -3.746 -0.9952 241 SMP2_000269 CC[C@@H](C)[C@@H](CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCS(=O)(=O)C)C(=O)OC(C)C)NCC(N)CS 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M09 compound treatment 701500.0 77800.0 0.36 666478.2609 3790.0 0.02 0.2679 0.7455 3076808 SMP2_000270 CC1(C)[C@H]2C[C@@H]1C(=C)[C@H](O)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M10 compound treatment 734409.0909 111000.0 0.51 740442.953 77800.0 0.41 0.6526 0.9944 220 SMP2_000271 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M11 compound treatment 226650.7937 -397000.0 -1.83 181698.1132 -481000.0 -2.55 -3.0987 -0.9868 1579 SMP2_000272 CC(Cc1ccc(O)c(O)c1)C(C)Cc2ccc(O)c(O)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M12 compound treatment 507904.918 -116000.0 -0.53 566077.7778 -96600.0 -0.51 -0.74 -0.9998 284 SMP2_000273 OC(=O)c1cc(ccc1O)N(Cc2ccccc2O)Cc3cc(O)ccc3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M13 compound treatment 663386.2816 39700.0 0.18 703199.0741 40500.0 0.21 0.2813 0.9968 3076815 SMP2_000274 CC(O)CCCCn1c(=O)n(C)c2ncn(C)c2c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M14 compound treatment 457149.6063 -167000.0 -0.77 507314.1361 -155000.0 -0.82 -1.1259 -0.9994 1102317 SMP2_000275 COc1ccc(cc1)C23Oc4cc(OC)cc(OC)c4C3(O)C(O)C(C2c5ccccc5)C(=O)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M15 compound treatment 582879.1209 -40800.0 -0.19 619473.1183 -43200.0 -0.23 -0.2952 -0.9952 1907751 SMP2_000276 CN/C(=N\c1ccc(cc1)C2=NNC(=O)CC2C)/NC#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M16 compound treatment 610105.0725 -13600.0 -0.06 620193.0502 -42500.0 -0.23 -0.2038 -0.8709 536 SMP2_000277 ONC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M17 compound treatment 74600.0 -549000.0 -2.53 100380.9524 -562000.0 -2.98 -3.8996 -0.9967 3076873 SMP2_000278 COc1cc(O)c(CC=C(C)C)c(O)c1C(=O)/C=C/c2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M18 compound treatment 151516.2455 -472000.0 -2.18 193149.2537 -470000.0 -2.49 -3.3008 -0.9978 536 SMP2_000279 ONC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M19 compound treatment 478767.7903 -145000.0 -0.67 578085.7143 -84600.0 -0.45 -0.79 -0.9812 3199800 SMP2_000280 CC(C)CCC[C@@H](C)[C@H]1CC(=O)[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M20 compound treatment 544170.2128 -79500.0 -0.37 542943.7229 -120000.0 -0.64 -0.7085 -0.966 3199801 SMP2_000281 CO[C@@H]([C@H](O)CC(=O)[C@@H](C)[C@@H](O)CC[C@@H](C)C1O[C@]2(CC[C@@H](C)C(CC[C@H](C)C(=O)C)O2)CC[C@@H]1C)[C@H](OC(=O)C[C@@H](O)C3=C(C)C(=O)OC3=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M21 compound treatment 536267.5439 -87400.0 -0.4 515193.5484 -147000.0 -0.78 -0.8383 -0.9525 257 SMP2_000282 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1CC(=O)CCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M22 compound treatment 915555.5556 292000.0 1.35 684721.519 22000.0 0.12 1.0343 0.7656 3076883 SMP2_000283 CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(N)CSSCC(NC(=O)C(CC(=O)N)NC(=O)C(CCC(=O)N)NC1=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M23 compound treatment 507245.1362 -116000.0 -0.54 553946.7456 -109000.0 -0.58 -0.7876 -0.9994 2059 SMP2_000284 CC(C)CC(N)C(O)C(=O)NC(C(C)C)C(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 M24 compound treatment 396246.8085 -227000.0 -1.05 437442.1769 -225000.0 -1.19 -1.5865 -0.9979 2350 SMP2_000285 Cc1c(C)c2OC(C)(CN3CCN(CC3)c4cc(nc(n4)N5CCCC5)N6CCCC6)CCc2c(C)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N01 mock treatment 678723.5023 55000.0 0.25 67969.697 -595000.0 -3.15 -2.0511 -0.6481 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N02 mock treatment 751471.3656 128000.0 0.59 802122.2707 139000.0 0.74 0.9395 0.9937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N03 compound treatment 787379.6992 164000.0 0.75 744592.4171 81900.0 0.43 0.8409 0.9656 3076955 SMP2_000286 CC(C)(C)[C@]1(O)C[C@@H]2OC(=O)CC23C(=O)O[C@@H]4OC(=O)[C@H](O)C413 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N04 compound treatment 560805.4054 -62900.0 -0.29 606070.1754 -56600.0 -0.3 -0.4175 -0.9999 907302 SMP2_000287 CN1CC[C@]2(C)C1N(C)c3ccc(O)cc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N05 compound treatment 609134.3874 -14600.0 -0.07 629550.8475 -33100.0 -0.18 -0.1718 -0.9131 3199802 SMP2_000288 CSC(=S)NCc1c[nH]c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N06 compound treatment 737665.1376 114000.0 0.53 688278.481 25600.0 0.14 0.4676 0.8615 398 SMP2_000289 OC[C@H]1NC[C@@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N07 compound treatment 622770.2128 -944.0 0.0 667474.5763 4780.0 0.03 0.0149 0.5774 1975 SMP2_000290 C[C@@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@@]43C)[C@@]2(O)CC[C@@H]1c5ccc(=O)oc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N08 compound treatment 555040.404 -68700.0 -0.32 644810.8108 -17900.0 -0.09 -0.291 -0.8802 1026746 SMP2_000291 OCc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N09 compound treatment 634625.0 10900.0 0.05 759409.5238 96700.0 0.51 0.3983 0.7728 810 SMP2_000292 CCCCC[C@@H]1[C@@H](OC(=O)CC(C)C)[C@H](C)OC(=O)[C@@H](NC(=O)c2cccc(NC=O)c2O)[C@@H](C)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N10 compound treatment 649613.8614 25900.0 0.12 754309.3923 91600.0 0.49 0.4281 0.8554 3176068 SMP2_000293 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N11 compound treatment 552760.1626 -71000.0 -0.33 615190.4762 -47500.0 -0.25 -0.4095 -0.9917 2018 SMP2_000294 NC1=NC(=O)/C(=C/2\CCNC(=O)c3[nH]ccc23)/N1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N12 compound treatment 50943.3962 -573000.0 -2.64 76863.6364 -586000.0 -3.11 -4.0649 -0.9967 1090 SMP2_000295 CCC[C@@H]1C[C@H](N(C)C1)C(=O)NC(C(C)Cl)C2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N13 compound treatment 647539.8551 23800.0 0.11 729556.6038 66900.0 0.35 0.3285 0.8847 3199804 SMP2_000296 CC(C)CC(NC(=O)C(Cc1ccc(OP(O)(O)O)cc1)NC(=O)C2CCCN2C(=O)C)C(=O)NC(CCCCN)C(=O)NC(C(C)O)C(=O)NC(CCCCN)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N14 compound treatment 48294.1177 -575000.0 -2.65 62083.3333 -601000.0 -3.19 -4.129 -0.9959 1000674 SMP2_000297 COc1cccc2C(=O)c3c(O)c4CC(O)(CC(OC5CC(N)C(O)C(C)O5)c4c(O)c3C(=O)c12)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N15 compound treatment 71723.4043 -552000.0 -2.55 93441.8605 -569000.0 -3.02 -3.935 -0.9964 1084811 SMP2_000298 Cc1c2[nH]c3ccc(O)cc3c2c(C)c4cnccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N16 compound treatment 462920.1681 -161000.0 -0.74 459294.686 -203000.0 -1.08 -1.2872 -0.9833 3077040 SMP2_000299 CC(C)[C@H]1CN2CCC[C@H]2[C@@]3(O)O[C@](CC(=O)[C@H]4CN(C)[C@@H]5Cc6c[nH]c7cccc(C5=C4)c67)(C(C)C)C(=O)N13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N17 compound treatment 570068.4932 -53600.0 -0.25 602354.8387 -60300.0 -0.32 -0.4012 -0.9919 1108916 SMP2_000300 NCCCCC(NC(=O)C(Cc1c[nH]cn1)NC(=O)CN)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N18 compound treatment 723189.781 99500.0 0.46 868452.381 206000.0 1.09 1.0961 0.9259 3177114 SMP2_000301 CN(C)c1cc2c(Nc3ccc4n(Cc5ccccc5)ncc4c3)ncnc2cn1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N19 compound treatment 584711.1913 -39000.0 -0.18 631762.4521 -30900.0 -0.16 -0.2432 -0.9989 3076041 SMP2_000302 COc1cc(/C=C/c2cccc[n+]2C)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N20 compound treatment 496053.6398 -128000.0 -0.59 528823.5294 -134000.0 -0.71 -0.9184 -0.9957 1734 SMP2_000303 Nc1nnc(c(N)n1)c2cccc(Cl)c2Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N21 compound treatment 520268.1992 -103000.0 -0.48 666758.8933 4070.0 0.02 -0.3221 -0.6744 3076048 SMP2_000304 OC[C@H]1O[C@@H](Oc2c[nH]c3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N22 compound treatment 162797.1014 -461000.0 -2.13 103176.4706 -560000.0 -2.97 -3.6015 -0.9866 1000089 SMP2_000305 COC1C(C)OC(OC2CC(C)(O)C(C(=O)OC)c3cc4C(=O)c5c6OC7OC(C)(C(O)C(C7O)N(C)C)c6cc(O)c5C(=O)c4c(O)c23)C(OC)C1(C)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N23 compound treatment 580202.1661 -43500.0 -0.2 664857.1429 2170.0 0.01 -0.1338 -0.6655 628 SMP2_000306 Brc1ccc2[nH]c-3c(CC(=O)Nc4ccccc34)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 N24 compound treatment 476050.5837 -148000.0 -0.68 537912.8788 -125000.0 -0.66 -0.9495 -0.9999 1273 SMP2_000307 C[C@@]12CC(=O)C3C(CCC4=CC(=O)C=C[C@]34C)C2CC[C@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O01 mock treatment 539304.721 -84400.0 -0.39 552104.3478 -111000.0 -0.59 -0.69 -0.9802 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O02 mock treatment 536796.2085 -86900.0 -0.4 549337.6068 -113000.0 -0.6 -0.7086 -0.9806 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O03 compound treatment 631243.5897 7530.0 0.03 664638.5542 1950.0 0.01 0.0319 0.8794 1059696 SMP2_000308 CC1CCC2(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O04 compound treatment 630367.7686 6650.0 0.03 567000.0 -95700.0 -0.51 -0.3372 -0.6631 988 SMP2_000309 COc1ccc2[nH]cc(CCNC(=O)C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O05 compound treatment 553766.0377 -69900.0 -0.32 680011.4068 17300.0 0.09 -0.1631 -0.4864 413 SMP2_000310 CCCCCC[C@@H]([C@@H](C)O)n1cnc2c(N)ncnc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O06 compound treatment 593228.0 -30500.0 -0.14 635240.5063 -27400.0 -0.15 -0.2024 -0.9998 3199805 SMP2_000311 NC(=O)OC[C@H]1[C@@H]2NC(=N)N[C@]23N(CCC3(O)O)C(=N)N1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O07 compound treatment 859197.3684 235000.0 1.09 821650.7937 159000.0 0.84 1.3641 0.9922 2081802 SMP2_000312 CC[C@@]1(O)C(=O)OCc2c1cc3-c4nc5ccc(O)c(CN(C)C)c5cc4Cn3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O08 compound treatment 598318.9655 -25400.0 -0.12 608991.4894 -53700.0 -0.28 -0.2842 -0.9229 1080649 SMP2_000313 CC1(CC2(O)OC3O1)C4(CC2C34COC(=O)c5ccccc5)OC6OC(CO)C(O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O09 compound treatment 551750.0 -72000.0 -0.33 603674.0088 -59000.0 -0.31 -0.456 -0.9996 3076119 SMP2_000314 CNc1ccc2ccccc2c1N=Nc3ccc(N=Nc4ccccc4)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O10 compound treatment 642886.5546 19200.0 0.09 651273.5426 -11400.0 -0.06 0.0197 0.1838 1072985 SMP2_000315 CC1C(O)C2(O)C(C3C=C(CO)CC4(O)C(C=C(C)C4=O)C13O)C2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O11 compound treatment 639476.9231 15800.0 0.07 722909.0909 60200.0 0.32 0.2773 0.8464 3076122 SMP2_000316 CC(=C[C@H](C=C)C(C)(C)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O12 compound treatment 722138.0952 98400.0 0.45 751121.7391 88400.0 0.47 0.6526 0.9999 3001166 SMP2_000317 C[C@H]/1CC[C@@H]2C[C@H](C[C@@](O)(O2)[C@@H]3CSC(=O)N3)OC(=O)\C=C(\C)/CC/C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O13 compound treatment 537967.3469 -85700.0 -0.4 589681.4815 -73000.0 -0.39 -0.5534 -0.9999 189 SMP2_000318 CCCCCC(O)c1cccc(OCc2ccc3ccccc3n2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O14 compound treatment 646037.9747 22300.0 0.1 644389.5582 -18300.0 -0.1 0.0042 0.0294 3199895 SMP2_000319 CSCCC(NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(Cc1ccc(O)cc1)NC(=O)C(Cc2ccccc2)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCC(=O)O)NC(=O)C3CCCN3C(=O)C(CC(=O)N)NC(=O)C4CCCN4C(=O)C(N)CCCCN)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O15 compound treatment 53022.2222 -571000.0 -2.63 69255.8139 -593000.0 -3.15 -4.0866 -0.996 2305 SMP2_000320 COC1=C(N)C(=O)c2nc(ccc2C1=O)c3nc(C(=O)O)c(C)c(c3N)c4ccc(OC)c(OC)c4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O16 compound treatment 565139.8305 -58600.0 -0.27 562867.1875 -99800.0 -0.53 -0.5654 -0.9512 3076126 SMP2_000321 Nc1ncnc2n([C@@H]3OC4COP(O)(S)O[C@@H]4C3O)c(nc12)N5CCCCC5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O17 compound treatment 516717.1717 -107000.0 -0.49 530981.8182 -132000.0 -0.7 -0.8429 -0.9855 2080871 SMP2_000322 CC1=C(O)C(=O)[C@@H]2O[C@@H]2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O18 compound treatment 368003.5971 -256000.0 -1.18 327275.3036 -335000.0 -1.78 -2.0918 -0.9801 3076175 SMP2_000323 COc1cc(ccc1O)[C@H]2Oc3cc(ccc3O[C@@H]2CO)[C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O19 compound treatment 236335.9375 -387000.0 -1.79 380554.2169 -282000.0 -1.5 -2.3214 -0.9961 3199896 SMP2_000324 CC(C)CCC[C@@H](C)[C@H]1CC(=O)C2=C3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O20 compound treatment 520896.0 -103000.0 -0.47 508739.8374 -154000.0 -0.82 -0.9127 -0.9666 3076177 SMP2_000325 COc1cc(ccc1O)c2cc(=O)c3c(O)cc(OC4OC(CO)C(O)C(O)C4OS(=O)(=O)O)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O21 compound treatment 620975.2066 -2740.0 -0.01 711371.0407 48700.0 0.26 0.1736 0.6717 2119025 SMP2_000326 Nc1nc(S)c2nc[nH]c2n1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O22 compound treatment 472336.9963 -151000.0 -0.7 513007.7519 -150000.0 -0.79 -1.055 -0.9979 2081802 SMP2_000327 CC[C@@]1(O)C(=O)OCc2c1cc3-c4nc5ccc(O)c(CN(C)C)c5cc4Cn3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O23 compound treatment 48565.2174 -575000.0 -2.65 105680.8511 -557000.0 -2.95 -3.9646 -0.9986 316 SMP2_000328 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 O24 compound treatment 58604.6512 -565000.0 -2.61 68275.0 -594000.0 -3.15 -4.0721 -0.9955 1004963 SMP2_000329 CC1CCC2(CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P01 mock treatment 619878.6611 -3840.0 -0.02 613811.3208 -48900.0 -0.26 -0.1958 -0.7536 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P02 mock treatment 566680.7512 -57000.0 -0.26 619562.7907 -43100.0 -0.23 -0.3477 -0.9976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P03 compound treatment 570660.2871 -53100.0 -0.24 647367.9654 -15300.0 -0.08 -0.2305 -0.894 3199897 SMP2_000330 CS[C@]12CC3=CC=CC(O)[C@H]3N2C(=O)[C@@](CO)(SC)N(C)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P04 compound treatment 595309.6234 -28400.0 -0.13 625285.0877 -37400.0 -0.2 -0.2329 -0.9797 2060488 SMP2_000331 CC(=CCC[C@@](C)(O)C=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P05 compound treatment 640015.6863 16300.0 0.08 636200.0 -26500.0 -0.14 -0.0462 -0.2899 1968 SMP2_000332 C[C@@H]1CC2OC3CC4OC(=O)C=C(C)C4O[C@@]3(C)CC2OC5CC[C@@]6(C)O[C@@]7(C)CC8OC9CC%10O[C@@]%11(C)[C@@H](O)C[C@@H](CC(=C)C=O)OC%11CC%10OC9C=CC[C@]8(C)OC7CC6OC15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P06 compound treatment 592754.386 -31000.0 -0.14 574765.5502 -87900.0 -0.47 -0.4307 -0.8831 1000053 SMP2_000333 OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P07 compound treatment 481847.1074 -142000.0 -0.65 478494.0239 -184000.0 -0.98 -1.1534 -0.981 1977 SMP2_000334 CC12CCc3occc3[C@H]2CCC4(CC5CC[C@H]41)C[C@]5(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P08 compound treatment 572472.5738 -51200.0 -0.24 581418.3267 -81300.0 -0.43 -0.4719 -0.96 1693 SMP2_000335 NCCCNCCSP(=O)(O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P09 compound treatment 561690.1408 -62000.0 -0.29 584500.0 -78200.0 -0.41 -0.4955 -0.9836 3199899 SMP2_000336 CC[C@@H]1[C@H](O)[C@@H](C)C/C(=C\C=C/C(=C(\OC(=O)\C(=C/C(=C\[C@H](C)C1O)/C)\OC)/[C@@H](C)[C@@H](O)[C@H](C)[C@@]2(O)C[C@@H](OC3CC(O)C(OC(=O)N)C(C)O3)[C@H](C)[C@H](O2)/C=C/C)/OC)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P10 compound treatment 602080.9717 -21600.0 -0.1 596583.3333 -66100.0 -0.35 -0.3185 -0.8736 446 SMP2_000337 COc1cc(CNC(=O)CCCC/C=C/C(C)C)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P11 compound treatment 397554.1126 -226000.0 -1.04 553927.8351 -109000.0 -0.58 -1.1454 -0.961 360 SMP2_000338 Oc1ccc(cc1)c2cc(=O)c3c(O)cc(O)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P12 compound treatment 296181.8182 -328000.0 -1.51 288547.9452 -374000.0 -1.98 -2.4713 -0.9909 3068886 SMP2_000339 CC(C)/N=c/1\cc2n(c3ccc(Cl)cc3)c4ccccc4nc2cc1Nc5ccc(Cl)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P13 compound treatment 537884.1202 -85800.0 -0.4 576637.1308 -86100.0 -0.46 -0.6026 -0.9975 1817 SMP2_000340 CC(=O)O[C@@]12CO[C@H]2C[C@@H](O)[C@@]3(C)[C@H]1[C@H](OC(=O)c4ccccc4)[C@@]5(O)C[C@H](OC(=O)[C@@H](O)[C@H](NC(=O)OC(C)(C)C)c6ccccc6)C(=C([C@H](O)C3=O)C5(C)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P14 compound treatment 482901.9608 -141000.0 -0.65 528408.867 -134000.0 -0.71 -0.9628 -0.9989 3076236 SMP2_000341 COc1ccc(C=Cc2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P15 compound treatment 517003.69 -107000.0 -0.49 591374.5455 -71300.0 -0.38 -0.6154 -0.9916 832320 SMP2_000342 CC[C@H](C)[C@H](NC(=O)[C@H]([C@@H](C)CC)N(C)C(=O)C)C(=O)N[C@@H](C(=O)C)C(=O)N[C@@H](CC(C)C)[C@@]1(O)O[C@H](C)[C@H](N[C@@]1(C)CO)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P16 compound treatment 553148.3051 -70600.0 -0.33 523194.3128 -139000.0 -0.74 -0.7533 -0.932 2069 SMP2_000343 CC12CCC3C(CCC4=C(O)C(=O)CCC34C)C2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P17 compound treatment 509528.8889 -114000.0 -0.53 512506.0729 -150000.0 -0.8 -0.9356 -0.9798 3199902 SMP2_000344 CCC(C)C(NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C2CCCN2C(=O)C(C)NC(=O)C(N)CO)C(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)NC(Cc4ccccc4)C(=O)NCC(=O)NC(Cc5ccccc5)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P18 compound treatment 505122.2707 -119000.0 -0.55 495501.8587 -167000.0 -0.89 -1.0138 -0.973 2100 SMP2_000345 COC(=O)CC(O)(CCCC(C)(C)O)C(=O)O[C@H]1[C@H]2c3cc4OCOc4cc3CCN5CCC[C@]25C=C1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P19 compound treatment 379378.7234 -244000.0 -1.13 379129.9213 -284000.0 -1.5 -1.8602 -0.9899 613 SMP2_000346 Oc1cc(/C=C/c2ccc(O)c(O)c2)oc(=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P20 compound treatment 532897.2332 -90800.0 -0.42 458707.5099 -204000.0 -1.08 -1.0612 -0.9147 3076242 SMP2_000347 CC1(C)O[C@H]2CC(=O)OC[C@]23[C@H]4CC[C@@](C)([C@@H](OC5OC(CO)C(O)C(O)C5O)c6ccoc6)[C@@]7(O[C@@H]7C(=O)O)[C@]4(C)C(=O)C[C@]13C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P21 compound treatment 514809.1286 -109000.0 -0.5 513458.1818 -149000.0 -0.79 -0.9148 -0.9759 3199903 SMP2_000348 C/C=C(/C)\C(=O)O[C@H]1C(=C[C@]2([C@H](C)C[C@H]3[C@@H](C3(C)C)[C@]4(C)C=C(CO)[C@@H](O)[C@@]12O)C4=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P22 compound treatment 441153.5714 -183000.0 -0.84 531348.3146 -131000.0 -0.7 -1.0879 -0.9956 1048361 SMP2_000349 c1ccc2c(c1)[nH]c3cnccc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P23 compound treatment 451018.9394 -173000.0 -0.8 456021.5054 -207000.0 -1.1 -1.3383 -0.9877 832145 SMP2_000350 OC[C@@H]1[C@@H](O)[C@H](O)[C@H](O)[C@H]2NC(=O)C(=O)N21 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2099 P24 compound treatment 434397.7273 -189000.0 -0.87 491458.3333 -171000.0 -0.91 -1.2595 -0.9998 2260 SMP2_000351 Cc1cc(O)c2c(=O)c3c(O)cc(O)c4c5c(O)cc(O)c6c(=O)c7c(O)cc(CO)c8c1c2c(c34)c(c65)c78 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A01 compound treatment 514543.7788 -49700.0 -0.23 456470.5882 -120000.0 -0.64 -0.6132 -0.9046 Starr1.2_000001 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A02 compound treatment 559405.4054 -4860.0 -0.02 572674.1071 -4060.0 -0.02 -0.0311 -0.9998 Starr1.2_000002 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A03 compound treatment 770238.0952 206000.0 0.95 674421.8009 97700.0 0.52 1.038 0.9594 Starr1.2_000003 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A04 compound treatment 567030.0429 2760.0 0.01 679540.9091 103000.0 0.55 0.3946 0.7234 Starr1.2_000004 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A05 compound treatment 714241.8605 150000.0 0.69 635236.9668 58500.0 0.31 0.7084 0.9346 Starr1.2_000005 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A06 compound treatment 763202.8986 199000.0 0.92 814140.0966 237000.0 1.26 1.5391 0.9879 Starr1.2_000006 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A07 compound treatment 300115.3846 -264000.0 -1.22 299571.4286 -277000.0 -1.47 -1.9009 -0.9956 Starr1.2_000007 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A08 compound treatment 653178.3784 88900.0 0.41 515535.0 -61200.0 -0.32 0.0604 0.1155 Starr1.2_000008 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A09 compound treatment 616781.3953 52500.0 0.24 643263.1579 66500.0 0.35 0.4207 0.9831 Starr1.2_000009 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A10 compound treatment 697397.1963 133000.0 0.61 676766.055 100000.0 0.53 0.8093 0.9974 Starr1.2_000010 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A11 compound treatment 748638.8889 184000.0 0.85 610509.0909 33800.0 0.18 0.7279 0.8377 Starr1.2_000011 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A12 compound treatment 537377.907 -26900.0 -0.12 553352.9412 -23400.0 -0.12 -0.1754 -1.0 Starr1.2_000012 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A13 compound treatment 468566.2651 -95700.0 -0.44 400904.1096 -176000.0 -0.93 -0.9715 -0.9416 Starr1.2_000013 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A14 compound treatment 80583.3333 -484000.0 -2.23 63062.5 -514000.0 -2.72 -3.5038 -0.9951 Starr1.2_000014 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A15 compound treatment 539547.0085 -24700.0 -0.11 688373.2719 112000.0 0.59 0.3381 0.5607 Starr1.2_000015 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A16 compound treatment 720000.0 156000.0 0.72 724564.6552 148000.0 0.78 1.0622 0.999 Starr1.2_000016 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A17 compound treatment 611082.9694 46800.0 0.22 600792.3729 24100.0 0.13 0.2429 0.9685 Starr1.2_000017 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A18 compound treatment 428312.5 -136000.0 -0.63 518520.8333 -58200.0 -0.31 -0.6617 -0.9468 Starr1.2_000018 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A19 compound treatment 717054.5455 153000.0 0.7 639328.9474 62600.0 0.33 0.733 0.941 Starr1.2_000019 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A20 compound treatment 712692.3077 148000.0 0.68 706092.233 129000.0 0.69 0.9691 1.0 Starr1.2_000020 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A21 compound treatment 96290.9091 -468000.0 -2.16 82200.0 -495000.0 -2.62 -3.3808 -0.9953 Starr1.2_000021 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A22 compound treatment 562846.7742 -1420.0 -0.01 501606.2992 -75100.0 -0.4 -0.2864 -0.7186 Starr1.2_000022 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A23 mock treatment 560757.732 -3510.0 -0.02 601444.4444 24700.0 0.13 0.0812 0.6151 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 A24 mock treatment 717173.7089 153000.0 0.71 585351.0204 8610.0 0.05 0.5309 0.7513 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B01 compound treatment 474296.748 -90000.0 -0.41 545079.602 -31700.0 -0.17 -0.4121 -0.9207 Starr1.2_000023 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B02 compound treatment 263532.1101 -301000.0 -1.39 58440.0 -518000.0 -2.75 -2.9245 -0.9498 Starr1.2_000024 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B03 compound treatment 707756.7568 143000.0 0.66 736975.6098 160000.0 0.85 1.0689 0.9923 Starr1.2_000025 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B04 compound treatment 589355.102 25100.0 0.12 617067.2269 40300.0 0.21 0.2331 0.9584 Starr1.2_000026 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B05 compound treatment 736764.9573 172000.0 0.8 564244.7257 -12500.0 -0.07 0.5156 0.646 Starr1.2_000027 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B06 compound treatment 663148.0 98900.0 0.46 616065.0407 39300.0 0.21 0.4699 0.9372 Starr1.2_000028 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B07 compound treatment 63891.8919 -500000.0 -2.31 63298.5075 -513000.0 -2.72 -3.5573 -0.9966 Starr1.2_000029 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B08 compound treatment 827896.3964 264000.0 1.22 685668.1614 109000.0 0.58 1.2682 0.9422 Starr1.2_000030 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B09 compound treatment 619399.0385 55100.0 0.25 434813.0081 -142000.0 -0.75 -0.3525 -0.4437 Starr1.2_000031 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B10 compound treatment 743973.6842 180000.0 0.83 679927.4194 103000.0 0.55 0.973 0.9797 Starr1.2_000032 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B11 compound treatment 702406.5041 138000.0 0.64 566586.3454 -10200.0 -0.05 0.4124 0.645 Starr1.2_000033 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B12 compound treatment 336478.7234 -228000.0 -1.05 167070.5882 -410000.0 -2.17 -2.2793 -0.9444 Starr1.2_000034 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B13 compound treatment 710706.6116 146000.0 0.68 603890.3509 27200.0 0.14 0.5794 0.839 Starr1.2_000035 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B14 compound treatment 458661.1111 -106000.0 -0.49 465756.9061 -111000.0 -0.59 -0.7606 -0.9956 Starr1.2_000036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B15 compound treatment 537947.8261 -26300.0 -0.12 564631.3559 -12100.0 -0.06 -0.1312 -0.9557 Starr1.2_000037 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B16 compound treatment 512747.7064 -51500.0 -0.24 635014.7059 58300.0 0.31 0.0506 0.1297 Starr1.2_000038 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B17 compound treatment 734228.3465 170000.0 0.78 729307.6923 153000.0 0.81 1.1264 0.9999 Starr1.2_000039 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B18 compound treatment 749546.2555 185000.0 0.85 728365.9574 152000.0 0.8 1.1729 0.9995 Starr1.2_000040 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B19 compound treatment 250095.2381 -314000.0 -1.45 359144.3299 -218000.0 -1.15 -1.8406 -0.9937 Starr1.2_000041 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B20 compound treatment 756004.3103 192000.0 0.88 763919.6787 187000.0 0.99 1.3273 0.9983 Starr1.2_000042 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B21 compound treatment 621967.2131 57700.0 0.27 428473.1707 -148000.0 -0.79 -0.3679 -0.4432 Starr1.2_000043 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B22 compound treatment 530708.6093 -33600.0 -0.15 454093.9597 -123000.0 -0.65 -0.5694 -0.8516 Starr1.2_000044 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B23 mock treatment 553604.3478 -10700.0 -0.05 692054.2986 115000.0 0.61 0.3977 0.6482 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 B24 mock treatment 529649.1228 -34600.0 -0.16 655577.9468 78800.0 0.42 0.1828 0.4084 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C01 compound treatment 502812.1827 -61500.0 -0.28 555261.3065 -21500.0 -0.11 -0.281 -0.9198 Starr1.2_000045 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C02 compound treatment 611112.1495 46800.0 0.22 647081.0811 70300.0 0.37 0.4166 0.9662 Starr1.2_000046 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C03 compound treatment 565941.7476 1670.0 0.01 425557.1429 -151000.0 -0.8 -0.5615 -0.7003 Starr1.2_000047 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C04 compound treatment 738466.3677 174000.0 0.8 804393.9394 228000.0 1.21 1.4219 0.9804 Starr1.2_000048 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C05 compound treatment 721524.4444 157000.0 0.73 700038.0952 123000.0 0.65 0.9752 0.9987 Starr1.2_000049 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C06 compound treatment 70712.1212 -494000.0 -2.28 82968.75 -494000.0 -2.62 -3.4613 -0.9976 Starr1.2_000050 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C07 compound treatment 225934.2105 -338000.0 -1.56 297708.3333 -279000.0 -1.48 -2.1498 -0.9997 Starr1.2_000051 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C08 compound treatment 688183.4061 124000.0 0.57 647238.3178 70500.0 0.37 0.6685 0.9789 Starr1.2_000052 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C09 compound treatment 700403.9409 136000.0 0.63 515500.0 -61200.0 -0.32 0.2143 0.3031 Starr1.2_000053 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C10 compound treatment 700600.939 136000.0 0.63 608026.4317 31300.0 0.17 0.5619 0.8642 Starr1.2_000054 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C11 compound treatment 673222.2222 109000.0 0.5 355023.4375 -222000.0 -1.18 -0.4763 -0.3724 Starr1.2_000055 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C12 compound treatment 734730.7692 170000.0 0.79 553289.4737 -23400.0 -0.12 0.4679 0.5879 Starr1.2_000056 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C13 compound treatment 295388.1579 -269000.0 -1.24 267595.7447 -309000.0 -1.64 -2.0362 -0.9905 Starr1.2_000057 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C14 compound treatment 78738.0952 -486000.0 -2.24 65800.0 -511000.0 -2.71 -3.4995 -0.9955 Starr1.2_000058 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C15 compound treatment 121493.3333 -443000.0 -2.04 94850.7463 -482000.0 -2.56 -3.2512 -0.9938 Starr1.2_000059 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C16 compound treatment 545053.4759 -19200.0 -0.09 615447.6744 38700.0 0.21 0.0825 0.369 Starr1.2_000060 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C17 compound treatment 672642.5121 108000.0 0.5 636298.3193 59600.0 0.32 0.5768 0.9755 Starr1.2_000061 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C18 compound treatment 538277.5665 -26000.0 -0.12 490020.1613 -86700.0 -0.46 -0.41 -0.8626 Starr1.2_000062 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C19 compound treatment 623785.7143 59500.0 0.27 721157.6577 144000.0 0.77 0.7357 0.9042 Starr1.2_000063 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C20 compound treatment 272815.3846 -291000.0 -1.34 481284.2105 -95500.0 -0.51 -1.3084 -0.911 Starr1.2_000064 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C21 compound treatment 732640.9091 168000.0 0.78 701257.384 125000.0 0.66 1.0161 0.9968 Starr1.2_000065 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C22 compound treatment 310061.7284 -254000.0 -1.17 295753.0864 -281000.0 -1.49 -1.8828 -0.9929 Starr1.2_000066 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C23 mock treatment 615353.9095 51100.0 0.24 712642.8571 136000.0 0.72 0.6763 0.8918 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 C24 mock treatment 614105.9322 49800.0 0.23 600532.4074 23800.0 0.13 0.2518 0.9602 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D01 compound treatment 505165.9193 -59100.0 -0.27 526918.9189 -49800.0 -0.26 -0.3796 -0.9999 Starr1.2_000067 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D02 compound treatment 425641.3043 -139000.0 -0.64 434091.8367 -143000.0 -0.76 -0.987 -0.9965 Starr1.2_000068 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D03 compound treatment 645498.0843 81200.0 0.37 758292.5764 182000.0 0.96 0.9458 0.9154 Starr1.2_000069 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D04 compound treatment 661848.3607 97600.0 0.45 564213.9738 -12500.0 -0.07 0.2712 0.5963 Starr1.2_000070 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D05 compound treatment 616881.2785 52600.0 0.24 719065.1163 142000.0 0.75 0.7054 0.8896 Starr1.2_000071 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D06 compound treatment 630938.8646 66700.0 0.31 685646.8085 109000.0 0.58 0.6259 0.9564 Starr1.2_000072 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D07 compound treatment 287134.6154 -277000.0 -1.28 342196.0784 -235000.0 -1.24 -1.7834 -0.9999 Starr1.2_000073 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D08 compound treatment 627523.2068 63300.0 0.29 649835.6808 73100.0 0.39 0.4804 0.9902 Starr1.2_000074 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D09 compound treatment 574248.1203 9980.0 0.05 517837.5 -58900.0 -0.31 -0.1884 -0.5965 Starr1.2_000075 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D10 compound treatment 799231.8841 235000.0 1.08 856694.5455 280000.0 1.48 1.8162 0.988 Starr1.2_000076 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D11 compound treatment 581825.6881 17600.0 0.08 582784.5528 6050.0 0.03 0.0799 0.9178 Starr1.2_000077 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D12 compound treatment 56075.4717 -508000.0 -2.34 51750.0 -525000.0 -2.78 -3.6261 -0.9963 Starr1.2_000078 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D13 compound treatment 754267.2811 190000.0 0.88 611110.6383 34400.0 0.18 0.7485 0.8363 Starr1.2_000079 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D14 compound treatment 705517.1103 141000.0 0.65 698366.1972 122000.0 0.65 0.9168 1.0 Starr1.2_000080 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D15 compound treatment 449133.3333 -115000.0 -0.53 546629.2135 -30100.0 -0.16 -0.4884 -0.8808 Starr1.2_000081 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D16 compound treatment 153925.9259 -410000.0 -1.89 151301.8868 -425000.0 -2.26 -2.9337 -0.9962 Starr1.2_000082 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D17 compound treatment 676158.4906 112000.0 0.52 674466.3677 97700.0 0.52 0.7314 1.0 Starr1.2_000083 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D18 compound treatment 475384.9057 -88900.0 -0.41 635565.5738 58800.0 0.31 -0.0692 -0.1344 Starr1.2_000084 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D19 compound treatment 724097.0464 160000.0 0.74 619764.4788 43000.0 0.23 0.6826 0.8846 Starr1.2_000085 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D20 compound treatment 558887.0056 -5380.0 -0.02 467765.7143 -109000.0 -0.58 -0.4263 -0.7368 Starr1.2_000086 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D21 compound treatment 441488.2813 -123000.0 -0.57 559337.5 -17400.0 -0.09 -0.4656 -0.8117 Starr1.2_000087 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D22 compound treatment 591990.5213 27700.0 0.13 570477.6119 -6260.0 -0.03 0.0669 0.5066 Starr1.2_000088 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D23 mock treatment 600715.5172 36400.0 0.17 583445.7364 6710.0 0.04 0.144 0.8382 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 D24 mock treatment 626967.3469 62700.0 0.29 609303.6437 32600.0 0.17 0.3266 0.9697 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E01 compound treatment 515879.7814 -48400.0 -0.22 494720.0 -82000.0 -0.44 -0.4654 -0.9519 Starr1.2_000089 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E02 compound treatment 592344.0367 28100.0 0.13 632096.1538 55400.0 0.29 0.2992 0.9323 Starr1.2_000090 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E03 compound treatment 830469.0265 266000.0 1.23 665806.6038 89100.0 0.47 1.2021 0.9139 Starr1.2_000091 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E04 compound treatment 785023.3645 221000.0 1.02 782793.2692 206000.0 1.09 1.4927 0.9994 Starr1.2_000092 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E05 compound treatment 616201.6129 51900.0 0.24 784356.0976 208000.0 1.1 0.948 0.8412 Starr1.2_000093 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E06 compound treatment 729290.1786 165000.0 0.76 752912.4424 176000.0 0.93 1.1989 0.9948 Starr1.2_000094 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E07 compound treatment 598063.2911 33800.0 0.16 593933.3333 17200.0 0.09 0.1747 0.9674 Starr1.2_000095 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E08 compound treatment 705714.2857 141000.0 0.65 802004.4248 225000.0 1.19 1.3061 0.9595 Starr1.2_000096 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E09 compound treatment 503768.9076 -60500.0 -0.28 585871.2871 9130.0 0.05 -0.163 -0.5757 Starr1.2_000097 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E10 compound treatment 650902.6549 86600.0 0.4 550210.9705 -26500.0 -0.14 0.183 0.4321 Starr1.2_000098 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E11 compound treatment 520565.0407 -43700.0 -0.2 689721.3115 113000.0 0.6 0.2812 0.4448 Starr1.2_000099 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E12 compound treatment 759572.6496 195000.0 0.9 736333.3333 160000.0 0.85 1.2354 0.9995 Starr1.2_000100 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E13 compound treatment 301322.9814 -263000.0 -1.21 388847.561 -188000.0 -1.0 -1.5621 -0.9953 Starr1.2_000101 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E14 compound treatment 53293.1035 -511000.0 -2.36 64272.7273 -512000.0 -2.72 -3.5882 -0.9975 Starr1.2_000102 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E15 compound treatment 602246.7532 38000.0 0.18 612258.3893 35500.0 0.19 0.2571 0.9993 Starr1.2_000103 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E16 compound treatment 566233.3333 1970.0 0.01 590668.1034 13900.0 0.07 0.0586 0.7879 Starr1.2_000104 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E17 compound treatment 598412.844 34100.0 0.16 669064.7773 92300.0 0.49 0.4576 0.8896 Starr1.2_000105 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E18 compound treatment 685246.8085 121000.0 0.56 653884.7737 77100.0 0.41 0.6838 0.9884 Starr1.2_000106 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E19 compound treatment 663790.2439 99500.0 0.46 558459.3496 -18300.0 -0.1 0.256 0.5457 Starr1.2_000107 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E20 compound treatment 659218.75 95000.0 0.44 486744.5887 -90000.0 -0.48 -0.0279 -0.0431 Starr1.2_000108 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E21 compound treatment 649734.1772 85500.0 0.39 681491.1504 105000.0 0.56 0.6716 0.9859 Starr1.2_000109 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E22 compound treatment 93126.9841 -471000.0 -2.17 235446.1538 -341000.0 -1.81 -2.8164 -0.9959 Starr1.2_000110 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E23 mock treatment 580525.5814 16300.0 0.07 622122.807 45400.0 0.24 0.2232 0.8854 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 E24 mock treatment 631781.6594 67500.0 0.31 621681.1594 44900.0 0.24 0.3887 0.9913 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F01 compound treatment 739117.9775 175000.0 0.81 567693.3962 -9050.0 -0.05 0.5362 0.6639 Starr1.2_000111 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F02 compound treatment 307706.5217 -257000.0 -1.18 312000.0 -265000.0 -1.4 -1.8295 -0.9964 Starr1.2_000112 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F03 compound treatment 891111.1111 327000.0 1.51 719489.5833 143000.0 0.76 1.6012 0.9493 Starr1.2_000113 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F04 compound treatment 724184.5494 160000.0 0.74 615376.0684 38600.0 0.2 0.6664 0.8706 Starr1.2_000114 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F05 compound treatment 740504.7619 176000.0 0.81 727698.1132 151000.0 0.8 1.1409 1.0 Starr1.2_000115 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F06 compound treatment 329850.9317 -234000.0 -1.08 492927.8351 -83800.0 -0.44 -1.0787 -0.9229 Starr1.2_000116 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F07 compound treatment 639425.5319 75200.0 0.35 482000.0 -94700.0 -0.5 -0.1102 -0.1806 Starr1.2_000117 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F08 compound treatment 548286.3636 -16000.0 -0.07 511505.5351 -65200.0 -0.35 -0.2968 -0.8389 Starr1.2_000118 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F09 compound treatment 700944.206 137000.0 0.63 606285.7143 29500.0 0.16 0.5565 0.8568 Starr1.2_000119 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F10 compound treatment 521246.3054 -43000.0 -0.2 458852.1739 -118000.0 -0.63 -0.5824 -0.8879 Starr1.2_000120 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F11 compound treatment 468049.6183 -96200.0 -0.44 579889.313 3150.0 0.02 -0.3019 -0.68 Starr1.2_000121 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F12 compound treatment 352611.9403 -212000.0 -0.98 511992.0 -64700.0 -0.34 -0.933 -0.9017 Starr1.2_000122 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F13 compound treatment 518278.0749 -46000.0 -0.21 649226.8041 72500.0 0.38 0.1219 0.2776 Starr1.2_000123 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F14 compound treatment 629596.8379 65300.0 0.3 665439.8496 88700.0 0.47 0.5457 0.9768 Starr1.2_000124 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F15 compound treatment 668497.992 104000.0 0.48 667264.3678 90500.0 0.48 0.6794 1.0 Starr1.2_000125 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F16 compound treatment 480975.9615 -83300.0 -0.38 502004.0161 -74700.0 -0.4 -0.5519 -0.9999 Starr1.2_000126 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F17 compound treatment 585988.8889 21700.0 0.1 640454.8611 63700.0 0.34 0.3098 0.8789 Starr1.2_000127 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F18 compound treatment 604344.8276 40100.0 0.18 523609.6654 -53100.0 -0.28 -0.0686 -0.2035 Starr1.2_000128 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F19 compound treatment 558396.7391 -5870.0 -0.03 591707.2072 15000.0 0.08 0.037 0.441 Starr1.2_000129 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F20 compound treatment 494943.8202 -69300.0 -0.32 435784.8101 -141000.0 -0.75 -0.7547 -0.9282 Starr1.2_000130 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F21 compound treatment 476462.1514 -87800.0 -0.4 449012.0 -128000.0 -0.68 -0.7654 -0.9697 Starr1.2_000131 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F22 compound treatment 555052.6316 -9220.0 -0.04 516087.1369 -60700.0 -0.32 -0.2575 -0.7936 Starr1.2_000132 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F23 mock treatment 528219.5122 -36000.0 -0.17 482406.5934 -94300.0 -0.5 -0.4713 -0.894 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 F24 mock treatment 593747.8992 29500.0 0.14 647325.8929 70600.0 0.37 0.3609 0.906 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G01 compound treatment 628808.6124 64500.0 0.3 597124.424 20400.0 0.11 0.2869 0.906 Starr1.2_000133 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G02 compound treatment 676657.8947 112000.0 0.52 579325.1232 2590.0 0.01 0.3762 0.7256 Starr1.2_000134 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G03 compound treatment 601126.2626 36900.0 0.17 663976.8519 87200.0 0.46 0.4474 0.9076 Starr1.2_000135 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G04 compound treatment 436520.5479 -128000.0 -0.59 618829.0155 42100.0 0.22 -0.2587 -0.4107 Starr1.2_000136 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G05 compound treatment 593654.7619 29400.0 0.14 561496.732 -15200.0 -0.08 0.0387 0.245 Starr1.2_000137 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G06 compound treatment 412438.0165 -152000.0 -0.7 509626.0163 -67100.0 -0.36 -0.7468 -0.9508 Starr1.2_000138 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G07 compound treatment 747286.2745 183000.0 0.84 560242.7984 -16500.0 -0.09 0.5349 0.6304 Starr1.2_000139 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G08 compound treatment 533120.6226 -31100.0 -0.14 592381.4815 15600.0 0.08 -0.0429 -0.2586 Starr1.2_000140 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G09 compound treatment 500113.2075 -64200.0 -0.3 539991.7355 -36700.0 -0.19 -0.347 -0.9795 Starr1.2_000141 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G10 compound treatment 555541.2844 -8730.0 -0.04 521496.124 -55200.0 -0.29 -0.2356 -0.7968 Starr1.2_000142 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G11 compound treatment 470795.7746 -93500.0 -0.43 490242.2145 -86500.0 -0.46 -0.6292 -0.9995 Starr1.2_000143 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G12 compound treatment 597495.7627 33200.0 0.15 529643.1535 -47100.0 -0.25 -0.0683 -0.233 Starr1.2_000144 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G13 compound treatment 339611.5108 -225000.0 -1.04 356944.4444 -220000.0 -1.17 -1.5569 -0.9983 Starr1.2_000145 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G14 compound treatment 612207.5472 47900.0 0.22 542422.5352 -34300.0 -0.18 0.0276 0.0965 Starr1.2_000146 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G15 compound treatment 473140.2985 -91100.0 -0.42 488829.1139 -87900.0 -0.47 -0.6269 -0.9987 Starr1.2_000147 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G16 compound treatment 555932.1267 -8340.0 -0.04 497186.5672 -79600.0 -0.42 -0.3255 -0.7683 Starr1.2_000148 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G17 compound treatment 502984.375 -61300.0 -0.28 459959.707 -117000.0 -0.62 -0.6378 -0.9368 Starr1.2_000149 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G18 compound treatment 570316.3636 6050.0 0.03 527244.5255 -49500.0 -0.26 -0.1659 -0.6284 Starr1.2_000150 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G19 compound treatment 652494.0239 88200.0 0.41 548196.9697 -28500.0 -0.15 0.1807 0.4161 Starr1.2_000151 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G20 compound treatment 586686.7925 22400.0 0.1 502433.213 -74300.0 -0.39 -0.2056 -0.5045 Starr1.2_000152 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G21 compound treatment 472858.0247 -91400.0 -0.42 540228.8557 -36500.0 -0.19 -0.435 -0.9377 Starr1.2_000153 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G22 compound treatment 202560.6061 -362000.0 -1.67 312959.4595 -264000.0 -1.4 -2.1688 -0.9962 Starr1.2_000154 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G23 mock treatment 587589.6226 23300.0 0.11 597004.5249 20300.0 0.11 0.1521 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 G24 mock treatment 485427.8075 -78800.0 -0.36 534723.0769 -42000.0 -0.22 -0.4147 -0.9724 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H01 compound treatment 675638.8889 111000.0 0.51 584123.2877 7380.0 0.04 0.3909 0.7588 Starr1.2_000155 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H02 compound treatment 717590.9091 153000.0 0.71 767473.9336 191000.0 1.01 1.2153 0.9847 Starr1.2_000156 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H03 compound treatment 725181.4159 161000.0 0.74 689586.8545 113000.0 0.6 0.948 0.9943 Starr1.2_000157 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H04 compound treatment 694930.8756 131000.0 0.6 698837.8378 122000.0 0.65 0.884 0.9994 Starr1.2_000158 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H05 compound treatment 589930.8943 25700.0 0.12 713539.5349 137000.0 0.73 0.5968 0.8117 Starr1.2_000159 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H06 compound treatment 594054.8523 29800.0 0.14 608685.3448 31900.0 0.17 0.2169 0.9946 Starr1.2_000160 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H07 compound treatment 543958.8235 -20300.0 -0.09 452837.2093 -124000.0 -0.66 -0.5309 -0.7998 Starr1.2_000161 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H08 compound treatment 674822.5108 111000.0 0.51 626909.465 50200.0 0.27 0.5487 0.954 Starr1.2_000162 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H09 compound treatment 613936.5672 49700.0 0.23 607985.0187 31200.0 0.17 0.2792 0.9874 Starr1.2_000163 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H10 compound treatment 549835.4978 -14400.0 -0.07 598551.4019 21800.0 0.12 0.0347 0.2603 Starr1.2_000164 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H11 compound treatment 548915.0 -15400.0 -0.07 676885.4626 100000.0 0.53 0.3255 0.6075 Starr1.2_000165 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H12 compound treatment 485734.127 -78500.0 -0.36 541024.3902 -35700.0 -0.19 -0.39 -0.9543 Starr1.2_000166 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H13 compound treatment 627896.9466 63600.0 0.29 608482.0144 31700.0 0.17 0.3265 0.9652 Starr1.2_000167 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H14 compound treatment 537658.7302 -26600.0 -0.12 473018.5874 -104000.0 -0.55 -0.4758 -0.8441 Starr1.2_000168 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H15 compound treatment 102911.1111 -461000.0 -2.13 144130.9524 -433000.0 -2.29 -3.1269 -0.9993 Starr1.2_000169 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H16 compound treatment 401000.0 -163000.0 -0.75 460811.8081 -116000.0 -0.61 -0.9672 -0.9949 Starr1.2_000170 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H17 compound treatment 478418.5185 -85800.0 -0.4 495908.7137 -80800.0 -0.43 -0.5831 -0.9992 Starr1.2_000171 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H18 compound treatment 558296.8198 -5970.0 -0.03 512922.7799 -63800.0 -0.34 -0.2588 -0.7621 Starr1.2_000172 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H19 compound treatment 543746.1538 -20500.0 -0.09 499776.6323 -77000.0 -0.41 -0.3556 -0.8485 Starr1.2_000173 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H20 compound treatment 322027.7778 -242000.0 -1.12 547757.8947 -29000.0 -0.15 -0.8986 -0.7969 Starr1.2_000174 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H21 compound treatment 437034.6021 -127000.0 -0.59 478268.2119 -98500.0 -0.52 -0.7842 -0.9983 Starr1.2_000175 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H22 compound treatment 597982.0628 33700.0 0.16 548240.7407 -28500.0 -0.15 0.0031 0.0141 Starr1.2_000176 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H23 mock treatment 533991.6318 -30300.0 -0.14 562427.23 -14300.0 -0.08 -0.1524 -0.959 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 H24 mock treatment 522133.0049 -42100.0 -0.19 473355.7312 -103000.0 -0.55 -0.5251 -0.9027 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I01 compound treatment 447797.2028 -116000.0 -0.54 466963.7681 -110000.0 -0.58 -0.7915 -0.9992 Starr1.2_000177 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I02 compound treatment 678702.7027 114000.0 0.53 682425.1208 106000.0 0.56 0.7695 0.9995 Starr1.2_000178 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I03 compound treatment 636056.4103 71800.0 0.33 677824.1206 101000.0 0.54 0.6132 0.9732 Starr1.2_000179 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I04 compound treatment 744954.955 181000.0 0.83 686143.5407 109000.0 0.58 0.9995 0.9844 Starr1.2_000180 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I05 compound treatment 644623.9669 80400.0 0.37 805466.0633 229000.0 1.21 1.1199 0.8828 Starr1.2_000181 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I06 compound treatment 625690.9871 61400.0 0.28 753226.6667 176000.0 0.94 0.8622 0.8816 Starr1.2_000182 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I07 compound treatment 323423.0769 -241000.0 -1.11 432058.3333 -145000.0 -0.77 -1.328 -0.9837 Starr1.2_000183 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I08 compound treatment 467180.2575 -97100.0 -0.45 578739.726 2000.0 0.01 -0.3091 -0.6902 Starr1.2_000184 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I09 compound treatment 698918.9189 135000.0 0.62 578410.0 1670.0 0.01 0.4454 0.7171 Starr1.2_000185 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I10 compound treatment 613274.0741 49000.0 0.23 611645.9854 34900.0 0.19 0.2907 0.9951 Starr1.2_000186 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I11 compound treatment 562271.6535 -2000.0 -0.01 537832.7402 -38900.0 -0.21 -0.1524 -0.7379 Starr1.2_000187 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I12 compound treatment 593882.8829 29600.0 0.14 642415.3846 65700.0 0.35 0.3429 0.9164 Starr1.2_000188 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I13 compound treatment 778681.4516 214000.0 0.99 786250.9653 210000.0 1.11 1.485 0.9983 Starr1.2_000189 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I14 compound treatment 47464.2857 -517000.0 -2.38 93463.7681 -483000.0 -2.56 -3.4978 -0.9993 Starr1.2_000190 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I15 compound treatment 521800.578 -42500.0 -0.2 501740.1813 -75000.0 -0.4 -0.4198 -0.9467 Starr1.2_000191 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I16 compound treatment 623332.2368 59100.0 0.27 628737.2263 52000.0 0.28 0.3876 1.0 Starr1.2_000192 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I17 compound treatment 347954.023 -216000.0 -1.0 450512.1951 -126000.0 -0.67 -1.1788 -0.9812 Starr1.2_000193 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I18 compound treatment 537016.3934 -27300.0 -0.13 525800.0 -50900.0 -0.27 -0.2799 -0.9394 Starr1.2_000194 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I19 compound treatment 640253.1646 76000.0 0.35 593639.576 16900.0 0.09 0.3112 0.8603 Starr1.2_000195 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I20 compound treatment 644039.5257 79800.0 0.37 577203.6364 465.0 0.0 0.2619 0.7118 Starr1.2_000196 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I21 compound treatment 595478.2609 31200.0 0.14 524443.038 -52300.0 -0.28 -0.0944 -0.302 Starr1.2_000197 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I22 compound treatment 233057.971 -331000.0 -1.53 343607.5949 -233000.0 -1.24 -1.9544 -0.9945 Starr1.2_000198 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I23 mock treatment 569024.6914 4760.0 0.02 573472.3618 -3270.0 -0.02 0.0033 0.1166 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 I24 mock treatment 514215.859 -50100.0 -0.23 608772.9469 32000.0 0.17 -0.0431 -0.1503 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J01 compound treatment 789034.4828 225000.0 1.04 725338.0952 149000.0 0.79 1.2903 0.9909 Starr1.2_000199 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J02 compound treatment 649854.6512 85600.0 0.39 707622.549 131000.0 0.69 0.77 0.9642 Starr1.2_000200 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J03 compound treatment 623748.503 59500.0 0.27 627239.1304 50500.0 0.27 0.3834 0.9999 Starr1.2_000201 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J04 compound treatment 619665.1376 55400.0 0.26 535491.1504 -41200.0 -0.22 0.0259 0.0771 Starr1.2_000202 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J05 compound treatment 710222.7074 146000.0 0.67 695404.7619 119000.0 0.63 0.921 0.9994 Starr1.2_000203 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J06 compound treatment 628460.8696 64200.0 0.3 716949.3671 140000.0 0.74 0.7352 0.9185 Starr1.2_000204 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J07 compound treatment 664472.9242 100000.0 0.46 831080.0 254000.0 1.35 1.2807 0.8981 Starr1.2_000205 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J08 compound treatment 556443.8503 -7820.0 -0.04 503446.0784 -73300.0 -0.39 -0.3004 -0.7694 Starr1.2_000206 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J09 compound treatment 444383.6478 -120000.0 -0.55 590371.6216 13600.0 0.07 -0.3398 -0.6094 Starr1.2_000207 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J10 compound treatment 443960.9375 -120000.0 -0.55 440985.7143 -136000.0 -0.72 -0.9015 -0.9917 Starr1.2_000208 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J11 compound treatment 577807.0175 13500.0 0.06 472916.0584 -104000.0 -0.55 -0.3452 -0.6229 Starr1.2_000209 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J12 compound treatment 51358.4906 -513000.0 -2.37 36971.831 -540000.0 -2.86 -3.6969 -0.9955 Starr1.2_000210 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J13 compound treatment 281073.7705 -283000.0 -1.31 349909.0909 -227000.0 -1.2 -1.7742 -0.9992 Starr1.2_000211 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J14 compound treatment 420524.6479 -144000.0 -0.66 420792.5697 -156000.0 -0.83 -1.0536 -0.994 Starr1.2_000212 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J15 compound treatment 446472.8682 -118000.0 -0.54 482651.5152 -94100.0 -0.5 -0.737 -0.9991 Starr1.2_000213 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J16 compound treatment 67644.4444 -497000.0 -2.29 95934.7826 -481000.0 -2.55 -3.4227 -0.9986 Starr1.2_000214 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J17 compound treatment 487775.4386 -76500.0 -0.35 481375.8621 -95400.0 -0.51 -0.6071 -0.9845 Starr1.2_000215 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J18 compound treatment 542439.1892 -21800.0 -0.1 539486.755 -37300.0 -0.2 -0.2109 -0.951 Starr1.2_000216 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J19 compound treatment 471233.3333 -93000.0 -0.43 340409.7561 -236000.0 -1.25 -1.1897 -0.898 Starr1.2_000217 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J20 compound treatment 101756.4103 -463000.0 -2.13 101493.5065 -475000.0 -2.52 -3.2906 -0.9965 Starr1.2_000218 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J21 compound treatment 473762.987 -90500.0 -0.42 469746.3768 -107000.0 -0.57 -0.6964 -0.9886 Starr1.2_000219 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J22 compound treatment 665329.1139 101000.0 0.47 568152.9851 -8590.0 -0.05 0.2974 0.635 Starr1.2_000220 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J23 mock treatment 580966.0377 16700.0 0.08 606498.2079 29800.0 0.16 0.1661 0.9455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 J24 mock treatment 498657.6923 -65600.0 -0.3 535826.8398 -40900.0 -0.22 -0.3674 -0.9867 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K01 compound treatment 385692.3077 -179000.0 -0.82 361111.1111 -216000.0 -1.14 -1.391 -0.987 Starr1.2_000221 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K02 compound treatment 734925.7813 171000.0 0.79 621279.2793 44500.0 0.24 0.7235 0.8805 Starr1.2_000222 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K03 compound treatment 734388.8889 170000.0 0.78 736924.0506 160000.0 0.85 1.1555 0.9992 Starr1.2_000223 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K04 compound treatment 592729.7297 28500.0 0.13 586778.626 10000.0 0.05 0.1305 0.9211 Starr1.2_000224 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K05 compound treatment 659559.7826 95300.0 0.44 690459.0164 114000.0 0.6 0.7372 0.9879 Starr1.2_000225 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K06 compound treatment 704079.3651 140000.0 0.64 510825.1121 -65900.0 -0.35 0.2087 0.2846 Starr1.2_000226 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K07 compound treatment 591136.3636 26900.0 0.12 630140.4959 53400.0 0.28 0.2879 0.9312 Starr1.2_000227 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K08 compound treatment 55894.7368 -508000.0 -2.34 83347.8261 -493000.0 -2.62 -3.5082 -0.9985 Starr1.2_000228 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K09 compound treatment 630594.1176 66300.0 0.31 616724.1379 40000.0 0.21 0.3662 0.984 Starr1.2_000229 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K10 compound treatment 725330.9609 161000.0 0.74 614000.0 37300.0 0.2 0.665 0.8652 Starr1.2_000230 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K11 compound treatment 557717.9487 -6550.0 -0.03 540039.604 -36700.0 -0.19 -0.159 -0.8072 Starr1.2_000231 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K12 compound treatment 601791.3043 37500.0 0.17 583976.7442 7240.0 0.04 0.1495 0.8435 Starr1.2_000232 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K13 compound treatment 51724.1379 -513000.0 -2.36 46071.4286 -531000.0 -2.81 -3.6616 -0.9962 Starr1.2_000233 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K14 compound treatment 593472.4409 29200.0 0.13 598073.3333 21300.0 0.11 0.1752 0.9963 Starr1.2_000234 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K15 compound treatment 621044.2177 56800.0 0.26 594377.2455 17600.0 0.09 0.2513 0.9038 Starr1.2_000235 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K16 compound treatment 509185.8736 -55100.0 -0.25 602441.7178 25700.0 0.14 -0.0832 -0.2887 Starr1.2_000236 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K17 compound treatment 599336.6337 35100.0 0.16 595554.8173 18800.0 0.1 0.1849 0.9731 Starr1.2_000237 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K18 compound treatment 519271.1864 -45000.0 -0.21 494818.1818 -81900.0 -0.43 -0.454 -0.9428 Starr1.2_000238 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K19 compound treatment 601433.4471 37200.0 0.17 576505.3004 -234.0 0.0 0.1203 0.702 Starr1.2_000239 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K20 compound treatment 610668.9655 46400.0 0.21 630519.685 53800.0 0.29 0.353 0.99 Starr1.2_000240 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K21 compound treatment 475082.5688 -89200.0 -0.41 686334.9515 110000.0 0.58 0.1202 0.1688 Starr1.2_000241 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K22 compound treatment 133777.7778 -430000.0 -1.99 120506.4935 -456000.0 -2.42 -3.1149 -0.9952 Starr1.2_000242 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K23 mock treatment 568550.6073 4280.0 0.02 587897.541 11200.0 0.06 0.0558 0.8946 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 K24 mock treatment 595512.5 31200.0 0.14 597017.2414 20300.0 0.11 0.1779 0.9896 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L01 compound treatment 489210.8434 -75100.0 -0.35 428542.4837 -148000.0 -0.79 -0.8006 -0.9321 Starr1.2_000243 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L02 compound treatment 768180.2575 204000.0 0.94 771590.3614 195000.0 1.03 1.3957 0.9989 Starr1.2_000244 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L03 compound treatment 777489.083 213000.0 0.98 739294.1176 163000.0 0.86 1.305 0.9979 Starr1.2_000245 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L04 compound treatment 593339.4495 29100.0 0.13 643276.8595 66500.0 0.35 0.3443 0.9121 Starr1.2_000246 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L05 compound treatment 718801.6878 155000.0 0.71 635544.3548 58800.0 0.31 0.7245 0.9313 Starr1.2_000247 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L06 compound treatment 762890.9774 199000.0 0.92 840683.6364 264000.0 1.4 1.6376 0.9789 Starr1.2_000248 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L07 compound treatment 436541.2844 -128000.0 -0.59 502965.7534 -73800.0 -0.39 -0.6932 -0.9803 Starr1.2_000249 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L08 compound treatment 702239.7004 138000.0 0.64 803829.7101 227000.0 1.2 1.3016 0.9555 Starr1.2_000250 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L09 compound treatment 572136.5079 7870.0 0.04 623380.6228 46600.0 0.25 0.2006 0.8022 Starr1.2_000251 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L10 compound treatment 706958.8015 143000.0 0.66 578350.9434 1610.0 0.01 0.4713 0.7162 Starr1.2_000252 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L11 compound treatment 645675.4967 81400.0 0.38 761209.9644 184000.0 0.98 0.9573 0.9135 Starr1.2_000253 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L12 compound treatment 45808.5106 -518000.0 -2.39 51384.6154 -525000.0 -2.79 -3.661 -0.9971 Starr1.2_000254 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L13 compound treatment 539090.9091 -25200.0 -0.12 593606.2718 16900.0 0.09 -0.0188 -0.1285 Starr1.2_000255 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L14 compound treatment 542353.4483 -21900.0 -0.1 629312.7148 52600.0 0.28 0.1257 0.4239 Starr1.2_000256 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L15 compound treatment 679032.8467 115000.0 0.53 674384.8797 97600.0 0.52 0.7405 0.9999 Starr1.2_000257 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L16 compound treatment 684912.5874 121000.0 0.56 654100.0 77400.0 0.41 0.6836 0.9888 Starr1.2_000258 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L17 compound treatment 509065.8436 -55200.0 -0.25 578403.8462 1670.0 0.01 -0.1738 -0.6822 Starr1.2_000259 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L18 compound treatment 545701.4388 -18600.0 -0.09 503980.1325 -72800.0 -0.39 -0.3334 -0.8435 Starr1.2_000260 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L19 compound treatment 619644.0 55400.0 0.26 621447.8114 44700.0 0.24 0.3483 0.9993 Starr1.2_000261 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L20 compound treatment 467734.6939 -96500.0 -0.45 535166.6667 -41600.0 -0.22 -0.4707 -0.9475 Starr1.2_000262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L21 compound treatment 459124.1135 -105000.0 -0.48 530870.3072 -45900.0 -0.24 -0.5149 -0.9491 Starr1.2_000263 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L22 compound treatment 377063.8298 -187000.0 -0.86 432423.913 -144000.0 -0.77 -1.1517 -0.9982 Starr1.2_000264 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L23 mock treatment 631326.6129 67100.0 0.31 558617.2249 -18100.0 -0.1 0.1507 0.4654 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 L24 mock treatment 586522.0884 22300.0 0.1 571395.3488 -5340.0 -0.03 0.0525 0.4934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M01 compound treatment 98602.9412 -466000.0 -2.15 82970.1493 -494000.0 -2.62 -3.3704 -0.9951 Starr1.2_000265 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M02 compound treatment 639091.2863 74800.0 0.35 649296.2963 72600.0 0.38 0.5161 0.9985 Starr1.2_000266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M03 compound treatment 598434.4262 34200.0 0.16 608872.9508 32100.0 0.17 0.2319 0.9992 Starr1.2_000267 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M04 compound treatment 725798.4496 162000.0 0.74 680065.0407 103000.0 0.55 0.9143 0.9886 Starr1.2_000268 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M05 compound treatment 608885.1064 44600.0 0.21 618452.6749 41700.0 0.22 0.3019 0.9993 Starr1.2_000269 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M06 compound treatment 556971.2919 -7300.0 -0.03 568263.8889 -8470.0 -0.04 -0.0556 -0.9898 Starr1.2_000270 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M07 compound treatment 550919.598 -13300.0 -0.06 569995.2607 -6740.0 -0.04 -0.0688 -0.9666 Starr1.2_000271 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M08 compound treatment 561774.5902 -2490.0 -0.01 671078.9474 94300.0 0.5 0.3457 0.6907 Starr1.2_000272 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M09 compound treatment 684291.8455 120000.0 0.55 797902.1739 221000.0 1.17 1.2209 0.9412 Starr1.2_000273 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M10 compound treatment 469427.7457 -94800.0 -0.44 479816.3265 -96900.0 -0.51 -0.6728 -0.9968 Starr1.2_000274 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M11 compound treatment 432220.0 -132000.0 -0.61 613175.4386 36400.0 0.19 -0.2939 -0.4601 Starr1.2_000275 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M12 compound treatment 495769.6335 -68500.0 -0.32 434203.7915 -143000.0 -0.76 -0.7579 -0.9251 Starr1.2_000276 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M13 compound treatment 666806.1674 103000.0 0.47 546267.101 -30500.0 -0.16 0.2201 0.4404 Starr1.2_000277 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M14 compound treatment 451622.2222 -113000.0 -0.52 475900.0 -101000.0 -0.53 -0.7455 -0.9999 Starr1.2_000278 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M15 compound treatment 483624.6246 -80600.0 -0.37 600652.3179 23900.0 0.13 -0.1733 -0.441 Starr1.2_000279 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M16 compound treatment 530885.0575 -33400.0 -0.15 498660.7143 -78100.0 -0.41 -0.4017 -0.9092 Starr1.2_000280 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M17 compound treatment 451052.0833 -113000.0 -0.52 333500.0 -243000.0 -1.29 -1.2815 -0.9207 Starr1.2_000281 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M18 compound treatment 443451.6129 -121000.0 -0.56 443570.4225 -133000.0 -0.71 -0.8934 -0.9931 Starr1.2_000282 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M19 compound treatment 529600.7463 -34700.0 -0.16 567996.6216 -8740.0 -0.05 -0.1458 -0.8761 Starr1.2_000283 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M20 compound treatment 567317.4061 3050.0 0.01 642591.5033 65900.0 0.35 0.2569 0.735 Starr1.2_000284 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M21 compound treatment 513056.3798 -51200.0 -0.24 514646.875 -62100.0 -0.33 -0.3999 -0.9867 Starr1.2_000285 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M22 compound treatment 172835.443 -391000.0 -1.81 161887.5 -415000.0 -2.2 -2.8323 -0.9952 Starr1.2_000286 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M23 mock treatment 515839.8438 -48400.0 -0.22 547352.1127 -29400.0 -0.16 -0.2681 -0.9845 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 M24 mock treatment 549152.7094 -15100.0 -0.07 531709.8214 -45000.0 -0.24 -0.2182 -0.8769 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N01 compound treatment 610787.4016 46500.0 0.21 681503.7879 105000.0 0.56 0.5446 0.9143 Starr1.2_000287 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N02 compound treatment 687796.0 124000.0 0.57 675489.3617 98800.0 0.52 0.7732 0.9991 Starr1.2_000288 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N03 compound treatment 811179.5918 247000.0 1.14 706328.8889 130000.0 0.69 1.2912 0.9708 Starr1.2_000289 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N04 compound treatment 732850.4673 169000.0 0.78 715098.0392 138000.0 0.73 1.0686 0.9996 Starr1.2_000290 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N05 compound treatment 631611.3537 67300.0 0.31 624715.9533 48000.0 0.25 0.3995 0.9951 Starr1.2_000291 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N06 compound treatment 728964.1434 165000.0 0.76 660372.807 83600.0 0.44 0.8507 0.9672 Starr1.2_000292 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N07 compound treatment 811898.7854 248000.0 1.14 707502.0576 131000.0 0.69 1.2979 0.9714 Starr1.2_000293 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N08 compound treatment 766944.7005 203000.0 0.93 711683.0986 135000.0 0.72 1.167 0.9913 Starr1.2_000294 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N09 compound treatment 619503.7594 55200.0 0.25 536522.5564 -40200.0 -0.21 0.0293 0.0882 Starr1.2_000295 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N10 compound treatment 578540.4255 14300.0 0.07 777213.9918 200000.0 1.06 0.7984 0.7494 Starr1.2_000296 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N11 compound treatment 504497.2376 -59800.0 -0.28 547055.2764 -29700.0 -0.16 -0.3062 -0.9647 Starr1.2_000297 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N12 compound treatment 265549.4505 -299000.0 -1.38 220885.4167 -356000.0 -1.89 -2.3087 -0.988 Starr1.2_000298 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N13 compound treatment 687774.0586 124000.0 0.57 724161.2903 147000.0 0.78 0.9556 0.9879 Starr1.2_000299 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N14 compound treatment 702129.4643 138000.0 0.64 501689.3939 -75000.0 -0.4 0.1681 0.2241 Starr1.2_000300 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N15 compound treatment 432409.396 -132000.0 -0.61 481428.5714 -95300.0 -0.51 -0.7874 -0.9958 Starr1.2_000301 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N16 compound treatment 485096.4467 -79200.0 -0.37 453994.8187 -123000.0 -0.65 -0.7185 -0.9626 Starr1.2_000302 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N17 compound treatment 606400.0 42100.0 0.19 489640.8451 -87100.0 -0.46 -0.1893 -0.3777 Starr1.2_000303 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N18 compound treatment 568873.7864 4610.0 0.02 519904.1534 -56800.0 -0.3 -0.1981 -0.6557 Starr1.2_000304 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N19 compound treatment 667455.7522 103000.0 0.48 619525.5474 42800.0 0.23 0.497 0.9426 Starr1.2_000305 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N20 compound treatment 593298.8506 29000.0 0.13 466275.8621 -110000.0 -0.59 -0.3196 -0.5318 Starr1.2_000306 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N21 compound treatment 529510.3448 -34800.0 -0.16 520461.8056 -56300.0 -0.3 -0.3244 -0.9575 Starr1.2_000307 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N22 compound treatment 345353.9823 -219000.0 -1.01 440933.3333 -136000.0 -0.72 -1.2232 -0.9863 Starr1.2_000308 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N23 mock treatment 525390.625 -38900.0 -0.18 602882.5758 26100.0 0.14 -0.0287 -0.1267 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 N24 mock treatment 652266.4093 88000.0 0.41 544591.3043 -32100.0 -0.17 0.1664 0.378 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O01 compound treatment 400362.069 -164000.0 -0.76 338322.0339 -238000.0 -1.26 -1.4287 -0.9697 Starr1.2_000309 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O02 compound treatment 550335.8209 -13900.0 -0.06 600384.9057 23600.0 0.13 0.0433 0.3069 Starr1.2_000310 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O03 compound treatment 545112.4031 -19200.0 -0.09 627138.7755 50400.0 0.27 0.1266 0.4495 Starr1.2_000311 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O04 compound treatment 662676.4706 98400.0 0.45 598663.8298 21900.0 0.12 0.4031 0.8605 Starr1.2_000312 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O05 compound treatment 520136.5462 -44100.0 -0.2 534511.5207 -42200.0 -0.22 -0.3023 -0.9989 Starr1.2_000313 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O06 compound treatment 595035.2941 30800.0 0.14 608528.0 31800.0 0.17 0.2196 0.9963 Starr1.2_000314 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O07 compound treatment 594851.6746 30600.0 0.14 588420.7921 11700.0 0.06 0.1435 0.9318 Starr1.2_000315 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O08 compound treatment 318867.9245 -245000.0 -1.13 204419.6429 -372000.0 -1.97 -2.1966 -0.9651 Starr1.2_000316 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O09 compound treatment 609355.8282 45100.0 0.21 645882.6816 69100.0 0.37 0.4063 0.9639 Starr1.2_000317 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O10 compound treatment 630607.438 66300.0 0.31 679541.4847 103000.0 0.55 0.6019 0.9627 Starr1.2_000318 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O11 compound treatment 530619.7719 -33600.0 -0.16 439244.2748 -137000.0 -0.73 -0.6254 -0.8388 Starr1.2_000319 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O12 compound treatment 59021.2766 -505000.0 -2.33 66720.9302 -510000.0 -2.71 -3.5604 -0.9972 Starr1.2_000320 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O13 compound treatment 253271.6049 -311000.0 -1.43 364325.5814 -212000.0 -1.13 -1.8108 -0.9929 Starr1.2_000321 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O14 compound treatment 495926.5306 -68300.0 -0.32 487460.6742 -89300.0 -0.47 -0.5577 -0.9804 Starr1.2_000322 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O15 compound treatment 539166.6667 -25100.0 -0.12 559667.9537 -17100.0 -0.09 -0.1459 -0.9926 Starr1.2_000323 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O16 compound treatment 582597.4026 18300.0 0.08 674062.7306 97300.0 0.52 0.4248 0.8121 Starr1.2_000324 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O17 compound treatment 538870.5036 -25400.0 -0.12 644783.9721 68000.0 0.36 0.1724 0.4543 Starr1.2_000325 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O18 compound treatment 481884.6154 -82400.0 -0.38 455876.3251 -121000.0 -0.64 -0.7219 -0.9688 Starr1.2_000326 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O19 compound treatment 488049.8221 -76200.0 -0.35 433260.8696 -143000.0 -0.76 -0.7867 -0.9384 Starr1.2_000327 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O20 compound treatment 521809.2486 -42500.0 -0.2 580190.7895 3450.0 0.02 -0.1255 -0.6382 Starr1.2_000328 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O21 compound treatment 542043.3333 -22200.0 -0.1 567646.6431 -9090.0 -0.05 -0.1066 -0.9409 Starr1.2_000329 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O22 compound treatment 463251.7986 -101000.0 -0.47 451980.6452 -125000.0 -0.66 -0.7973 -0.9852 Starr1.2_000330 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O23 mock treatment 474845.8647 -89400.0 -0.41 506129.6296 -70600.0 -0.37 -0.5564 -0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 O24 mock treatment 578812.0 14500.0 0.07 562662.2807 -14100.0 -0.07 -0.0054 -0.0535 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P01 compound treatment 467656.5217 -96600.0 -0.45 509022.5225 -67700.0 -0.36 -0.569 -0.9943 Starr1.2_000331 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P02 compound treatment 554786.0465 -9480.0 -0.04 523872.0 -52900.0 -0.28 -0.2292 -0.8076 Starr1.2_000332 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P03 compound treatment 608182.6087 43900.0 0.2 568764.1509 -7970.0 -0.04 0.1133 0.5476 Starr1.2_000333 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P04 compound treatment 550014.1509 -14300.0 -0.07 568525.3456 -8210.0 -0.04 -0.0773 -0.98 Starr1.2_000334 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P05 compound treatment 311647.0588 -253000.0 -1.16 293415.6627 -283000.0 -1.5 -1.8864 -0.9921 Starr1.2_000335 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P06 compound treatment 606268.2927 42000.0 0.19 600707.5472 24000.0 0.13 0.2269 0.9791 Starr1.2_000336 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P07 compound treatment 378602.0408 -186000.0 -0.86 267647.541 -309000.0 -1.64 -1.7647 -0.9541 Starr1.2_000337 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P08 compound treatment 506507.874 -57800.0 -0.27 538714.2857 -38000.0 -0.2 -0.331 -0.9906 Starr1.2_000338 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P09 compound treatment 531465.8635 -32800.0 -0.15 506444.0299 -70300.0 -0.37 -0.3706 -0.9211 Starr1.2_000339 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P10 compound treatment 53352.9412 -511000.0 -2.36 59984.8485 -517000.0 -2.74 -3.6041 -0.9972 Starr1.2_000340 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P11 compound treatment 536902.9536 -27400.0 -0.13 544070.2479 -32700.0 -0.17 -0.2118 -0.9879 Starr1.2_000341 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P12 compound treatment 536519.8556 -27700.0 -0.13 659658.2734 82900.0 0.44 0.2205 0.4814 Starr1.2_000342 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P13 compound treatment 509951.3889 -54300.0 -0.25 480813.9535 -95900.0 -0.51 -0.5369 -0.9467 Starr1.2_000343 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P14 compound treatment 444906.4039 -119000.0 -0.55 425870.3704 -151000.0 -0.8 -0.9551 -0.9833 Starr1.2_000344 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P15 compound treatment 664172.0 99900.0 0.46 647881.295 71100.0 0.38 0.5926 0.9951 Starr1.2_000345 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P16 compound treatment 613665.3226 49400.0 0.23 583210.9375 6470.0 0.03 0.1854 0.8046 Starr1.2_000346 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P17 compound treatment 54187.5 -510000.0 -2.35 68958.3333 -508000.0 -2.69 -3.5678 -0.9977 Starr1.2_000347 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P18 compound treatment 546338.9121 -17900.0 -0.08 606971.831 30200.0 0.16 0.0549 0.3044 Starr1.2_000348 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P19 compound treatment 484666.6667 -79600.0 -0.37 491600.0 -85100.0 -0.45 -0.5789 -0.9947 Starr1.2_000349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P20 compound treatment 458776.0618 -105000.0 -0.49 507952.7897 -68800.0 -0.36 -0.602 -0.9899 Starr1.2_000350 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P21 compound treatment 404660.7143 -160000.0 -0.74 509870.7224 -66900.0 -0.35 -0.7713 -0.944 Starr1.2_000351 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P22 compound treatment 342700.0 -222000.0 -1.02 280598.4252 -296000.0 -1.57 -1.8332 -0.9783 Starr1.2_000352 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P23 mock treatment 464567.0103 -99700.0 -0.46 484026.3158 -92700.0 -0.49 -0.6728 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2143 P24 mock treatment 469190.0452 -95100.0 -0.44 455391.8367 -121000.0 -0.64 -0.7652 -0.9825 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A01 compound treatment 318398.3051 -221000.0 -1.02 307214.7651 -170000.0 -0.9 -1.3593 -0.9982 Starr1.2_000353 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A02 compound treatment 248159.0909 -291000.0 -1.34 272608.1081 -205000.0 -1.09 -1.7182 -0.9945 Starr1.2_000354 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A03 compound treatment 604035.7143 64800.0 0.3 509845.8781 32200.0 0.17 0.3321 0.9648 Starr1.2_000355 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A04 compound treatment 157837.8378 -381000.0 -1.76 198976.1905 -279000.0 -1.48 -2.2888 -0.9963 Starr1.2_000356 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A05 compound treatment 746952.1531 208000.0 0.96 523291.3043 45600.0 0.24 0.8486 0.8588 Starr1.2_000357 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A06 compound treatment 109811.5942 -429000.0 -1.98 130894.7368 -347000.0 -1.84 -2.7008 -0.9993 Starr1.2_000358 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A07 compound treatment 522745.098 -16500.0 -0.08 403127.8195 -74500.0 -0.4 -0.3332 -0.8279 Starr1.2_000359 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A08 compound treatment 636197.4249 97000.0 0.45 538492.6471 60800.0 0.32 0.5444 0.9872 Starr1.2_000360 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A09 compound treatment 658643.4426 119000.0 0.55 502862.5 25200.0 0.13 0.484 0.854 Starr1.2_000361 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A10 compound treatment 708579.646 169000.0 0.78 375080.3859 -103000.0 -0.54 0.1676 0.176 Starr1.2_000362 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A11 compound treatment 753197.5309 214000.0 0.99 599660.1307 122000.0 0.65 1.1553 0.9791 Starr1.2_000363 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A12 compound treatment 501954.0816 -37300.0 -0.17 606688.6447 129000.0 0.68 0.3624 0.5136 Starr1.2_000364 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A13 compound treatment 781311.3208 242000.0 1.12 577550.7246 99900.0 0.53 1.1641 0.942 Starr1.2_000365 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A14 compound treatment 562547.9452 23300.0 0.11 504818.7919 27200.0 0.14 0.1779 0.9896 Starr1.2_000366 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A15 compound treatment 642915.3226 104000.0 0.48 509384.6154 31700.0 0.17 0.4571 0.9018 Starr1.2_000367 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A16 compound treatment 77975.6098 -461000.0 -2.13 61895.8333 -416000.0 -2.21 -3.0634 -0.9998 Starr1.2_000368 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A17 compound treatment 219980.0 -319000.0 -1.47 381279.5699 -96400.0 -0.51 -1.4025 -0.8999 Starr1.2_000369 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A18 compound treatment 566432.5397 27200.0 0.13 472826.7148 -4820.0 -0.03 0.0706 0.5516 Starr1.2_000370 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A19 compound treatment 520885.1675 -18300.0 -0.08 497605.8394 20000.0 0.11 0.015 0.1109 Starr1.2_000371 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A20 compound treatment 630064.8148 90800.0 0.42 448196.0784 -29500.0 -0.16 0.1857 0.4155 Starr1.2_000372 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A21 compound treatment 521701.0309 -17500.0 -0.08 475291.2281 -2360.0 -0.01 -0.066 -0.8069 Starr1.2_000373 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A22 compound treatment 653232.8042 114000.0 0.53 443654.2751 -34000.0 -0.18 0.2443 0.4395 Starr1.2_000374 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A23 mock treatment 535802.6906 -3430.0 -0.02 469856.6038 -7790.0 -0.04 -0.0404 -0.913 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 A24 mock treatment 575936.7089 36700.0 0.17 449948.2759 -27700.0 -0.15 0.0158 0.0705 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B01 compound treatment 617257.7778 78000.0 0.36 599130.719 121000.0 0.64 0.7101 0.9621 Starr1.2_000375 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B02 compound treatment 774326.5306 235000.0 1.08 581111.8012 103000.0 0.55 1.1547 0.9502 Starr1.2_000376 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B03 compound treatment 634053.0612 94800.0 0.44 505296.2963 27600.0 0.15 0.4129 0.8952 Starr1.2_000377 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B04 compound treatment 715366.0377 176000.0 0.81 645350.3185 168000.0 0.89 1.2033 0.999 Starr1.2_000378 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B05 compound treatment 295526.7857 -244000.0 -1.12 383721.7391 -93900.0 -0.5 -1.147 -0.933 Starr1.2_000379 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B06 compound treatment 364737.2881 -174000.0 -0.8 360185.0 -117000.0 -0.62 -1.0095 -0.992 Starr1.2_000380 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B07 compound treatment 475462.1514 -63800.0 -0.29 501370.5036 23700.0 0.13 -0.119 -0.3719 Starr1.2_000381 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B08 compound treatment 560227.0742 21000.0 0.1 514730.5195 37100.0 0.2 0.2075 0.9467 Starr1.2_000382 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B09 compound treatment 481400.0 -57800.0 -0.27 388325.1232 -89300.0 -0.47 -0.5236 -0.963 Starr1.2_000383 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B10 compound treatment 793470.5882 254000.0 1.17 486138.3648 8490.0 0.05 0.8609 0.7337 Starr1.2_000384 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B11 compound treatment 64787.234 -474000.0 -2.19 66603.4483 -411000.0 -2.18 -3.0887 -1.0 Starr1.2_000385 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B12 compound treatment 557675.8893 18400.0 0.09 629000.0 151000.0 0.8 0.6278 0.7777 Starr1.2_000386 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B13 compound treatment 723100.0 184000.0 0.85 623655.4307 146000.0 0.77 1.1472 0.999 Starr1.2_000387 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B14 compound treatment 713839.5062 175000.0 0.81 487558.3039 9910.0 0.05 0.6066 0.7517 Starr1.2_000388 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B15 compound treatment 715217.5732 176000.0 0.81 553075.2351 75400.0 0.4 0.8568 0.9469 Starr1.2_000389 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B16 compound treatment 553885.3047 14700.0 0.07 569867.7966 92200.0 0.49 0.3937 0.7972 Starr1.2_000390 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B17 compound treatment 657938.4615 119000.0 0.55 505759.4502 28100.0 0.15 0.4925 0.8681 Starr1.2_000391 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B18 compound treatment 620161.2903 80900.0 0.37 643600.0 166000.0 0.88 0.8863 0.927 Starr1.2_000392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B19 compound treatment 686577.6892 147000.0 0.68 459503.3557 -18100.0 -0.1 0.4124 0.601 Starr1.2_000393 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B20 compound treatment 552321.8884 13100.0 0.06 476679.4872 -969.0 -0.01 0.0391 0.6446 Starr1.2_000394 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B21 compound treatment 363589.4737 -176000.0 -0.81 357221.8182 -120000.0 -0.64 -1.0244 -0.9931 Starr1.2_000395 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B22 compound treatment 673434.4569 134000.0 0.62 510993.3775 33300.0 0.18 0.5627 0.8742 Starr1.2_000396 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B23 mock treatment 595934.5455 56700.0 0.26 476363.6364 -1280.0 -0.01 0.1801 0.6884 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 B24 mock treatment 587155.0 47900.0 0.22 483146.4286 5500.0 0.03 0.1769 0.7935 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C01 compound treatment 243605.2632 -296000.0 -1.36 169927.9279 -308000.0 -1.63 -2.1181 -0.996 Starr1.2_000397 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C02 compound treatment 450605.042 -88600.0 -0.41 433984.9057 -43700.0 -0.23 -0.4528 -0.9638 Starr1.2_000398 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C03 compound treatment 660660.8696 121000.0 0.56 663464.4195 186000.0 0.99 1.0929 0.9641 Starr1.2_000399 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C04 compound treatment 186852.9412 -352000.0 -1.63 213763.8889 -264000.0 -1.4 -2.1388 -0.9972 Starr1.2_000400 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C05 compound treatment 692495.7627 153000.0 0.71 661844.3709 184000.0 0.98 1.1906 0.9874 Starr1.2_000401 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C06 compound treatment 231310.8108 -308000.0 -1.42 181591.5493 -296000.0 -1.57 -2.1145 -0.9987 Starr1.2_000402 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C07 compound treatment 447130.0 -92100.0 -0.42 475832.5359 -1820.0 -0.01 -0.3071 -0.723 Starr1.2_000403 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C08 compound treatment 654370.5179 115000.0 0.53 633767.9739 156000.0 0.83 0.961 0.9769 Starr1.2_000404 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C09 compound treatment 701488.806 162000.0 0.75 531149.3902 53500.0 0.28 0.7298 0.9119 Starr1.2_000405 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C10 compound treatment 670126.8657 131000.0 0.6 603163.1206 126000.0 0.67 0.8976 0.9988 Starr1.2_000406 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C11 compound treatment 686540.0 147000.0 0.68 549429.0657 71800.0 0.38 0.7496 0.9625 Starr1.2_000407 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C12 compound treatment 628363.2813 89100.0 0.41 647804.5113 170000.0 0.9 0.9288 0.9366 Starr1.2_000408 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C13 compound treatment 553967.3913 14700.0 0.07 528976.5258 51300.0 0.27 0.2406 0.8573 Starr1.2_000409 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C14 compound treatment 577613.7184 38400.0 0.18 530246.1059 52600.0 0.28 0.3224 0.9759 Starr1.2_000410 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C15 compound treatment 412782.8571 -126000.0 -0.58 459236.8421 -18400.0 -0.1 -0.4814 -0.8142 Starr1.2_000411 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C16 compound treatment 343707.6923 -196000.0 -0.9 162931.0345 -315000.0 -1.67 -1.8179 -0.9582 Starr1.2_000412 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C17 compound treatment 625334.6774 86100.0 0.4 489440.8163 11800.0 0.06 0.325 0.8085 Starr1.2_000413 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C18 compound treatment 485893.2039 -53300.0 -0.25 414545.082 -63100.0 -0.33 -0.4106 -0.9885 Starr1.2_000414 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C19 compound treatment 760155.2511 221000.0 1.02 580146.6165 102000.0 0.54 1.1048 0.9567 Starr1.2_000415 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C20 compound treatment 628424.3697 89200.0 0.41 455702.9703 -21900.0 -0.12 0.2086 0.4879 Starr1.2_000416 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C21 compound treatment 643302.3256 104000.0 0.48 554817.1642 77200.0 0.41 0.6288 0.9969 Starr1.2_000417 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C22 compound treatment 631104.8387 91900.0 0.42 527584.8375 49900.0 0.26 0.4869 0.9744 Starr1.2_000418 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C23 mock treatment 661660.793 122000.0 0.56 503468.3099 25800.0 0.14 0.4961 0.8539 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 C24 mock treatment 578559.633 39300.0 0.18 466164.6586 -11500.0 -0.06 0.0852 0.4452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D01 compound treatment 421061.9469 -118000.0 -0.54 429358.2888 -48300.0 -0.26 -0.5664 -0.9407 Starr1.2_000419 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D02 compound treatment 781108.2251 242000.0 1.12 516329.8969 38700.0 0.21 0.9338 0.8234 Starr1.2_000420 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D03 compound treatment 828387.7551 289000.0 1.33 543212.0141 65600.0 0.35 1.1888 0.8627 Starr1.2_000421 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D04 compound treatment 667396.8254 128000.0 0.59 625016.4474 147000.0 0.78 0.9706 0.9905 Starr1.2_000422 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D05 compound treatment 329503.5971 -210000.0 -0.97 354780.1418 -123000.0 -0.65 -1.1447 -0.9815 Starr1.2_000423 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D06 compound treatment 346786.4583 -192000.0 -0.89 407355.0296 -70300.0 -0.37 -0.8912 -0.9258 Starr1.2_000424 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D07 compound treatment 601508.1301 62300.0 0.29 566138.2979 88500.0 0.47 0.535 0.9722 Starr1.2_000425 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D08 compound treatment 603630.1887 64400.0 0.3 625690.7895 148000.0 0.79 0.7652 0.9115 Starr1.2_000426 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D09 compound treatment 447213.8728 -92000.0 -0.42 471433.1797 -6220.0 -0.03 -0.3234 -0.7598 Starr1.2_000427 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D10 compound treatment 642947.3684 104000.0 0.48 566083.0769 88400.0 0.47 0.6699 1.0 Starr1.2_000428 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D11 compound treatment 400511.6279 -139000.0 -0.64 513649.7696 36000.0 0.19 -0.3173 -0.4753 Starr1.2_000429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D12 compound treatment 342559.5855 -197000.0 -0.91 470026.0417 -7620.0 -0.04 -0.6699 -0.7379 Starr1.2_000430 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D13 compound treatment 680095.2381 141000.0 0.65 649861.7021 172000.0 0.91 1.1052 0.9861 Starr1.2_000431 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D14 compound treatment 661077.6699 122000.0 0.56 565452.5862 87800.0 0.47 0.7266 0.9956 Starr1.2_000432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D15 compound treatment 104568.1818 -435000.0 -2.0 139392.1569 -338000.0 -1.79 -2.686 -0.9985 Starr1.2_000433 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D16 compound treatment 499496.6216 -39700.0 -0.18 446994.3978 -30700.0 -0.16 -0.2445 -0.9982 Starr1.2_000434 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D17 compound treatment 548294.964 9070.0 0.04 441443.1138 -36200.0 -0.19 -0.1062 -0.5405 Starr1.2_000435 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D18 compound treatment 483537.5 -55700.0 -0.26 544207.9208 66600.0 0.35 0.068 0.1558 Starr1.2_000436 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D19 compound treatment 593620.155 54400.0 0.25 506684.9817 29000.0 0.15 0.2863 0.9726 Starr1.2_000437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D20 compound treatment 554350.0 15100.0 0.07 558995.7082 81300.0 0.43 0.3544 0.8109 Starr1.2_000438 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D21 compound treatment 451452.9915 -87800.0 -0.4 490447.2362 12800.0 0.07 -0.2382 -0.5804 Starr1.2_000439 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D22 compound treatment 674777.3585 136000.0 0.63 420578.4314 -57100.0 -0.3 0.228 0.3282 Starr1.2_000440 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D23 mock treatment 622133.0472 82900.0 0.38 608354.6326 131000.0 0.69 0.7606 0.9607 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 D24 mock treatment 573486.166 34300.0 0.16 412676.4706 -65000.0 -0.34 -0.132 -0.3481 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E01 compound treatment 180107.6923 -359000.0 -1.66 289847.2222 -188000.0 -1.0 -1.8754 -0.9704 Starr1.2_000441 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E02 compound treatment 388653.8462 -151000.0 -0.69 92022.7273 -386000.0 -2.05 -1.9373 -0.8969 Starr1.2_000442 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E03 compound treatment 507238.8664 -32000.0 -0.15 454200.0 -23400.0 -0.12 -0.1923 -0.9964 Starr1.2_000443 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E04 compound treatment 275583.3333 -264000.0 -1.22 259168.8312 -218000.0 -1.16 -1.6791 -0.9997 Starr1.2_000444 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E05 compound treatment 388624.3386 -151000.0 -0.69 384733.3333 -92900.0 -0.49 -0.8396 -0.9859 Starr1.2_000445 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E06 compound treatment 704872.2467 166000.0 0.76 716844.7489 239000.0 1.27 1.4373 0.9705 Starr1.2_000446 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E07 compound treatment 570729.6296 31500.0 0.15 612336.8794 135000.0 0.71 0.6079 0.8338 Starr1.2_000447 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E08 compound treatment 571723.5023 32500.0 0.15 556489.083 78800.0 0.42 0.4017 0.9042 Starr1.2_000448 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E09 compound treatment 740705.8824 201000.0 0.93 577462.406 99800.0 0.53 1.0314 0.9644 Starr1.2_000449 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E10 compound treatment 676743.1193 138000.0 0.63 571981.4126 94300.0 0.5 0.8022 0.9931 Starr1.2_000450 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E11 compound treatment 853438.3562 314000.0 1.45 778991.7355 301000.0 1.6 2.1548 0.9988 Starr1.2_000451 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E12 compound treatment 741043.6681 202000.0 0.93 682350.6494 205000.0 1.09 1.4258 0.9971 Starr1.2_000452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E13 compound treatment 599797.8723 60600.0 0.28 647147.7273 169000.0 0.9 0.8332 0.8851 Starr1.2_000453 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E14 compound treatment 668735.7724 130000.0 0.6 542748.9362 65100.0 0.35 0.6665 0.9661 Starr1.2_000454 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E15 compound treatment 582646.2585 43400.0 0.2 474188.6792 -3460.0 -0.02 0.1286 0.6396 Starr1.2_000455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E16 compound treatment 339476.1905 -200000.0 -0.92 277785.7143 -200000.0 -1.06 -1.401 -0.9976 Starr1.2_000456 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E17 compound treatment 687423.0769 148000.0 0.68 631500.0 154000.0 0.82 1.0603 0.9961 Starr1.2_000457 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E18 compound treatment 653692.3077 114000.0 0.53 601570.3704 124000.0 0.66 0.838 0.9941 Starr1.2_000458 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E19 compound treatment 610947.9167 71700.0 0.33 452620.3209 -25000.0 -0.13 0.14 0.3928 Starr1.2_000459 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E20 compound treatment 552209.8214 13000.0 0.06 555639.0041 78000.0 0.41 0.3348 0.8011 Starr1.2_000460 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E21 compound treatment 561884.9206 22700.0 0.1 699713.1474 222000.0 1.18 0.9067 0.7668 Starr1.2_000461 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E22 compound treatment 605591.2698 66400.0 0.31 642506.9444 165000.0 0.87 0.8347 0.901 Starr1.2_000462 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E23 mock treatment 625740.566 86500.0 0.4 645803.0888 168000.0 0.89 0.9128 0.9342 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 E24 mock treatment 585889.4231 46700.0 0.22 495486.014 17800.0 0.09 0.2191 0.9319 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F01 compound treatment 505351.6484 -33900.0 -0.16 428854.1667 -48800.0 -0.26 -0.2935 -0.9708 Starr1.2_000463 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F02 compound treatment 801573.3945 262000.0 1.21 597706.3197 120000.0 0.64 1.3058 0.9551 Starr1.2_000464 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F03 compound treatment 714091.2863 175000.0 0.81 558055.3506 80400.0 0.43 0.8718 0.9557 Starr1.2_000465 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F04 compound treatment 641134.1991 102000.0 0.47 510841.4634 33200.0 0.18 0.4568 0.9102 Starr1.2_000466 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F05 compound treatment 638842.5197 99600.0 0.46 562664.1791 85000.0 0.45 0.6437 1.0 Starr1.2_000467 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F06 compound treatment 73666.6667 -466000.0 -2.15 79125.0 -399000.0 -2.11 -3.0128 -1.0 Starr1.2_000468 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F07 compound treatment 466727.2727 -72500.0 -0.33 430005.2083 -47600.0 -0.25 -0.4151 -0.9905 Starr1.2_000469 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F08 compound treatment 70212.766 -469000.0 -2.16 55711.5385 -422000.0 -2.24 -3.1119 -0.9999 Starr1.2_000470 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F09 compound treatment 713413.1274 174000.0 0.8 717325.2033 240000.0 1.27 1.4669 0.9755 Starr1.2_000471 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F10 compound treatment 608445.6929 69200.0 0.32 598680.4124 121000.0 0.64 0.6796 0.948 Starr1.2_000472 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F11 compound treatment 553231.8841 14000.0 0.06 496146.1187 18500.0 0.1 0.115 0.9794 Starr1.2_000473 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F12 compound treatment 57650.6024 -482000.0 -2.22 56759.4937 -421000.0 -2.23 -3.1489 -1.0 Starr1.2_000474 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F13 compound treatment 824526.3158 285000.0 1.32 748325.8065 271000.0 1.44 1.9455 0.9991 Starr1.2_000475 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F14 compound treatment 682043.1894 143000.0 0.66 506895.5224 29200.0 0.16 0.5754 0.8504 Starr1.2_000476 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F15 compound treatment 97600.0 -442000.0 -2.04 154489.7959 -323000.0 -1.71 -2.6521 -0.9963 Starr1.2_000477 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F16 compound treatment 476633.3333 -62600.0 -0.29 445136.8421 -32500.0 -0.17 -0.3261 -0.9697 Starr1.2_000478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F17 compound treatment 528703.9275 -10500.0 -0.05 474169.5906 -3480.0 -0.02 -0.0474 -0.9122 Starr1.2_000479 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F18 compound treatment 614379.845 75200.0 0.35 459878.4314 -17800.0 -0.09 0.1784 0.4968 Starr1.2_000480 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F19 compound treatment 437952.381 -101000.0 -0.47 400750.0 -76900.0 -0.41 -0.6187 -0.9977 Starr1.2_000481 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F20 compound treatment 171521.7391 -368000.0 -1.7 190988.3721 -287000.0 -1.52 -2.2742 -0.9985 Starr1.2_000482 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F21 compound treatment 555839.5062 16600.0 0.08 614418.9602 137000.0 0.73 0.5671 0.7775 Starr1.2_000483 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F22 compound treatment 545806.8966 6580.0 0.03 430862.5 -46800.0 -0.25 -0.154 -0.6161 Starr1.2_000484 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F23 mock treatment 507392.2414 -31800.0 -0.15 485696.6292 8050.0 0.04 -0.0736 -0.4816 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 F24 mock treatment 502164.0 -37100.0 -0.17 433613.9706 -44000.0 -0.23 -0.286 -0.9882 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G01 compound treatment 529704.0359 -9520.0 -0.04 484395.2569 6750.0 0.04 -0.0058 -0.1016 Starr1.2_000485 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G02 compound treatment 449096.1538 -90100.0 -0.42 209250.0 -268000.0 -1.42 -1.3005 -0.877 Starr1.2_000486 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G03 compound treatment 477000.0 -62200.0 -0.29 409468.0 -68200.0 -0.36 -0.4586 -0.9934 Starr1.2_000487 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G04 compound treatment 410293.1034 -129000.0 -0.59 417303.5714 -60300.0 -0.32 -0.6468 -0.9578 Starr1.2_000488 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G05 compound treatment 696214.5749 157000.0 0.72 487012.8755 9360.0 0.05 0.547 0.7538 Starr1.2_000489 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G06 compound treatment 577150.5376 37900.0 0.17 584275.8621 107000.0 0.57 0.5236 0.8844 Starr1.2_000490 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G07 compound treatment 427375.0 -112000.0 -0.52 440864.3533 -36800.0 -0.2 -0.5027 -0.9115 Starr1.2_000491 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G08 compound treatment 462879.845 -76300.0 -0.35 579276.1194 102000.0 0.54 0.1322 0.2053 Starr1.2_000492 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G09 compound treatment 505056.4784 -34200.0 -0.16 562625.7669 85000.0 0.45 0.2073 0.4341 Starr1.2_000493 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G10 compound treatment 558014.4928 18800.0 0.09 535801.5564 58200.0 0.31 0.2794 0.872 Starr1.2_000494 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G11 compound treatment 91195.6522 -448000.0 -2.07 99722.2222 -378000.0 -2.0 -2.8784 -0.9999 Starr1.2_000495 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G12 compound treatment 595117.4242 55900.0 0.26 484260.4167 6610.0 0.04 0.207 0.796 Starr1.2_000496 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G13 compound treatment 501151.0791 -38100.0 -0.18 534745.5197 57100.0 0.3 0.09 0.257 Starr1.2_000497 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G14 compound treatment 420315.7895 -119000.0 -0.55 395117.6471 -82500.0 -0.44 -0.6973 -0.9938 Starr1.2_000498 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G15 compound treatment 476177.8523 -63100.0 -0.29 443538.6905 -34100.0 -0.18 -0.3335 -0.9739 Starr1.2_000499 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G16 compound treatment 381372.549 -158000.0 -0.73 386048.3871 -91600.0 -0.49 -0.8583 -0.9807 Starr1.2_000500 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G17 compound treatment 359391.0615 -180000.0 -0.83 300303.1915 -177000.0 -0.94 -1.2516 -0.998 Starr1.2_000501 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G18 compound treatment 464232.6389 -75000.0 -0.35 417696.7509 -60000.0 -0.32 -0.4694 -0.9991 Starr1.2_000502 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G19 compound treatment 65360.0 -474000.0 -2.19 65595.7447 -412000.0 -2.19 -3.0906 -1.0 Starr1.2_000503 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G20 compound treatment 438061.7761 -101000.0 -0.47 368087.2483 -110000.0 -0.58 -0.7408 -0.9941 Starr1.2_000504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G21 compound treatment 470105.8824 -69100.0 -0.32 459319.1489 -18300.0 -0.1 -0.2941 -0.8826 Starr1.2_000505 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G22 compound treatment 488628.7879 -50600.0 -0.23 517136.9427 39500.0 0.21 -0.0169 -0.0539 Starr1.2_000506 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G23 mock treatment 612747.5248 73500.0 0.34 440991.9028 -36700.0 -0.19 0.1023 0.2616 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 G24 mock treatment 509330.3965 -29900.0 -0.14 417862.5 -59800.0 -0.32 -0.3217 -0.9304 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H01 compound treatment 471211.1801 -68000.0 -0.31 300566.0377 -177000.0 -0.94 -0.8859 -0.8947 Starr1.2_000507 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H02 compound treatment 671009.7087 132000.0 0.61 675216.8675 198000.0 1.05 1.1707 0.9664 Starr1.2_000508 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H03 compound treatment 620625.5924 81400.0 0.38 563141.129 85500.0 0.45 0.5861 0.9956 Starr1.2_000509 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H04 compound treatment 738896.5517 200000.0 0.92 563459.0909 85800.0 0.46 0.9729 0.9472 Starr1.2_000510 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H05 compound treatment 523609.6491 -15600.0 -0.07 511564.6259 33900.0 0.18 0.0763 0.3936 Starr1.2_000511 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H06 compound treatment 105134.6154 -434000.0 -2.0 79444.4444 -398000.0 -2.11 -2.909 -0.9996 Starr1.2_000512 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H07 compound treatment 512084.1584 -27100.0 -0.13 475636.7713 -2010.0 -0.01 -0.0961 -0.7646 Starr1.2_000513 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H08 compound treatment 94931.8182 -444000.0 -2.05 90066.6667 -388000.0 -2.06 -2.9024 -1.0 Starr1.2_000514 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H09 compound treatment 508506.1224 -30700.0 -0.14 500568.6275 22900.0 0.12 -0.0142 -0.0762 Starr1.2_000515 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H10 compound treatment 451885.5932 -87300.0 -0.4 575129.5547 97500.0 0.52 0.0808 0.1233 Starr1.2_000516 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H11 compound treatment 523601.6949 -15600.0 -0.07 432265.1515 -45400.0 -0.24 -0.2212 -0.8802 Starr1.2_000517 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H12 compound treatment 554824.7012 15600.0 0.07 499950.1779 22300.0 0.12 0.1345 0.9716 Starr1.2_000518 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H13 compound treatment 605676.8707 66400.0 0.31 514184.127 36500.0 0.19 0.3537 0.9756 Starr1.2_000519 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H14 compound treatment 380753.6232 -158000.0 -0.73 408007.4627 -69600.0 -0.37 -0.778 -0.95 Starr1.2_000520 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H15 compound treatment 490338.9831 -48900.0 -0.23 446403.1008 -31200.0 -0.17 -0.2766 -0.9885 Starr1.2_000521 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H16 compound treatment 294419.3548 -245000.0 -1.13 300534.0909 -177000.0 -0.94 -1.4626 -0.9958 Starr1.2_000522 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H17 compound treatment 490055.5556 -49200.0 -0.23 510578.2748 32900.0 0.17 -0.0368 -0.1287 Starr1.2_000523 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H18 compound treatment 383186.3354 -156000.0 -0.72 426560.7477 -51100.0 -0.27 -0.7004 -0.9109 Starr1.2_000524 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H19 compound treatment 503974.7292 -35300.0 -0.16 522904.2553 45300.0 0.24 0.0548 0.1889 Starr1.2_000525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H20 compound treatment 491696.5812 -47500.0 -0.22 401690.3766 -76000.0 -0.4 -0.4399 -0.9591 Starr1.2_000526 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H21 compound treatment 512622.4784 -26600.0 -0.12 478181.5287 533.0 0.0 -0.0848 -0.6906 Starr1.2_000527 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H22 compound treatment 430050.4732 -109000.0 -0.5 494271.875 16600.0 0.09 -0.2937 -0.5745 Starr1.2_000528 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H23 mock treatment 581003.6364 41800.0 0.19 476280.0 -1370.0 -0.01 0.1311 0.68 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 H24 mock treatment 518156.8627 -21100.0 -0.1 456933.1104 -20700.0 -0.11 -0.1464 -0.9981 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I01 compound treatment 540562.963 1330.0 0.01 520011.7188 42400.0 0.22 0.1632 0.7262 Starr1.2_000529 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I02 compound treatment 70045.4545 -469000.0 -2.16 80608.6956 -397000.0 -2.11 -3.0191 -0.9999 Starr1.2_000530 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I03 compound treatment 558878.1513 19600.0 0.09 601903.1008 124000.0 0.66 0.5301 0.7968 Starr1.2_000531 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I04 compound treatment 463305.8252 -75900.0 -0.35 577456.3107 99800.0 0.53 0.1267 0.1997 Starr1.2_000532 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I05 compound treatment 568497.5124 29300.0 0.13 586411.5226 109000.0 0.58 0.5034 0.8496 Starr1.2_000533 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I06 compound treatment 587132.0 47900.0 0.22 656973.7828 179000.0 0.95 0.8288 0.8487 Starr1.2_000534 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I07 compound treatment 623341.5493 84100.0 0.39 581285.7143 104000.0 0.55 0.663 0.9854 Starr1.2_000535 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I08 compound treatment 564725.5639 25500.0 0.12 549570.8155 71900.0 0.38 0.3529 0.884 Starr1.2_000536 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I09 compound treatment 527843.949 -11400.0 -0.05 502049.6689 24400.0 0.13 0.0544 0.3894 Starr1.2_000537 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I10 compound treatment 614006.8027 74800.0 0.34 621003.6765 143000.0 0.76 0.7815 0.936 Starr1.2_000538 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I11 compound treatment 482632.107 -56600.0 -0.26 511260.8696 33600.0 0.18 -0.0585 -0.1851 Starr1.2_000539 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I12 compound treatment 516782.4675 -22400.0 -0.1 620067.0927 142000.0 0.76 0.4609 0.6046 Starr1.2_000540 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I13 compound treatment 682058.1818 143000.0 0.66 603115.6716 125000.0 0.67 0.9363 1.0 Starr1.2_000541 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I14 compound treatment 403716.3462 -136000.0 -0.62 352057.6132 -126000.0 -0.67 -0.9129 -0.9995 Starr1.2_000542 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I15 compound treatment 468692.7711 -70500.0 -0.33 515518.2927 37900.0 0.2 -0.088 -0.2301 Starr1.2_000543 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I16 compound treatment 266670.2128 -273000.0 -1.26 389684.7826 -88000.0 -0.47 -1.2187 -0.909 Starr1.2_000544 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I17 compound treatment 71090.9091 -468000.0 -2.16 81975.6098 -396000.0 -2.1 -3.0105 -0.9999 Starr1.2_000545 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I18 compound treatment 518885.7143 -20300.0 -0.09 454807.4324 -22800.0 -0.12 -0.152 -0.992 Starr1.2_000546 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I19 compound treatment 294683.5443 -245000.0 -1.13 374025.0 -104000.0 -0.55 -1.1861 -0.9454 Starr1.2_000547 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I20 compound treatment 481111.1111 -58100.0 -0.27 655097.2222 177000.0 0.94 0.476 0.4864 Starr1.2_000548 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I21 compound treatment 648207.0313 109000.0 0.5 542961.6858 65300.0 0.35 0.6003 0.9835 Starr1.2_000549 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I22 compound treatment 479040.2685 -60200.0 -0.28 548034.2466 70400.0 0.37 0.0677 0.1455 Starr1.2_000550 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I23 mock treatment 602116.9355 62900.0 0.29 486535.2113 8890.0 0.05 0.2384 0.8114 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 I24 mock treatment 625236.3636 86000.0 0.4 501490.7063 23800.0 0.13 0.3699 0.8885 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J01 compound treatment 664208.8889 125000.0 0.58 524978.8732 47300.0 0.25 0.5851 0.9306 Starr1.2_000551 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J02 compound treatment 573985.4369 34800.0 0.16 529038.7324 51400.0 0.27 0.3061 0.968 Starr1.2_000552 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J03 compound treatment 707502.1645 168000.0 0.78 679906.81 202000.0 1.07 1.3073 0.9874 Starr1.2_000553 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J04 compound treatment 769920.5607 231000.0 1.06 516261.8182 38600.0 0.2 0.8971 0.828 Starr1.2_000554 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J05 compound treatment 649917.7489 111000.0 0.51 691554.3478 214000.0 1.13 1.1632 0.935 Starr1.2_000555 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J06 compound treatment 437529.4118 -102000.0 -0.47 544102.3622 66500.0 0.35 -0.0824 -0.1405 Starr1.2_000556 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J07 compound treatment 537159.204 -2070.0 -0.01 543615.0235 66000.0 0.35 0.2407 0.6876 Starr1.2_000557 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J08 compound treatment 73355.5556 -466000.0 -2.15 53192.3077 -424000.0 -2.25 -3.1111 -0.9997 Starr1.2_000558 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J09 compound treatment 460725.1908 -78500.0 -0.36 569408.9457 91800.0 0.49 0.0882 0.1453 Starr1.2_000559 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J10 compound treatment 235618.1818 -304000.0 -1.4 215822.4299 -262000.0 -1.39 -1.972 -1.0 Starr1.2_000560 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J11 compound treatment 377454.5455 -162000.0 -0.75 347130.8411 -131000.0 -0.69 -1.017 -0.9993 Starr1.2_000561 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J12 compound treatment 668251.5723 129000.0 0.6 566663.1579 89000.0 0.47 0.7546 0.9934 Starr1.2_000562 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J13 compound treatment 599688.9632 60500.0 0.28 556514.5631 78900.0 0.42 0.4929 0.9806 Starr1.2_000563 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J14 compound treatment 548450.7576 9220.0 0.04 626180.9524 149000.0 0.79 0.5871 0.7442 Starr1.2_000564 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J15 compound treatment 529287.6712 -9940.0 -0.05 479132.5301 1480.0 0.01 -0.0269 -0.5773 Starr1.2_000565 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J16 compound treatment 509889.2617 -29300.0 -0.14 539534.7222 61900.0 0.33 0.1364 0.3843 Starr1.2_000566 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J17 compound treatment 486806.6914 -52400.0 -0.24 516232.9749 38600.0 0.2 -0.0262 -0.0828 Starr1.2_000567 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J18 compound treatment 540158.1197 929.0 0.0 403616.0 -74000.0 -0.39 -0.2746 -0.6993 Starr1.2_000568 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J19 compound treatment 529243.6709 -9990.0 -0.05 697972.4138 220000.0 1.17 0.7938 0.6787 Starr1.2_000569 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J20 compound treatment 495873.5294 -43400.0 -0.2 534343.75 56700.0 0.3 0.0713 0.1973 Starr1.2_000570 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J21 compound treatment 591816.8498 52600.0 0.24 484450.4505 6800.0 0.04 0.197 0.8035 Starr1.2_000571 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J22 compound treatment 552545.1977 13300.0 0.06 626997.1014 149000.0 0.79 0.6036 0.7596 Starr1.2_000572 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J23 mock treatment 495571.4286 -43700.0 -0.2 486348.9097 8700.0 0.05 -0.1097 -0.5313 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 J24 mock treatment 472086.9565 -67100.0 -0.31 451371.5278 -26300.0 -0.14 -0.3175 -0.935 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K01 compound treatment 634545.045 95300.0 0.44 510545.0644 32900.0 0.17 0.4342 0.9181 Starr1.2_000573 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K02 compound treatment 64224.4898 -475000.0 -2.19 63180.0 -414000.0 -2.2 -3.1034 -1.0 Starr1.2_000574 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K03 compound treatment 513186.2745 -26000.0 -0.12 388826.6667 -88800.0 -0.47 -0.418 -0.8599 Starr1.2_000575 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K04 compound treatment 681454.1833 142000.0 0.66 581223.5772 104000.0 0.55 0.8522 0.9961 Starr1.2_000576 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K05 compound treatment 529305.7851 -9920.0 -0.05 526420.4545 48800.0 0.26 0.1506 0.5731 Starr1.2_000577 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K06 compound treatment 550324.2321 11100.0 0.05 607571.4286 130000.0 0.69 0.5235 0.7575 Starr1.2_000578 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K07 compound treatment 547621.9931 8390.0 0.04 430726.3514 -46900.0 -0.25 -0.1486 -0.59 Starr1.2_000579 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K08 compound treatment 681003.8462 142000.0 0.65 653573.3788 176000.0 0.93 1.1221 0.9849 Starr1.2_000580 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K09 compound treatment 296975.2066 -242000.0 -1.12 310751.773 -167000.0 -0.89 -1.4159 -0.9934 Starr1.2_000581 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K10 compound treatment 651257.0533 112000.0 0.52 630987.6543 153000.0 0.81 0.9404 0.976 Starr1.2_000582 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K11 compound treatment 574571.4286 35300.0 0.16 633360.0 156000.0 0.83 0.6992 0.8306 Starr1.2_000583 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K12 compound treatment 527094.8276 -12100.0 -0.06 482728.3582 5080.0 0.03 -0.0205 -0.3303 Starr1.2_000584 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K13 compound treatment 682699.6198 143000.0 0.66 655229.7297 178000.0 0.94 1.1339 0.9851 Starr1.2_000585 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K14 compound treatment 923554.5244 384000.0 1.77 899427.5534 422000.0 2.24 2.8351 0.9933 Starr1.2_000586 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K15 compound treatment 548226.9939 9000.0 0.04 485474.9263 7830.0 0.04 0.0587 1.0 Starr1.2_000587 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K16 compound treatment 574088.2353 34900.0 0.16 547341.9355 69700.0 0.37 0.3751 0.9304 Starr1.2_000588 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K17 compound treatment 513157.377 -26100.0 -0.12 525666.6667 48000.0 0.25 0.0951 0.3376 Starr1.2_000589 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K18 compound treatment 541428.125 2200.0 0.01 489082.2368 11400.0 0.06 0.0501 0.8141 Starr1.2_000590 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K19 compound treatment 430302.6316 -109000.0 -0.5 429848.3146 -47800.0 -0.25 -0.5345 -0.9499 Starr1.2_000591 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K20 compound treatment 442068.8259 -97200.0 -0.45 376814.0351 -101000.0 -0.53 -0.695 -0.9961 Starr1.2_000592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K21 compound treatment 614336.7698 75100.0 0.35 621681.4815 144000.0 0.76 0.7851 0.936 Starr1.2_000593 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K22 compound treatment 501427.2446 -37800.0 -0.17 429970.0375 -47700.0 -0.25 -0.3021 -0.9835 Starr1.2_000594 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K23 mock treatment 546673.913 7440.0 0.03 496032.8947 18400.0 0.1 0.0932 0.9018 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 K24 mock treatment 531145.9227 -8080.0 -0.04 537913.9073 60300.0 0.32 0.1997 0.6204 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L01 compound treatment 531842.3423 -7390.0 -0.03 512382.1429 34700.0 0.18 0.1062 0.5668 Starr1.2_000595 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L02 compound treatment 408404.7619 -131000.0 -0.6 514516.4835 36900.0 0.2 -0.2883 -0.4546 Starr1.2_000596 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L03 compound treatment 797789.2857 259000.0 1.19 807364.9123 330000.0 1.75 2.0797 0.9826 Starr1.2_000597 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L04 compound treatment 707192.0 168000.0 0.77 552138.3399 74500.0 0.4 0.8271 0.9512 Starr1.2_000598 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L05 compound treatment 711902.1739 173000.0 0.8 741682.8358 264000.0 1.4 1.5533 0.9642 Starr1.2_000599 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L06 compound treatment 285505.7471 -254000.0 -1.17 250154.7619 -227000.0 -1.21 -1.6806 -0.9999 Starr1.2_000600 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L07 compound treatment 428616.2791 -111000.0 -0.51 429034.4828 -48600.0 -0.26 -0.543 -0.9501 Starr1.2_000601 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L08 compound treatment 242318.6813 -297000.0 -1.37 172959.4595 -305000.0 -1.62 -2.1109 -0.9966 Starr1.2_000602 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L09 compound treatment 661869.1275 123000.0 0.57 540003.2468 62400.0 0.33 0.6338 0.9673 Starr1.2_000603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L10 compound treatment 248519.6078 -291000.0 -1.34 209230.7692 -268000.0 -1.42 -1.9547 -0.9995 Starr1.2_000604 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L11 compound treatment 548244.4444 9020.0 0.04 570111.1111 92500.0 0.49 0.3762 0.7643 Starr1.2_000605 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L12 compound treatment 215950.0 -323000.0 -1.49 218682.243 -259000.0 -1.37 -2.0254 -0.9992 Starr1.2_000606 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L13 compound treatment 588813.8801 49600.0 0.23 516895.6835 39200.0 0.21 0.3089 0.9989 Starr1.2_000607 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L14 compound treatment 48555.5556 -491000.0 -2.26 138363.6364 -339000.0 -1.8 -2.8725 -0.9936 Starr1.2_000608 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L15 compound treatment 452863.0705 -86400.0 -0.4 607736.6071 130000.0 0.69 0.2063 0.2589 Starr1.2_000609 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L16 compound treatment 405333.3333 -134000.0 -0.62 469496.7949 -8150.0 -0.04 -0.4672 -0.7548 Starr1.2_000610 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L17 compound treatment 603516.7173 64300.0 0.3 595860.9272 118000.0 0.63 0.653 0.9415 Starr1.2_000611 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L18 compound treatment 604018.8088 64800.0 0.3 661124.1611 183000.0 0.97 0.8994 0.8835 Starr1.2_000612 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L19 compound treatment 638251.5924 99000.0 0.46 640289.7196 163000.0 0.86 0.9329 0.9558 Starr1.2_000613 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L20 compound treatment 611980.3922 72800.0 0.34 451099.0712 -26500.0 -0.14 0.1377 0.3783 Starr1.2_000614 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L21 compound treatment 512784.3137 -26400.0 -0.12 551059.1549 73400.0 0.39 0.1891 0.4634 Starr1.2_000615 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L22 compound treatment 525555.5556 -13700.0 -0.06 608328.3582 131000.0 0.69 0.4455 0.6401 Starr1.2_000616 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L23 mock treatment 500980.8917 -38200.0 -0.18 489241.8301 11600.0 0.06 -0.0812 -0.4349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 L24 mock treatment 501338.7755 -37900.0 -0.17 471557.8947 -6090.0 -0.03 -0.1464 -0.8239 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M01 compound treatment 554103.9427 14900.0 0.07 496530.1587 18900.0 0.1 0.1193 0.983 Starr1.2_000617 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M02 compound treatment 93909.0909 -445000.0 -2.05 76545.4545 -401000.0 -2.13 -2.9565 -0.9998 Starr1.2_000618 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M03 compound treatment 564246.0938 25000.0 0.12 477961.1307 313.0 0.0 0.0828 0.7172 Starr1.2_000619 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M04 compound treatment 770783.8983 232000.0 1.07 639013.5593 161000.0 0.86 1.3603 0.994 Starr1.2_000620 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M05 compound treatment 604742.7184 65500.0 0.3 547462.6168 69800.0 0.37 0.4755 0.9949 Starr1.2_000621 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M06 compound treatment 616802.0833 77600.0 0.36 639362.8692 162000.0 0.86 0.8595 0.9248 Starr1.2_000622 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M07 compound treatment 589026.178 49800.0 0.23 708980.9524 231000.0 1.23 1.03 0.8251 Starr1.2_000623 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M08 compound treatment 637768.9655 98500.0 0.45 640768.9655 163000.0 0.87 0.9331 0.9548 Starr1.2_000624 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M09 compound treatment 502859.6491 -36400.0 -0.17 430680.8511 -47000.0 -0.25 -0.2947 -0.9815 Starr1.2_000625 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M10 compound treatment 600838.4146 61600.0 0.28 618307.4534 141000.0 0.75 0.7284 0.9125 Starr1.2_000626 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M11 compound treatment 572423.4875 33200.0 0.15 618655.4878 141000.0 0.75 0.6371 0.8345 Starr1.2_000627 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M12 compound treatment 538525.0 -704.0 0.0 608962.5 131000.0 0.7 0.4902 0.7038 Starr1.2_000628 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M13 compound treatment 553215.873 14000.0 0.06 574444.0433 96800.0 0.51 0.4086 0.7897 Starr1.2_000629 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M14 compound treatment 448076.9231 -91200.0 -0.42 504007.6336 26400.0 0.14 -0.1984 -0.4478 Starr1.2_000630 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M15 compound treatment 36231.8841 -503000.0 -2.32 42531.25 -435000.0 -2.31 -3.2721 -1.0 Starr1.2_000631 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M16 compound treatment 516869.0096 -22400.0 -0.1 522287.5399 44600.0 0.24 0.0945 0.3659 Starr1.2_000632 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M17 compound treatment 453746.8354 -85500.0 -0.39 518900.3215 41300.0 0.22 -0.124 -0.2751 Starr1.2_000633 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M18 compound treatment 457545.7516 -81700.0 -0.38 486051.6129 8400.0 0.04 -0.2348 -0.6191 Starr1.2_000634 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M19 compound treatment 531897.1963 -7330.0 -0.03 530616.8224 53000.0 0.28 0.1747 0.6175 Starr1.2_000635 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M20 compound treatment 159680.5556 -380000.0 -1.75 111750.0 -366000.0 -1.94 -2.61 -0.9987 Starr1.2_000636 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M21 compound treatment 572952.9412 33700.0 0.16 565961.8529 88300.0 0.47 0.4412 0.8939 Starr1.2_000637 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M22 compound treatment 484739.5833 -54500.0 -0.25 502464.7059 24800.0 0.13 -0.0846 -0.2983 Starr1.2_000638 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M23 mock treatment 493072.8477 -46200.0 -0.21 563941.3793 86300.0 0.46 0.1731 0.343 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 M24 mock treatment 532194.8882 -7030.0 -0.03 430727.9693 -46900.0 -0.25 -0.1989 -0.7926 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N01 compound treatment 665108.9494 126000.0 0.58 458840.4255 -18800.0 -0.1 0.3399 0.5771 Starr1.2_000639 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N02 compound treatment 726595.2381 187000.0 0.86 406053.5714 -71600.0 -0.38 0.3425 0.3629 Starr1.2_000640 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N03 compound treatment 777556.3636 238000.0 1.1 531983.7662 54300.0 0.29 0.981 0.8633 Starr1.2_000641 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N04 compound treatment 726846.1538 188000.0 0.87 303121.2121 -175000.0 -0.93 -0.0428 -0.0337 Starr1.2_000642 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N05 compound treatment 675368.231 136000.0 0.63 664846.6667 187000.0 0.99 1.146 0.9756 Starr1.2_000643 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N06 compound treatment 355376.0684 -184000.0 -0.85 389364.486 -88300.0 -0.47 -0.9306 -0.9608 Starr1.2_000644 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N07 compound treatment 264714.2857 -275000.0 -1.27 281776.4706 -196000.0 -1.04 -1.6298 -0.9952 Starr1.2_000645 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N08 compound treatment 646816.129 108000.0 0.5 796456.1934 319000.0 1.69 1.5465 0.8776 Starr1.2_000646 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N09 compound treatment 531974.8744 -7250.0 -0.03 490861.244 13200.0 0.07 0.0259 0.3335 Starr1.2_000647 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N10 compound treatment 478301.2552 -60900.0 -0.28 463516.8067 -14100.0 -0.07 -0.2517 -0.8655 Starr1.2_000648 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N11 compound treatment 478514.6444 -60700.0 -0.28 465847.4576 -11800.0 -0.06 -0.2422 -0.8443 Starr1.2_000649 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N12 compound treatment 635985.5072 96800.0 0.45 631061.4035 153000.0 0.81 0.8909 0.96 Starr1.2_000650 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N13 compound treatment 668732.852 130000.0 0.6 514774.1935 37100.0 0.2 0.5615 0.893 Starr1.2_000651 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N14 compound treatment 184065.9341 -355000.0 -1.64 214877.7778 -263000.0 -1.39 -2.1437 -0.9968 Starr1.2_000652 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N15 compound treatment 484824.0343 -54400.0 -0.25 550653.3865 73000.0 0.39 0.0964 0.2089 Starr1.2_000653 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N16 compound treatment 550996.9419 11800.0 0.05 423715.4696 -53900.0 -0.29 -0.1639 -0.5629 Starr1.2_000654 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N17 compound treatment 576722.807 37500.0 0.17 548301.5873 70700.0 0.37 0.3872 0.9383 Starr1.2_000655 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N18 compound treatment 631603.7736 92400.0 0.43 498153.1792 20500.0 0.11 0.3781 0.86 Starr1.2_000656 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N19 compound treatment 578806.0606 39600.0 0.18 667533.101 190000.0 1.01 0.8412 0.8219 Starr1.2_000657 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N20 compound treatment 536132.5758 -3100.0 -0.01 511467.354 33800.0 0.18 0.1167 0.6488 Starr1.2_000658 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N21 compound treatment 512602.3055 -26600.0 -0.12 498501.548 20900.0 0.11 -0.0086 -0.0522 Starr1.2_000659 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N22 compound treatment 449411.215 -89800.0 -0.41 545342.5926 67700.0 0.36 -0.039 -0.0712 Starr1.2_000660 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N23 mock treatment 477047.3186 -62200.0 -0.29 577692.053 100000.0 0.53 0.1724 0.2859 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 N24 mock treatment 517069.3069 -22200.0 -0.1 464379.661 -13300.0 -0.07 -0.122 -0.9834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O01 compound treatment 506227.1062 -33000.0 -0.15 455909.396 -21700.0 -0.12 -0.1891 -0.9906 Starr1.2_000661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O02 compound treatment 83782.6087 -455000.0 -2.1 84000.0 -394000.0 -2.09 -2.9615 -1.0 Starr1.2_000662 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O03 compound treatment 704306.0345 165000.0 0.76 565462.069 87800.0 0.47 0.8676 0.9722 Starr1.2_000663 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O04 compound treatment 554608.2949 15400.0 0.07 578322.0974 101000.0 0.53 0.4277 0.7941 Starr1.2_000664 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O05 compound treatment 603495.4128 64300.0 0.3 594483.2536 117000.0 0.62 0.6478 0.943 Starr1.2_000665 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O06 compound treatment 518772.5753 -20500.0 -0.09 503118.0328 25500.0 0.14 0.0288 0.1749 Starr1.2_000666 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O07 compound treatment 503627.6596 -35600.0 -0.16 544471.1538 66800.0 0.35 0.1345 0.3444 Starr1.2_000667 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O08 compound treatment 577726.8908 38500.0 0.18 481646.6667 4000.0 0.02 0.1405 0.786 Starr1.2_000668 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O09 compound treatment 612800.0 73600.0 0.34 618400.0 141000.0 0.75 0.7678 0.9363 Starr1.2_000669 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O10 compound treatment 583780.0687 44600.0 0.21 576111.8211 98500.0 0.52 0.5146 0.9169 Starr1.2_000670 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O11 compound treatment 548288.5246 9060.0 0.04 494730.1038 17100.0 0.09 0.0936 0.9382 Starr1.2_000671 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O12 compound treatment 606788.7324 67600.0 0.31 495732.5228 18100.0 0.1 0.2881 0.8839 Starr1.2_000672 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O13 compound treatment 566253.0612 27000.0 0.12 566462.5 88800.0 0.47 0.4212 0.8644 Starr1.2_000673 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O14 compound treatment 64139.5349 -475000.0 -2.19 64886.3636 -413000.0 -2.19 -3.0973 -1.0 Starr1.2_000674 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O15 compound treatment 112079.3651 -427000.0 -1.97 87848.4848 -390000.0 -2.07 -2.8548 -0.9997 Starr1.2_000675 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O16 compound treatment 572848.9796 33600.0 0.16 490664.5161 13000.0 0.07 0.1584 0.9336 Starr1.2_000676 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O17 compound treatment 455533.3333 -83700.0 -0.39 449920.5776 -27700.0 -0.15 -0.3769 -0.9125 Starr1.2_000677 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O18 compound treatment 408730.659 -130000.0 -0.6 449782.6087 -27900.0 -0.15 -0.5301 -0.8553 Starr1.2_000678 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O19 compound treatment 375760.0 -163000.0 -0.75 361594.3775 -116000.0 -0.62 -0.9683 -0.9949 Starr1.2_000679 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O20 compound treatment 453416.6667 -85800.0 -0.4 418619.8347 -59000.0 -0.31 -0.5012 -0.9933 Starr1.2_000680 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O21 compound treatment 310179.1045 -229000.0 -1.06 221272.7273 -256000.0 -1.36 -1.7084 -0.9922 Starr1.2_000681 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O22 compound treatment 452408.6687 -86800.0 -0.4 473912.7726 -3740.0 -0.02 -0.2971 -0.7412 Starr1.2_000682 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O23 mock treatment 493012.0482 -46200.0 -0.21 460085.2459 -17600.0 -0.09 -0.2166 -0.9311 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 O24 mock treatment 470140.3509 -69100.0 -0.32 413406.25 -64200.0 -0.34 -0.4662 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P01 compound treatment 464786.2903 -74400.0 -0.34 396580.2048 -81100.0 -0.43 -0.5468 -0.9938 Starr1.2_000683 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P02 compound treatment 206844.1558 -332000.0 -1.53 197935.0649 -280000.0 -1.48 -2.1329 -0.9999 Starr1.2_000684 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P03 compound treatment 483243.4783 -56000.0 -0.26 264923.913 -213000.0 -1.13 -0.9804 -0.847 Starr1.2_000685 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P04 compound treatment 371535.7143 -168000.0 -0.77 373132.2314 -105000.0 -0.55 -0.9388 -0.9867 Starr1.2_000686 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P05 compound treatment 486893.1298 -52300.0 -0.24 408922.8487 -68700.0 -0.36 -0.4284 -0.98 Starr1.2_000687 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P06 compound treatment 595285.1563 56100.0 0.26 624363.9344 147000.0 0.78 0.733 0.894 Starr1.2_000688 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P07 compound treatment 295214.2857 -244000.0 -1.13 301550.7246 -176000.0 -0.93 -1.4562 -0.9957 Starr1.2_000689 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P08 compound treatment 515236.3014 -24000.0 -0.11 478835.2273 1190.0 0.01 -0.0738 -0.6658 Starr1.2_000690 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P09 compound treatment 122021.2766 -417000.0 -1.92 82612.2449 -395000.0 -2.1 -2.8421 -0.9991 Starr1.2_000691 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P10 compound treatment 560876.1468 21600.0 0.1 472440.625 -5210.0 -0.03 0.0511 0.4929 Starr1.2_000692 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P11 compound treatment 425345.4545 -114000.0 -0.53 414766.4474 -62900.0 -0.33 -0.6072 -0.976 Starr1.2_000693 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P12 compound treatment 72807.6923 -466000.0 -2.15 66473.6842 -411000.0 -2.18 -3.0631 -1.0 Starr1.2_000694 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P13 compound treatment 466680.8511 -72500.0 -0.33 413175.9531 -64500.0 -0.34 -0.4784 -0.9999 Starr1.2_000695 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P14 compound treatment 465669.5652 -73600.0 -0.34 364712.7273 -113000.0 -0.6 -0.6634 -0.9637 Starr1.2_000696 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P15 compound treatment 478006.4725 -61200.0 -0.28 441034.1615 -36600.0 -0.19 -0.337 -0.9833 Starr1.2_000697 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P16 compound treatment 433723.127 -106000.0 -0.49 370569.8324 -107000.0 -0.57 -0.7456 -0.997 Starr1.2_000698 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P17 compound treatment 377389.4737 -162000.0 -0.75 364884.6154 -113000.0 -0.6 -0.9507 -0.994 Starr1.2_000699 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P18 compound treatment 453528.9575 -85700.0 -0.4 486866.6667 9220.0 0.05 -0.2449 -0.6149 Starr1.2_000700 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P19 compound treatment 378269.5925 -161000.0 -0.74 352924.5283 -125000.0 -0.66 -0.9927 -0.9983 Starr1.2_000701 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P20 compound treatment 425695.3642 -114000.0 -0.52 464638.6293 -13000.0 -0.07 -0.419 -0.7934 Starr1.2_000702 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P21 compound treatment 395341.3897 -144000.0 -0.66 384960.9375 -92700.0 -0.49 -0.8168 -0.9891 Starr1.2_000703 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P22 compound treatment 364426.087 -175000.0 -0.81 339297.6744 -138000.0 -0.73 -1.0889 -0.9989 Starr1.2_000704 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P23 mock treatment 408000.0 -131000.0 -0.61 361346.0411 -116000.0 -0.62 -0.8641 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2144 P24 mock treatment 416547.1698 -123000.0 -0.57 370034.9206 -108000.0 -0.57 -0.8037 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A01 compound treatment 658631.3559 147000.0 0.68 650428.5714 -12800.0 -0.07 0.4317 0.6332 Starr1.2_000705 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A02 compound treatment 669479.8206 158000.0 0.73 748217.7778 85000.0 0.45 0.8339 0.9734 Starr1.2_000706 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A03 compound treatment 285960.0 -226000.0 -1.04 260837.2093 -402000.0 -2.13 -2.2447 -0.9454 Starr1.2_000707 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A04 compound treatment 658961.9565 147000.0 0.68 621197.861 -42000.0 -0.22 0.3232 0.4516 Starr1.2_000708 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A05 compound treatment 854578.1991 343000.0 1.58 934931.1927 272000.0 1.44 2.1377 0.9989 Starr1.2_000709 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A06 compound treatment 449630.137 -61900.0 -0.29 493395.3488 -170000.0 -0.9 -0.8388 -0.8877 Starr1.2_000710 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A07 compound treatment 801441.1765 290000.0 1.34 802447.1154 139000.0 0.74 1.4676 0.9608 Starr1.2_000711 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A08 compound treatment 858862.7451 347000.0 1.6 802458.9372 139000.0 0.74 1.6548 0.9382 Starr1.2_000712 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A09 compound treatment 844933.3333 333000.0 1.54 784086.5385 121000.0 0.64 1.5405 0.9248 Starr1.2_000713 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A10 compound treatment 678719.8068 167000.0 0.77 723946.6667 60700.0 0.32 0.773 0.925 Starr1.2_000714 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A11 compound treatment 848046.9484 337000.0 1.55 508497.6744 -155000.0 -0.82 0.5171 0.2945 Starr1.2_000715 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A12 compound treatment 511431.8182 -85.3 0.0 396784.4828 -266000.0 -1.41 -0.9996 -0.7073 Starr1.2_000716 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A13 compound treatment 762975.7576 251000.0 1.16 798584.6154 135000.0 0.72 1.3276 0.9734 Starr1.2_000717 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A14 compound treatment 794073.7327 283000.0 1.3 772132.4201 109000.0 0.58 1.3298 0.933 Starr1.2_000718 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A15 compound treatment 476304.6358 -35200.0 -0.16 613556.8182 -49700.0 -0.26 -0.3011 -0.973 Starr1.2_000719 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A16 compound treatment 894302.3256 383000.0 1.77 1164160.0 501000.0 2.66 3.127 0.9803 Starr1.2_000720 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A17 compound treatment 686863.2075 175000.0 0.81 697051.6432 33800.0 0.18 0.6986 0.8435 Starr1.2_000721 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A18 compound treatment 307039.604 -204000.0 -0.94 350009.7087 -313000.0 -1.66 -1.8415 -0.964 Starr1.2_000722 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A19 compound treatment 642469.4836 131000.0 0.6 680862.7451 17600.0 0.09 0.4932 0.807 Starr1.2_000723 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A20 compound treatment 710333.3333 199000.0 0.92 741960.7843 78700.0 0.42 0.9436 0.9366 Starr1.2_000724 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A21 compound treatment 665464.4351 154000.0 0.71 600516.7464 -62700.0 -0.33 0.2668 0.3403 Starr1.2_000725 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A22 compound treatment 807807.5117 296000.0 1.37 917016.5289 254000.0 1.35 1.918 1.0 Starr1.2_000726 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A23 mock treatment 575696.6292 64200.0 0.3 703070.2703 39800.0 0.21 0.3587 0.9864 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 A24 mock treatment 711317.0732 200000.0 0.92 700620.5128 37400.0 0.2 0.7918 0.8401 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B01 mock treatment 798593.4579 287000.0 1.32 657601.1905 -5630.0 -0.03 0.915 0.691 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B02 mock treatment 666908.6294 155000.0 0.72 758815.0 95600.0 0.51 0.8652 0.9856 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B03 mock treatment 855287.8049 344000.0 1.59 691509.8039 28300.0 0.15 1.2271 0.7706 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B04 mock treatment 694830.0971 183000.0 0.85 669619.5122 6390.0 0.03 0.6217 0.7349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B05 mock treatment 702137.1681 191000.0 0.88 752323.3831 89100.0 0.47 0.9557 0.9576 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B06 mock treatment 700291.4798 189000.0 0.87 753235.2941 90000.0 0.48 0.9531 0.96 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B07 mock treatment 890029.8507 379000.0 1.75 733226.8041 70000.0 0.37 1.4968 0.8387 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B08 mock treatment 771952.6066 260000.0 1.2 865647.9592 202000.0 1.07 1.6084 0.9984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B09 mock treatment 844583.7104 333000.0 1.54 741000.0 77800.0 0.41 1.3778 0.8663 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B10 mock treatment 680680.0 169000.0 0.78 678707.113 15500.0 0.08 0.6097 0.7772 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B11 mock treatment 711979.5918 200000.0 0.92 738315.3153 75100.0 0.4 0.9353 0.9292 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B12 mock treatment 814519.2308 303000.0 1.4 766081.448 103000.0 0.55 1.3738 0.9158 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B13 mock treatment 679650.2242 168000.0 0.78 754202.6432 91000.0 0.48 0.8895 0.974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B14 mock treatment 792269.0583 281000.0 1.29 731138.8889 67900.0 0.36 1.1702 0.8708 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B15 mock treatment 807640.0 296000.0 1.37 771038.4615 108000.0 0.57 1.37 0.9253 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B16 mock treatment 562251.0823 50700.0 0.23 824238.5787 161000.0 0.85 0.7693 0.8688 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B17 mock treatment 819691.3043 308000.0 1.42 694064.8148 30800.0 0.16 1.1206 0.7833 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B18 mock treatment 705370.2128 194000.0 0.89 873573.5294 210000.0 1.12 1.421 0.994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B19 mock treatment 723013.0435 211000.0 0.98 657329.9492 -5900.0 -0.03 0.6675 0.6841 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B20 mock treatment 782620.0 271000.0 1.25 786962.5668 124000.0 0.66 1.3481 0.9547 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B21 mock treatment 708454.5455 197000.0 0.91 633210.2804 -30000.0 -0.16 0.5296 0.5744 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B22 mock treatment 712777.7778 201000.0 0.93 818339.2857 155000.0 0.82 1.238 0.9982 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B23 mock treatment 836986.0465 325000.0 1.5 617497.5845 -45700.0 -0.24 0.8898 0.5852 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 B24 mock treatment 696796.4602 185000.0 0.85 709795.2381 46600.0 0.25 0.7788 0.8757 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C01 compound treatment 658634.6154 147000.0 0.68 577158.6538 -86100.0 -0.46 0.1569 0.1919 Starr1.2_000727 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C02 compound treatment 260826.6667 -251000.0 -1.16 272902.7778 -390000.0 -2.07 -2.2814 -0.9621 Starr1.2_000728 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C03 compound treatment 706990.991 195000.0 0.9 836706.1611 173000.0 0.92 1.288 0.9999 Starr1.2_000729 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C04 compound treatment 546765.7143 35200.0 0.16 879609.2437 216000.0 1.15 0.9265 0.7993 Starr1.2_000730 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C05 compound treatment 588116.2791 76600.0 0.35 749994.7917 86800.0 0.46 0.5752 0.9915 Starr1.2_000731 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C06 compound treatment 633077.3067 122000.0 0.56 933558.6854 270000.0 1.43 1.4103 0.916 Starr1.2_000732 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C07 compound treatment 434906.7055 -76600.0 -0.35 878738.3178 216000.0 1.14 0.5584 0.4668 Starr1.2_000733 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C08 compound treatment 463816.4894 -47700.0 -0.22 680675.2137 17400.0 0.09 -0.0901 -0.3776 Starr1.2_000734 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C09 compound treatment 615671.0098 104000.0 0.48 628719.2982 -34500.0 -0.18 0.2102 0.409 Starr1.2_000735 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C10 compound treatment 524047.3373 12500.0 0.06 722143.5644 58900.0 0.31 0.2618 0.8239 Starr1.2_000736 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C11 compound treatment 703120.5674 192000.0 0.88 754262.2951 91000.0 0.48 0.9662 0.9596 Starr1.2_000737 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C12 compound treatment 466360.2941 -45200.0 -0.21 693024.0964 29800.0 0.16 -0.0355 -0.1358 Starr1.2_000738 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C13 compound treatment 250381.1475 -261000.0 -1.2 738708.0745 75500.0 0.4 -0.5685 -0.4479 Starr1.2_000739 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C14 compound treatment 586130.9904 74600.0 0.34 642862.7451 -20400.0 -0.11 0.1669 0.4628 Starr1.2_000740 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C15 compound treatment 12361.6236 -499000.0 -2.3 76180.3279 -587000.0 -3.11 -3.8294 -0.989 Starr1.2_000741 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C16 compound treatment 365352.6448 -146000.0 -0.67 622018.2648 -41200.0 -0.22 -0.6312 -0.8907 Starr1.2_000742 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C17 compound treatment 128310.8614 -383000.0 -1.77 412372.3404 -251000.0 -1.33 -2.1904 -0.9902 Starr1.2_000743 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C18 compound treatment 209203.3426 -302000.0 -1.39 657538.4615 -5690.0 -0.03 -1.0072 -0.7222 Starr1.2_000744 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C19 compound treatment 534296.4072 22800.0 0.11 831215.6863 168000.0 0.89 0.7043 0.785 Starr1.2_000745 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C20 compound treatment 420957.5758 -90600.0 -0.42 814182.7411 151000.0 0.8 0.2708 0.2999 Starr1.2_000746 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C21 compound treatment 543050.8906 31500.0 0.15 669242.915 6010.0 0.03 0.1254 0.8422 Starr1.2_000747 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C22 compound treatment 503711.1111 -7810.0 -0.04 533108.4906 -130000.0 -0.69 -0.5135 -0.743 Starr1.2_000748 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C23 mock treatment 826816.7539 315000.0 1.45 696504.8077 33300.0 0.18 1.153 0.7872 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 C24 mock treatment 716612.9032 205000.0 0.95 610948.4536 -52300.0 -0.28 0.4727 0.4796 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D01 mock treatment 790558.5586 279000.0 1.29 714425.9259 51200.0 0.27 1.1019 0.8379 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D02 mock treatment 767339.5349 256000.0 1.18 868284.4037 205000.0 1.09 1.6033 0.9992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D03 mock treatment 714972.0 203000.0 0.94 828653.3333 165000.0 0.88 1.2839 0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D04 mock treatment 566547.4684 55000.0 0.25 698430.9623 35200.0 0.19 0.3115 0.9886 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D05 mock treatment 624501.6722 113000.0 0.52 599880.1653 -63300.0 -0.34 0.1308 0.211 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D06 mock treatment 232692.4939 -279000.0 -1.29 675640.4494 12400.0 0.07 -0.8627 -0.67 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D07 mock treatment 455237.4302 -56300.0 -0.26 661935.1852 -1290.0 -0.01 -0.1884 -0.7256 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D08 mock treatment 499373.494 -12100.0 -0.06 601301.676 -61900.0 -0.33 -0.2719 -0.8159 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D09 mock treatment 506006.6225 -5510.0 -0.03 694021.8579 30800.0 0.16 0.0975 0.59 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D10 mock treatment 464679.6657 -46800.0 -0.22 609830.6878 -53400.0 -0.28 -0.353 -0.9911 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D11 mock treatment 436205.6338 -75300.0 -0.35 684219.5122 21000.0 0.11 -0.1669 -0.4575 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D12 mock treatment 464892.638 -46600.0 -0.22 679668.3168 16400.0 0.09 -0.0904 -0.3895 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D13 mock treatment 529878.7879 18400.0 0.08 697502.6455 34300.0 0.18 0.1884 0.9396 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D14 mock treatment 368884.8921 -143000.0 -0.66 646021.5054 -17200.0 -0.09 -0.5296 -0.7976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D15 mock treatment 276638.756 -235000.0 -1.08 800117.0213 137000.0 0.73 -0.2525 -0.1937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D16 mock treatment 301537.7358 -210000.0 -0.97 707114.8325 43900.0 0.23 -0.5201 -0.5223 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D17 mock treatment 272935.3234 -239000.0 -1.1 681929.5775 18700.0 0.1 -0.7079 -0.6408 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D18 mock treatment 259100.8403 -252000.0 -1.16 705927.0386 42700.0 0.23 -0.663 -0.5591 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D19 mock treatment 349722.0844 -162000.0 -0.75 725683.4171 62500.0 0.33 -0.2934 -0.3594 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D20 mock treatment 309823.1132 -202000.0 -0.93 650921.0526 -12300.0 -0.07 -0.7039 -0.7549 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D21 mock treatment 283300.5464 -228000.0 -1.05 671151.0417 7920.0 0.04 -0.7145 -0.6783 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D22 mock treatment 465417.2185 -46100.0 -0.21 694909.0909 31700.0 0.17 -0.0315 -0.1163 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D23 mock treatment 600651.6393 89100.0 0.41 703925.1101 40700.0 0.22 0.4433 0.9548 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 D24 mock treatment 607513.1579 96000.0 0.44 596555.5556 -66700.0 -0.35 0.063 0.1111 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E01 compound treatment 391440.7895 -120000.0 -0.55 502760.5634 -160000.0 -0.85 -0.9934 -0.9783 Starr1.2_000749 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E02 compound treatment 813778.3019 302000.0 1.39 897409.9099 234000.0 1.24 1.8639 0.9983 Starr1.2_000750 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E03 compound treatment 405733.5766 -106000.0 -0.49 722125.0 58900.0 0.31 -0.1241 -0.2142 Starr1.2_000751 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E04 compound treatment 103572.2543 -408000.0 -1.88 400188.4058 -263000.0 -1.4 -2.3168 -0.9892 Starr1.2_000752 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E05 compound treatment 663045.8716 152000.0 0.7 862356.8465 199000.0 1.06 1.2409 0.9799 Starr1.2_000753 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E06 compound treatment 393039.1198 -118000.0 -0.55 629109.2437 -34100.0 -0.18 -0.5143 -0.8936 Starr1.2_000754 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E07 compound treatment 422466.6667 -89100.0 -0.41 879825.4717 217000.0 1.15 0.522 0.4278 Starr1.2_000755 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E08 compound treatment 135601.5625 -376000.0 -1.73 437855.8559 -225000.0 -1.2 -2.0711 -0.9835 Starr1.2_000756 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E09 compound treatment 161277.4194 -350000.0 -1.62 487714.2857 -176000.0 -0.93 -1.8004 -0.9657 Starr1.2_000757 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E10 compound treatment 298271.8894 -213000.0 -0.98 671257.1429 8030.0 0.04 -0.6653 -0.6759 Starr1.2_000758 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E11 compound treatment 363462.5 -148000.0 -0.68 589286.9955 -73900.0 -0.39 -0.7601 -0.9654 Starr1.2_000759 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E12 compound treatment 28095.2381 -483000.0 -2.23 68509.0909 -595000.0 -3.15 -3.8069 -0.9856 Starr1.2_000760 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E13 compound treatment 486935.31 -24600.0 -0.11 874647.619 211000.0 1.12 0.7128 0.6324 Starr1.2_000761 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E14 compound treatment 317131.6964 -194000.0 -0.9 629244.3439 -34000.0 -0.18 -0.7613 -0.8326 Starr1.2_000762 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E15 compound treatment 431240.099 -80300.0 -0.37 745364.532 82100.0 0.44 0.0463 0.0809 Starr1.2_000763 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E16 compound treatment 437893.2292 -73600.0 -0.34 721351.2195 58100.0 0.31 -0.0221 -0.0482 Starr1.2_000764 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E17 compound treatment 14593.361 -497000.0 -2.29 77608.6956 -586000.0 -3.11 -3.8168 -0.9888 Starr1.2_000765 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E18 compound treatment 133110.0917 -378000.0 -1.75 586051.2821 -77200.0 -0.41 -1.5234 -0.8499 Starr1.2_000766 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E19 compound treatment 199170.0224 -312000.0 -1.44 718436.1702 55200.0 0.29 -0.8115 -0.5521 Starr1.2_000767 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E20 compound treatment 334416.6667 -177000.0 -0.82 713219.1011 50000.0 0.27 -0.39 -0.4542 Starr1.2_000768 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E21 compound treatment 416017.3267 -95500.0 -0.44 809234.3096 146000.0 0.77 0.2362 0.2651 Starr1.2_000769 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E22 compound treatment 552290.5028 40800.0 0.19 735063.2911 71800.0 0.38 0.4024 0.947 Starr1.2_000770 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E23 mock treatment 600736.8421 89200.0 0.41 661451.1628 -1780.0 -0.01 0.2843 0.6907 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 E24 mock treatment 684110.5528 173000.0 0.8 656171.875 -7060.0 -0.04 0.5363 0.6731 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F01 mock treatment 715509.5238 204000.0 0.94 701650.2463 38400.0 0.2 0.8093 0.8408 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F02 mock treatment 664909.0909 153000.0 0.71 915207.3733 252000.0 1.34 1.4452 0.9558 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F03 mock treatment 343562.982 -168000.0 -0.77 692073.8636 28800.0 0.15 -0.4395 -0.5567 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F04 mock treatment 378824.4444 -133000.0 -0.61 683513.9665 20300.0 0.11 -0.3566 -0.574 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F05 mock treatment 686013.7457 174000.0 0.8 590492.6108 -72700.0 -0.39 0.2962 0.3319 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F06 mock treatment 390736.1111 -121000.0 -0.56 726459.3301 63200.0 0.34 -0.1567 -0.241 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F07 mock treatment 593643.1095 82100.0 0.38 740044.7761 76800.0 0.41 0.5559 0.9993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F08 mock treatment 532643.3333 21100.0 0.1 920296.4824 257000.0 1.36 1.033 0.7557 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F09 mock treatment 388758.7822 -123000.0 -0.57 680468.4211 17200.0 0.09 -0.3356 -0.5853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F10 mock treatment 366204.4199 -145000.0 -0.67 721633.6634 58400.0 0.31 -0.2548 -0.3451 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F11 mock treatment 208277.2727 -303000.0 -1.4 775578.3133 112000.0 0.6 -0.5675 -0.3733 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F12 mock treatment 301313.3641 -210000.0 -0.97 661324.7423 -1900.0 -0.01 -0.6926 -0.7144 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F13 mock treatment 579197.2222 67700.0 0.31 668152.0 4920.0 0.03 0.2392 0.7636 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F14 mock treatment 301161.4458 -210000.0 -0.97 696152.4664 32900.0 0.17 -0.5625 -0.5706 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F15 mock treatment 465352.4096 -46200.0 -0.21 808527.6382 145000.0 0.77 0.3944 0.4933 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F16 mock treatment 292461.5385 -219000.0 -1.01 764787.7095 102000.0 0.54 -0.3334 -0.2912 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F17 mock treatment 252785.872 -259000.0 -1.19 643021.8579 -20200.0 -0.11 -0.9195 -0.7675 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F18 mock treatment 370651.9722 -141000.0 -0.65 733539.6825 70300.0 0.37 -0.1957 -0.2612 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F19 mock treatment 252468.8222 -259000.0 -1.19 626568.1818 -36700.0 -0.19 -0.9822 -0.8115 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F20 mock treatment 298663.4845 -213000.0 -0.98 719936.2745 56700.0 0.3 -0.4814 -0.4689 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F21 mock treatment 526928.5714 15400.0 0.07 820662.2807 157000.0 0.84 0.6407 0.7645 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F22 mock treatment 436295.2646 -75200.0 -0.35 746607.1429 83400.0 0.44 0.0674 0.1199 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F23 mock treatment 714990.991 203000.0 0.94 664955.8824 1730.0 0.01 0.67 0.714 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 F24 mock treatment 665470.8995 154000.0 0.71 672669.8565 9440.0 0.05 0.5374 0.7551 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G01 compound treatment 676547.8261 165000.0 0.76 748542.735 85300.0 0.45 0.8581 0.9692 Starr1.2_000771 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G02 compound treatment 358401.7857 -153000.0 -0.71 366556.6038 -297000.0 -1.57 -1.612 -0.9346 Starr1.2_000772 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G03 compound treatment 559198.1132 47700.0 0.22 760404.7619 97200.0 0.52 0.5199 0.9279 Starr1.2_000773 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G04 compound treatment 199401.6064 -312000.0 -1.44 521353.4483 -142000.0 -0.75 -1.5499 -0.9542 Starr1.2_000774 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G05 compound treatment 395670.3911 -116000.0 -0.53 593597.7654 -69600.0 -0.37 -0.6389 -0.9837 Starr1.2_000775 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G06 compound treatment 199004.329 -313000.0 -1.44 544236.5591 -119000.0 -0.63 -1.4654 -0.9314 Starr1.2_000776 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G07 compound treatment 480586.8852 -30900.0 -0.14 665365.8537 2140.0 0.01 -0.0928 -0.6489 Starr1.2_000777 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G08 compound treatment 317988.0 -194000.0 -0.89 432735.8491 -230000.0 -1.22 -1.4955 -0.988 Starr1.2_000778 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G09 compound treatment 229064.8379 -282000.0 -1.3 487904.0404 -175000.0 -0.93 -1.5786 -0.9864 Starr1.2_000779 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G10 compound treatment 275793.7853 -236000.0 -1.09 630157.2327 -33100.0 -0.18 -0.8927 -0.8107 Starr1.2_000780 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G11 compound treatment 492295.5326 -19200.0 -0.09 624653.4091 -38600.0 -0.2 -0.2074 -0.9299 Starr1.2_000781 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G12 compound treatment 289025.0569 -222000.0 -1.03 521255.5556 -142000.0 -0.75 -1.258 -0.9884 Starr1.2_000782 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G13 compound treatment 149865.9004 -362000.0 -1.67 439593.0233 -224000.0 -1.19 -2.0181 -0.9861 Starr1.2_000783 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G14 compound treatment 325683.6735 -186000.0 -0.86 515457.8755 -148000.0 -0.78 -1.1602 -0.999 Starr1.2_000784 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G15 compound treatment 285971.3604 -226000.0 -1.04 585426.4151 -77800.0 -0.41 -1.0273 -0.918 Starr1.2_000785 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G16 compound treatment 245933.6384 -266000.0 -1.22 593144.5783 -70100.0 -0.37 -1.1289 -0.882 Starr1.2_000786 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G17 compound treatment 361000.0 -151000.0 -0.69 550909.0909 -112000.0 -0.6 -0.9121 -0.9971 Starr1.2_000787 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G18 compound treatment 328544.1989 -183000.0 -0.84 558432.0 -105000.0 -0.56 -0.9897 -0.9795 Starr1.2_000788 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G19 compound treatment 320600.8316 -191000.0 -0.88 575277.9783 -88000.0 -0.47 -0.9524 -0.9559 Starr1.2_000789 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G20 compound treatment 77757.732 -434000.0 -2.0 419821.0526 -243000.0 -1.29 -2.3274 -0.9776 Starr1.2_000790 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G21 compound treatment 271821.7593 -240000.0 -1.11 575976.6537 -87300.0 -0.46 -1.1089 -0.9253 Starr1.2_000791 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G22 compound treatment 418878.9625 -92600.0 -0.43 570995.4751 -92200.0 -0.49 -0.648 -0.9977 Starr1.2_000792 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G23 mock treatment 546155.914 34600.0 0.16 576905.5556 -86300.0 -0.46 -0.2108 -0.4347 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 G24 mock treatment 570490.6542 59000.0 0.27 552991.5254 -110000.0 -0.58 -0.2211 -0.3429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H01 mock treatment 827247.6636 316000.0 1.46 647057.1429 -16200.0 -0.09 0.9689 0.6643 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H02 mock treatment 598517.9487 87000.0 0.4 670175.2577 6950.0 0.04 0.3098 0.7688 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H03 mock treatment 448261.1465 -63300.0 -0.29 658000.0 -5230.0 -0.03 -0.2259 -0.7709 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H04 mock treatment 354187.5 -157000.0 -0.73 761120.3704 97900.0 0.52 -0.1459 -0.1635 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H05 mock treatment 363182.3204 -148000.0 -0.68 695243.7811 32000.0 0.17 -0.3636 -0.5159 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H06 mock treatment 218168.9498 -293000.0 -1.35 593099.5025 -70100.0 -0.37 -1.2196 -0.8693 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H07 mock treatment 570928.8256 59400.0 0.27 634275.6757 -29000.0 -0.15 0.0851 0.2711 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H08 mock treatment 383336.2069 -128000.0 -0.59 587418.6047 -75800.0 -0.4 -0.7023 -0.9824 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H09 mock treatment 255152.2727 -256000.0 -1.18 695718.75 32500.0 0.17 -0.7141 -0.5977 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H10 mock treatment 237619.1489 -274000.0 -1.26 637628.2723 -25600.0 -0.14 -0.9892 -0.7786 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H11 mock treatment 453755.1724 -57800.0 -0.27 683643.5644 20400.0 0.11 -0.1118 -0.3888 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H12 mock treatment 298920.5128 -213000.0 -0.98 580426.3158 -82800.0 -0.44 -1.0038 -0.9344 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H13 mock treatment 496621.7105 -14900.0 -0.07 557777.1084 -105000.0 -0.56 -0.4441 -0.788 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H14 mock treatment 489560.7477 -22000.0 -0.1 592019.1388 -71200.0 -0.38 -0.3387 -0.8661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H15 mock treatment 446864.0777 -64700.0 -0.3 604805.7143 -58400.0 -0.31 -0.4299 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H16 mock treatment 399252.3364 -112000.0 -0.52 604577.7778 -58700.0 -0.31 -0.5861 -0.9703 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H17 mock treatment 365852.7778 -146000.0 -0.67 696895.1613 33700.0 0.18 -0.3487 -0.5017 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H18 mock treatment 604877.9528 93400.0 0.43 678607.1429 15400.0 0.08 0.3621 0.8264 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H19 mock treatment 255275.1196 -256000.0 -1.18 633183.0986 -30000.0 -0.16 -0.9483 -0.7953 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H20 mock treatment 249070.1357 -262000.0 -1.21 565738.7755 -97500.0 -0.52 -1.2215 -0.9281 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H21 mock treatment 312172.3356 -199000.0 -0.92 564460.9053 -98800.0 -0.52 -1.0205 -0.9644 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H22 mock treatment 275727.7108 -236000.0 -1.09 554669.9507 -109000.0 -0.58 -1.176 -0.9558 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H23 mock treatment 537144.1048 25600.0 0.12 550027.027 -113000.0 -0.6 -0.341 -0.5572 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 H24 mock treatment 544124.4444 32600.0 0.15 570825.8929 -92400.0 -0.49 -0.2402 -0.4686 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I01 compound treatment 575807.6923 64300.0 0.3 652862.069 -10400.0 -0.05 0.1708 0.5663 Starr1.2_000793 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I02 compound treatment 890128.4404 379000.0 1.75 855687.2247 192000.0 1.02 1.9564 0.9673 Starr1.2_000794 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I03 compound treatment 605462.069 93900.0 0.43 828890.0 166000.0 0.88 0.9277 0.9469 Starr1.2_000795 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I04 compound treatment 296471.8499 -215000.0 -0.99 548427.7457 -115000.0 -0.61 -1.1318 -0.9726 Starr1.2_000796 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I05 compound treatment 306532.8947 -205000.0 -0.95 782300.3802 119000.0 0.63 -0.2219 -0.1952 Starr1.2_000797 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I06 compound treatment 594803.6254 83300.0 0.38 1032337.963 369000.0 1.96 1.6559 0.83 Starr1.2_000798 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I07 compound treatment 11842.4242 -500000.0 -2.3 70568.9655 -593000.0 -3.14 -3.8522 -0.9883 Starr1.2_000799 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I08 compound treatment 118641.9437 -393000.0 -1.81 398586.2069 -265000.0 -1.4 -2.2737 -0.992 Starr1.2_000800 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I09 compound treatment 367082.3529 -144000.0 -0.67 595524.5098 -67700.0 -0.36 -0.7249 -0.958 Starr1.2_000801 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I10 compound treatment 485208.4507 -26300.0 -0.12 720882.3529 57700.0 0.31 0.1304 0.3965 Starr1.2_000802 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I11 compound treatment 177352.7697 -334000.0 -1.54 583965.812 -79300.0 -0.42 -1.387 -0.8683 Starr1.2_000803 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I12 compound treatment 490322.7666 -21200.0 -0.1 672136.7925 8910.0 0.05 -0.0357 -0.3289 Starr1.2_000804 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I13 compound treatment 387244.2922 -124000.0 -0.57 639591.5493 -23600.0 -0.13 -0.4939 -0.8419 Starr1.2_000805 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I14 compound treatment 141029.6053 -370000.0 -1.71 503536.0825 -160000.0 -0.85 -1.8071 -0.9476 Starr1.2_000806 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I15 compound treatment 21784.8837 -490000.0 -2.26 76055.5556 -587000.0 -3.11 -3.7992 -0.9875 Starr1.2_000807 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I16 compound treatment 352308.0082 -159000.0 -0.73 585593.361 -77600.0 -0.41 -0.8103 -0.9626 Starr1.2_000808 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I17 compound treatment 231723.3333 -280000.0 -1.29 605620.3209 -57600.0 -0.31 -1.1284 -0.851 Starr1.2_000809 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I18 compound treatment 275036.8764 -236000.0 -1.09 735542.4354 72300.0 0.38 -0.4999 -0.4325 Starr1.2_000810 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I19 compound treatment 282599.5575 -229000.0 -1.06 730387.5598 67200.0 0.36 -0.4946 -0.4439 Starr1.2_000811 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I20 compound treatment 374718.4265 -137000.0 -0.63 700276.2646 37000.0 0.2 -0.3071 -0.4648 Starr1.2_000812 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I21 compound treatment 346449.4382 -165000.0 -0.76 673260.4651 10000.0 0.05 -0.5006 -0.6561 Starr1.2_000813 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I22 compound treatment 386026.699 -125000.0 -0.58 769114.6789 106000.0 0.56 -0.0121 -0.015 Starr1.2_000814 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I23 mock treatment 646287.1795 135000.0 0.62 650059.7015 -13200.0 -0.07 0.3901 0.6237 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 I24 mock treatment 564071.09 52600.0 0.24 642067.0103 -21200.0 -0.11 0.092 0.3445 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J01 mock treatment 756442.7861 245000.0 1.13 644617.801 -18600.0 -0.1 0.7289 0.6429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J02 mock treatment 837324.6753 326000.0 1.5 790938.8889 128000.0 0.68 1.5414 0.9352 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J03 mock treatment 494795.1807 -16700.0 -0.08 655939.5349 -7290.0 -0.04 -0.0819 -0.949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J04 mock treatment 304119.2053 -207000.0 -0.96 677783.9196 14600.0 0.08 -0.6217 -0.6479 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J05 mock treatment 469005.7803 -42500.0 -0.2 783714.2857 120000.0 0.64 0.3133 0.4686 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J06 mock treatment 495558.2822 -16000.0 -0.07 692624.4726 29400.0 0.16 0.0582 0.3376 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J07 mock treatment 502913.9073 -8600.0 -0.04 678593.75 15400.0 0.08 0.0296 0.3262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J08 mock treatment 435884.6154 -75600.0 -0.35 615169.2308 -48100.0 -0.25 -0.4269 -0.9881 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J09 mock treatment 496090.1163 -15400.0 -0.07 591417.1123 -71800.0 -0.38 -0.3196 -0.8249 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J10 mock treatment 608475.6944 97000.0 0.45 577497.3545 -85700.0 -0.45 -0.0054 -0.0084 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J11 mock treatment 241951.7544 -270000.0 -1.24 707974.7899 44700.0 0.24 -0.7112 -0.562 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J12 mock treatment 352059.2593 -159000.0 -0.74 543652.968 -120000.0 -0.63 -0.9684 -0.9973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J13 mock treatment 313981.7352 -198000.0 -0.91 701370.6564 38100.0 0.2 -0.5011 -0.537 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J14 mock treatment 493533.9233 -18000.0 -0.08 561271.8447 -102000.0 -0.54 -0.441 -0.8061 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J15 mock treatment 268637.5546 -243000.0 -1.12 604899.2806 -58300.0 -0.31 -1.0108 -0.8698 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J16 mock treatment 247692.3077 -264000.0 -1.22 555204.0816 -108000.0 -0.57 -1.2655 -0.941 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J17 mock treatment 323455.6962 -188000.0 -0.87 501946.4883 -161000.0 -0.86 -1.2181 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J18 mock treatment 264157.8947 -247000.0 -1.14 539767.5439 -123000.0 -0.65 -1.2697 -0.9653 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J19 mock treatment 253051.1111 -258000.0 -1.19 598981.8182 -64200.0 -0.34 -1.0838 -0.8742 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J20 mock treatment 253638.4778 -258000.0 -1.19 561763.0522 -101000.0 -0.54 -1.2215 -0.9357 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J21 mock treatment 345073.3696 -166000.0 -0.77 540811.4035 -122000.0 -0.65 -1.0019 -0.9965 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J22 mock treatment 313669.9029 -198000.0 -0.91 537813.3333 -125000.0 -0.67 -1.1155 -0.9879 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J23 mock treatment 525100.4016 13600.0 0.06 562977.6119 -100000.0 -0.53 -0.3317 -0.6195 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 J24 mock treatment 545294.3925 33800.0 0.16 543722.5131 -120000.0 -0.63 -0.3381 -0.5179 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K01 compound treatment 647013.6364 135000.0 0.62 702752.3364 39500.0 0.21 0.5901 0.8953 Starr1.2_000815 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K02 compound treatment 652238.0952 141000.0 0.65 707468.3544 44200.0 0.23 0.6248 0.9054 Starr1.2_000816 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K03 compound treatment 411773.7557 -99700.0 -0.46 732019.9203 68800.0 0.36 -0.0673 -0.1146 Starr1.2_000817 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K04 compound treatment 546226.9663 34700.0 0.16 893549.8008 230000.0 1.22 0.977 0.793 Starr1.2_000818 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K05 compound treatment 195724.5509 -316000.0 -1.46 332844.6602 -330000.0 -1.75 -2.2689 -0.9958 Starr1.2_000819 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K06 compound treatment 308578.0 -203000.0 -0.94 744348.0 81100.0 0.43 -0.3575 -0.3471 Starr1.2_000820 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K07 compound treatment 313366.3102 -198000.0 -0.91 525512.8205 -138000.0 -0.73 -1.1627 -0.9938 Starr1.2_000821 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K08 compound treatment 363934.1826 -148000.0 -0.68 710860.6557 47600.0 0.25 -0.3026 -0.4168 Starr1.2_000822 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K09 compound treatment 524448.2759 12900.0 0.06 741642.8571 78400.0 0.42 0.3363 0.8003 Starr1.2_000823 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K10 compound treatment 346976.8908 -165000.0 -0.76 677912.5475 14700.0 0.08 -0.4815 -0.6312 Starr1.2_000824 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K11 compound treatment 416781.1816 -94700.0 -0.44 701783.8983 38600.0 0.2 -0.1643 -0.3407 Starr1.2_000825 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K12 compound treatment 322328.841 -189000.0 -0.87 786066.3265 123000.0 0.65 -0.1562 -0.1435 Starr1.2_000826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K13 compound treatment 429805.8824 -81700.0 -0.38 645510.4167 -17700.0 -0.09 -0.3329 -0.8572 Starr1.2_000827 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K14 compound treatment 259301.5873 -252000.0 -1.16 505096.3303 -158000.0 -0.84 -1.4155 -0.9871 Starr1.2_000828 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K15 compound treatment 353491.1894 -158000.0 -0.73 578847.352 -84400.0 -0.45 -0.8318 -0.9726 Starr1.2_000829 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K16 compound treatment 374332.696 -137000.0 -0.63 678816.129 15600.0 0.08 -0.3889 -0.6095 Starr1.2_000830 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K17 compound treatment 33237.2881 -478000.0 -2.21 151548.3871 -512000.0 -2.71 -3.4787 -0.9947 Starr1.2_000831 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K18 compound treatment 50211.3821 -461000.0 -2.13 167259.2593 -496000.0 -2.63 -3.3644 -0.9945 Starr1.2_000832 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K19 compound treatment 408129.4363 -103000.0 -0.48 614457.7465 -48800.0 -0.26 -0.5201 -0.9587 Starr1.2_000833 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K20 compound treatment 387615.3846 -124000.0 -0.57 554700.3891 -109000.0 -0.58 -0.8111 -1.0 Starr1.2_000834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K21 compound treatment 258733.6152 -253000.0 -1.17 459914.2857 -203000.0 -1.08 -1.5868 -0.9992 Starr1.2_000835 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K22 compound treatment 476265.8228 -35300.0 -0.16 588689.1892 -74500.0 -0.4 -0.3945 -0.9229 Starr1.2_000836 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K23 mock treatment 636758.7549 125000.0 0.58 680344.4976 17100.0 0.09 0.4726 0.8083 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 K24 mock treatment 660542.8571 149000.0 0.69 597495.4955 -65700.0 -0.35 0.2394 0.3107 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L01 mock treatment 924491.3793 413000.0 1.9 790139.0135 127000.0 0.67 1.8227 0.9023 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L02 mock treatment 769289.8551 258000.0 1.19 831467.3367 168000.0 0.89 1.4716 0.99 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L03 mock treatment 373440.5405 -138000.0 -0.64 913635.468 250000.0 1.33 0.4889 0.3319 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L04 mock treatment 690084.6395 179000.0 0.82 800175.8794 137000.0 0.73 1.0959 0.998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L05 mock treatment 661463.9175 150000.0 0.69 786305.3097 123000.0 0.65 0.9506 0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L06 mock treatment 513996.7638 2480.0 0.01 846272.3005 183000.0 0.97 0.6946 0.7154 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L07 mock treatment 590973.607 79500.0 0.37 815917.0732 153000.0 0.81 0.8318 0.9357 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L08 mock treatment 619639.1753 108000.0 0.5 724037.037 60800.0 0.32 0.5806 0.9778 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L09 mock treatment 550003.1546 38500.0 0.18 677355.9322 14100.0 0.07 0.1785 0.9265 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L10 mock treatment 381678.733 -130000.0 -0.6 746165.9574 82900.0 0.44 -0.1123 -0.1512 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L11 mock treatment 320947.0199 -191000.0 -0.88 740578.4314 77300.0 0.41 -0.3313 -0.3416 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L12 mock treatment 520976.8977 9460.0 0.04 738056.7686 74800.0 0.4 0.3115 0.7801 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L13 mock treatment 339018.0587 -172000.0 -0.8 677437.0629 14200.0 0.08 -0.5092 -0.6373 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L14 mock treatment 327759.5908 -184000.0 -0.85 726050.9259 62800.0 0.33 -0.3636 -0.3993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L15 mock treatment 312616.8675 -199000.0 -0.92 668479.3388 5250.0 0.03 -0.6289 -0.6853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L16 mock treatment 380759.8945 -131000.0 -0.6 718714.2857 55500.0 0.29 -0.2183 -0.3253 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L17 mock treatment 341282.4074 -170000.0 -0.79 608991.5254 -54200.0 -0.29 -0.7585 -0.9072 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L18 mock treatment 477869.3182 -33600.0 -0.16 636652.5424 -26600.0 -0.14 -0.2094 -0.9989 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L19 mock treatment 511170.0288 -347.0 0.0 633900.4739 -29300.0 -0.16 -0.1111 -0.7143 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L20 mock treatment 272239.5349 -239000.0 -1.1 597022.2222 -66200.0 -0.35 -1.0286 -0.8882 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L21 mock treatment 329273.399 -182000.0 -0.84 578290.3226 -84900.0 -0.45 -0.9128 -0.9573 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L22 mock treatment 465833.3333 -45700.0 -0.21 559187.5 -104000.0 -0.55 -0.5392 -0.9128 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L23 mock treatment 565616.5414 54100.0 0.25 592857.1429 -70400.0 -0.37 -0.0875 -0.1949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 L24 mock treatment 560821.0117 49300.0 0.23 578761.7188 -84500.0 -0.45 -0.156 -0.3105 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M01 compound treatment 684860.7595 173000.0 0.8 656058.8235 -7170.0 -0.04 0.5384 0.6727 Starr1.2_000837 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M02 compound treatment 706578.1818 195000.0 0.9 736151.5152 72900.0 0.39 0.9096 0.9289 Starr1.2_000838 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M03 compound treatment 535213.6986 23700.0 0.11 831851.5284 169000.0 0.89 0.7097 0.7876 Starr1.2_000839 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M04 compound treatment 515223.9264 3710.0 0.02 855281.8182 192000.0 1.02 0.7324 0.7189 Starr1.2_000840 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M05 compound treatment 404328.1938 -107000.0 -0.49 736439.3305 73200.0 0.39 -0.075 -0.1193 Starr1.2_000841 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M06 compound treatment 502715.1703 -8800.0 -0.04 684368.6275 21100.0 0.11 0.0506 0.4242 Starr1.2_000842 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M07 compound treatment 325456.8528 -186000.0 -0.86 499790.0 -163000.0 -0.87 -1.2197 -1.0 Starr1.2_000843 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M08 compound treatment 449711.9342 -61800.0 -0.29 762983.2776 99800.0 0.53 0.1726 0.2872 Starr1.2_000844 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M09 compound treatment 303925.4032 -208000.0 -0.96 793342.9752 130000.0 0.69 -0.1889 -0.1601 Starr1.2_000845 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M10 compound treatment 407728.3951 -104000.0 -0.48 660918.5668 -2310.0 -0.01 -0.3471 -0.725 Starr1.2_000846 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M11 compound treatment 430711.4914 -80800.0 -0.37 673187.7551 9960.0 0.05 -0.2262 -0.6009 Starr1.2_000847 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M12 compound treatment 292553.1496 -219000.0 -1.01 532374.1935 -131000.0 -0.69 -1.2048 -0.9833 Starr1.2_000848 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M13 compound treatment 7559.4855 -504000.0 -2.32 49982.1429 -613000.0 -3.25 -3.9433 -0.9864 Starr1.2_000849 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M14 compound treatment 14110.6195 -497000.0 -2.29 77734.6939 -585000.0 -3.11 -3.8179 -0.9889 Starr1.2_000850 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M15 compound treatment 412484.5679 -99000.0 -0.46 596303.0303 -66900.0 -0.35 -0.5739 -0.9922 Starr1.2_000851 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M16 compound treatment 188822.8571 -323000.0 -1.49 340413.7931 -323000.0 -1.71 -2.263 -0.9976 Starr1.2_000852 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M17 compound treatment 294616.8831 -217000.0 -1.0 483250.9091 -180000.0 -0.95 -1.3823 -0.9997 Starr1.2_000853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M18 compound treatment 305814.8148 -206000.0 -0.95 634137.8092 -29100.0 -0.15 -0.7799 -0.8115 Starr1.2_000854 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M19 compound treatment 363701.7544 -148000.0 -0.68 578260.4502 -85000.0 -0.45 -0.8007 -0.9798 Starr1.2_000855 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M20 compound treatment 371854.7009 -140000.0 -0.64 822144.5313 159000.0 0.84 0.1406 0.1325 Starr1.2_000856 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M21 compound treatment 194832.3171 -317000.0 -1.46 465638.8889 -198000.0 -1.05 -1.7737 -0.9868 Starr1.2_000857 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M22 compound treatment 592384.6154 80900.0 0.37 715316.8317 52100.0 0.28 0.4591 0.9891 Starr1.2_000858 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M23 mock treatment 583341.1215 71800.0 0.33 634316.8724 -28900.0 -0.15 0.1258 0.3446 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 M24 mock treatment 566197.3684 54700.0 0.25 547988.6364 -115000.0 -0.61 -0.2539 -0.384 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N01 mock treatment 871678.5714 360000.0 1.66 793395.2381 130000.0 0.69 1.6626 0.9244 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N02 mock treatment 870899.5215 359000.0 1.66 738167.4641 74900.0 0.4 1.453 0.8525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N03 mock treatment 839712.5984 328000.0 1.51 827112.1951 164000.0 0.87 1.6849 0.9653 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N04 mock treatment 853107.4074 342000.0 1.58 818787.1287 156000.0 0.83 1.6973 0.9545 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N05 mock treatment 634360.0 123000.0 0.57 920298.3193 257000.0 1.36 1.3647 0.9243 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N06 mock treatment 440603.352 -70900.0 -0.33 695625.0 32400.0 0.17 -0.1097 -0.2971 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N07 mock treatment 661794.1176 150000.0 0.69 652331.7073 -10900.0 -0.06 0.4492 0.6459 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N08 mock treatment 449014.7059 -62500.0 -0.29 696593.8865 33400.0 0.18 -0.0787 -0.2326 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N09 mock treatment 440272.4868 -71200.0 -0.33 735103.0043 71900.0 0.38 0.0372 0.074 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N10 mock treatment 431585.4342 -79900.0 -0.37 634788.7324 -28400.0 -0.15 -0.3673 -0.9222 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N11 mock treatment 558472.8435 47000.0 0.22 669014.652 5790.0 0.03 0.1748 0.7993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N12 mock treatment 397461.1529 -114000.0 -0.53 651398.2684 -11800.0 -0.06 -0.4163 -0.7859 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N13 mock treatment 395246.2312 -116000.0 -0.54 585339.7683 -77900.0 -0.41 -0.6713 -0.9917 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N14 mock treatment 396312.3288 -115000.0 -0.53 605622.0096 -57600.0 -0.31 -0.5917 -0.9655 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N15 mock treatment 333505.7737 -178000.0 -0.82 598027.2109 -65200.0 -0.35 -0.825 -0.9262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N16 mock treatment 470350.0 -41200.0 -0.19 621233.871 -42000.0 -0.22 -0.2917 -0.9968 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N17 mock treatment 364880.2228 -147000.0 -0.68 582375.5274 -80900.0 -0.43 -0.7814 -0.9758 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N18 mock treatment 344773.743 -167000.0 -0.77 586241.6667 -77000.0 -0.41 -0.8325 -0.9561 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N19 mock treatment 466060.4982 -45500.0 -0.21 586038.961 -77200.0 -0.41 -0.4377 -0.9517 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N20 mock treatment 523734.6939 12200.0 0.06 620259.6899 -43000.0 -0.23 -0.1213 -0.5167 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N21 mock treatment 451477.6119 -60000.0 -0.28 640947.1154 -22300.0 -0.12 -0.2794 -0.9279 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N22 mock treatment 595963.8554 84400.0 0.39 589250.0 -74000.0 -0.39 -0.0021 -0.0038 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N23 mock treatment 563545.098 52000.0 0.24 523444.8819 -140000.0 -0.74 -0.3546 -0.455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 N24 mock treatment 523237.7049 11700.0 0.05 573951.8072 -89300.0 -0.47 -0.2966 -0.6224 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O01 compound treatment 620312.0 109000.0 0.5 593105.9322 -70100.0 -0.37 0.0918 0.1469 Starr1.2_000859 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O02 compound treatment 49089.2857 -462000.0 -2.13 62339.6226 -601000.0 -3.19 -3.7616 -0.9809 Starr1.2_000860 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O03 compound treatment 642396.6942 131000.0 0.6 607692.0 -55500.0 -0.29 0.2185 0.3253 Starr1.2_000861 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O04 compound treatment 672305.2632 161000.0 0.74 734053.0303 70800.0 0.38 0.7899 0.9503 Starr1.2_000862 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O05 compound treatment 532500.0 21000.0 0.1 468386.5546 -195000.0 -1.03 -0.6623 -0.6381 Starr1.2_000863 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O06 compound treatment 735556.8182 224000.0 1.03 698918.4549 35700.0 0.19 0.8644 0.823 Starr1.2_000864 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O07 compound treatment 651984.6154 140000.0 0.65 674003.8911 10800.0 0.06 0.4985 0.7665 Starr1.2_000865 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O08 compound treatment 683562.963 172000.0 0.79 695748.0315 32500.0 0.17 0.683 0.8412 Starr1.2_000866 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O09 compound treatment 524269.4611 12800.0 0.06 520000.0 -143000.0 -0.76 -0.4956 -0.6504 Starr1.2_000867 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O10 compound treatment 672323.5294 161000.0 0.74 613270.2703 -50000.0 -0.26 0.337 0.4279 Starr1.2_000868 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O11 compound treatment 301287.5 -210000.0 -0.97 323308.642 -340000.0 -1.8 -1.9604 -0.9577 Starr1.2_000869 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O12 compound treatment 638197.7612 127000.0 0.58 586050.0 -77200.0 -0.41 0.1236 0.1733 Starr1.2_000870 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O13 compound treatment 596300.8475 84800.0 0.39 612952.381 -50300.0 -0.27 0.0879 0.1858 Starr1.2_000871 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O14 compound treatment 472950.3546 -38600.0 -0.18 528393.7008 -135000.0 -0.72 -0.6315 -0.8569 Starr1.2_000872 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O15 compound treatment 78725.4902 -433000.0 -2.0 82780.0 -580000.0 -3.08 -3.5883 -0.978 Starr1.2_000873 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O16 compound treatment 129307.6923 -382000.0 -1.76 128830.7692 -534000.0 -2.83 -3.2506 -0.9739 Starr1.2_000874 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O17 compound treatment 298054.5455 -213000.0 -0.98 306989.6907 -356000.0 -1.89 -2.0322 -0.9538 Starr1.2_000875 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O18 compound treatment 543750.8651 32200.0 0.15 555678.8079 -108000.0 -0.57 -0.2983 -0.5059 Starr1.2_000876 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O19 compound treatment 503278.1955 -8240.0 -0.04 614006.8729 -49200.0 -0.26 -0.2115 -0.8016 Starr1.2_000877 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O20 compound treatment 160321.8391 -351000.0 -1.62 188797.7528 -474000.0 -2.52 -2.9246 -0.9773 Starr1.2_000878 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O21 compound treatment 589254.7529 77700.0 0.36 682470.5882 19200.0 0.1 0.3257 0.8737 Starr1.2_000879 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O22 compound treatment 645859.2058 134000.0 0.62 711086.5052 47900.0 0.25 0.6176 0.9224 Starr1.2_000880 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O23 mock treatment 571648.4375 60100.0 0.28 533637.0968 -130000.0 -0.69 -0.2899 -0.3912 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 O24 mock treatment 542478.7645 31000.0 0.14 534729.8387 -128000.0 -0.68 -0.381 -0.5471 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P01 mock treatment 616544.0415 105000.0 0.48 553033.3333 -110000.0 -0.58 -0.0708 -0.0933 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P02 mock treatment 668226.8519 157000.0 0.72 666764.7059 3540.0 0.02 0.5243 0.7252 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P03 mock treatment 689781.1159 178000.0 0.82 676612.1495 13400.0 0.07 0.6315 0.7653 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P04 mock treatment 609154.5455 97600.0 0.45 634232.8767 -29000.0 -0.15 0.2096 0.4406 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P05 mock treatment 653160.6426 142000.0 0.65 674781.5534 11600.0 0.06 0.5052 0.7701 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P06 mock treatment 624722.7273 113000.0 0.52 609799.0196 -53400.0 -0.28 0.1688 0.2841 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P07 mock treatment 586469.697 75000.0 0.35 590533.3333 -72700.0 -0.39 -0.0282 -0.0545 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P08 mock treatment 592539.4737 81000.0 0.37 624206.422 -39000.0 -0.21 0.1179 0.2759 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P09 mock treatment 603307.0175 91800.0 0.42 548084.1584 -115000.0 -0.61 -0.1325 -0.1784 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P10 mock treatment 570485.5769 59000.0 0.27 583886.5546 -79300.0 -0.42 -0.1053 -0.2101 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P11 mock treatment 540250.0 28700.0 0.13 547179.2453 -116000.0 -0.62 -0.3415 -0.5425 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P12 mock treatment 578293.2692 66800.0 0.31 541157.8947 -122000.0 -0.65 -0.2401 -0.3348 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P13 mock treatment 650305.5556 139000.0 0.64 560494.0711 -103000.0 -0.54 0.0673 0.08 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P14 mock treatment 557216.0804 45700.0 0.21 543775.8621 -119000.0 -0.63 -0.299 -0.4478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P15 mock treatment 558323.7705 46800.0 0.22 579551.8672 -83700.0 -0.44 -0.1612 -0.3266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P16 mock treatment 549600.0 38100.0 0.18 570819.0045 -92400.0 -0.49 -0.2224 -0.4271 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P17 mock treatment 499533.3333 -12000.0 -0.06 568913.0435 -94300.0 -0.5 -0.3928 -0.7805 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P18 mock treatment 447114.8325 -64400.0 -0.3 565199.0521 -98000.0 -0.52 -0.5777 -0.9647 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P19 mock treatment 490952.1531 -20600.0 -0.09 573515.0376 -89700.0 -0.48 -0.4035 -0.8317 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P20 mock treatment 409428.0303 -102000.0 -0.47 523545.8167 -140000.0 -0.74 -0.8568 -0.976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P21 mock treatment 451061.6438 -60500.0 -0.28 440724.9071 -223000.0 -1.18 -1.0316 -0.8507 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P22 mock treatment 411685.5124 -99800.0 -0.46 452470.5882 -211000.0 -1.12 -1.116 -0.9231 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P23 mock treatment 424436.9748 -87100.0 -0.4 480164.6091 -183000.0 -0.97 -0.9705 -0.9237 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2145 P24 mock treatment 479160.1942 -32400.0 -0.15 493401.0152 -170000.0 -0.9 -0.7425 -0.8132 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A01 compound treatment 544092.233 -156000.0 -0.72 585910.8911 -87500.0 -0.46 -0.8359 -0.9778 3237406 Sulf1.1-A_000001 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A02 compound treatment 773836.4486 74100.0 0.34 831344.4976 158000.0 0.84 0.8338 0.9219 3237380 Sulf1.1-A_000002 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3ccc(Cl)cc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A03 compound treatment 744265.4028 44500.0 0.21 712254.902 38800.0 0.21 0.2907 1.0 3237177 Sulf1.1-A_000003 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccc(cc3)c4ccccc4)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A04 compound treatment 769139.8964 69400.0 0.32 953931.5789 280000.0 1.49 1.2782 0.84 3237394 Sulf1.1-A_000004 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A05 compound treatment 730441.3146 30700.0 0.14 655333.3333 -18100.0 -0.1 0.0322 0.1879 3237332 Sulf1.1-A_000005 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A06 compound treatment 663167.382 -36600.0 -0.17 650744.7917 -22700.0 -0.12 -0.2044 -0.9864 3237396 Sulf1.1-A_000006 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccc(Cl)cc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A07 compound treatment 719066.6667 19300.0 0.09 717657.0048 44200.0 0.23 0.2288 0.9123 3237257 Sulf1.1-A_000007 Cc1ccc(cc1)S(=O)(=O)NC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A08 compound treatment 780924.5283 81200.0 0.37 701732.7189 28300.0 0.15 0.3708 0.9193 3237153 Sulf1.1-A_000008 OCCOc1ccc(CN2CC[C@@H](C2)N3C(=O)c4ccccc4C3=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A09 compound treatment 685994.5355 -13700.0 -0.06 578011.7647 -95400.0 -0.51 -0.4028 -0.7894 3237428 Sulf1.1-A_000009 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccc(cc3)c4ccccc4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A10 compound treatment 688414.7465 -11300.0 -0.05 614761.9048 -58700.0 -0.31 -0.257 -0.8143 3237318 Sulf1.1-A_000010 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3cccc4cccnc34)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A11 compound treatment 717326.9231 17600.0 0.08 581398.1481 -92100.0 -0.49 -0.2879 -0.5816 3237197 Sulf1.1-A_000011 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A12 compound treatment 577961.326 -122000.0 -0.56 612089.4737 -61400.0 -0.33 -0.6273 -0.9664 3237446 Sulf1.1-A_000012 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A13 mock treatment 813209.1837 113000.0 0.52 648649.7462 -24800.0 -0.13 0.277 0.5133 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A14 mock treatment 847079.646 147000.0 0.68 791500.0 118000.0 0.63 0.9232 0.9992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A15 compound treatment 799943.0052 100000.0 0.46 721245.3704 47800.0 0.25 0.506 0.96 3237240 Sulf1.1-A_000013 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3cccc(F)c3)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A16 compound treatment 743167.4419 43400.0 0.2 635231.5271 -38200.0 -0.2 -0.0017 -0.0061 3237246 Sulf1.1-A_000014 COc1ccc(cc1)S(=O)(=O)NC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A17 compound treatment 558748.6911 -141000.0 -0.65 551840.2367 -122000.0 -0.65 -0.9159 -1.0 3237241 Sulf1.1-A_000015 CC(C)S(=O)(=O)NCC1CCN(Cc2ccc(OCCO)cc2)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A18 compound treatment 726308.5106 26600.0 0.12 880426.4706 207000.0 1.1 0.8629 0.7812 3237449 Sulf1.1-A_000016 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3ccc4ccccc4c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A19 compound treatment 499608.1871 -200000.0 -0.92 505076.0234 -168000.0 -0.89 -1.2841 -0.9999 3237371 Sulf1.1-A_000017 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3cccc4cccnc34)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A20 compound treatment 478555.5556 -221000.0 -1.02 572364.5833 -101000.0 -0.54 -1.1004 -0.9549 3237416 Sulf1.1-A_000018 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3cccc(F)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A21 compound treatment 742820.7547 43100.0 0.2 689784.689 16300.0 0.09 0.2017 0.9307 3237365 Sulf1.1-A_000019 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3ccc(Cl)cc3)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A22 compound treatment 700958.9041 1230.0 0.01 787716.895 114000.0 0.61 0.4325 0.7137 3237151 Sulf1.1-A_000020 OCCOc1ccc(CN2CC[C@H](C2)N3C(=O)c4ccccc4C3=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A23 compound treatment 832812.2271 133000.0 0.61 605335.1648 -68100.0 -0.36 0.1785 0.2506 3237460 Sulf1.1-A_000021 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccc(cc3)c4ccccc4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 A24 compound treatment 739786.4078 40100.0 0.18 827288.3721 154000.0 0.82 0.7075 0.8458 3237391 Sulf1.1-A_000022 CC(C)S(=O)(=O)NC1CCN(Cc2cccc(OCCO)c2)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B01 compound treatment 612547.5113 -87200.0 -0.4 786044.0529 113000.0 0.6 0.1379 0.1916 3237454 Sulf1.1-A_000023 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B02 mock treatment 705747.7064 6010.0 0.03 673720.0 262.0 0.0 0.0206 0.7416 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B03 compound treatment 920269.0583 221000.0 1.02 707647.343 34200.0 0.18 0.8474 0.8202 3237356 Sulf1.1-A_000024 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3cccc(F)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B04 mock treatment 687207.7295 -12500.0 -0.06 865590.4762 192000.0 1.02 0.6797 0.666 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B05 compound treatment 810617.9245 111000.0 0.51 750603.1746 77100.0 0.41 0.6509 0.9939 3237374 Sulf1.1-A_000025 Cc1nc(cn1C)S(=O)(=O)NCC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B06 mock treatment 709571.4286 9840.0 0.05 757231.8841 83800.0 0.44 0.3463 0.7753 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B07 compound treatment 682512.1951 -17200.0 -0.08 664833.3333 -8620.0 -0.05 -0.0885 -0.9657 3237437 Sulf1.1-A_000026 Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B08 mock treatment 713311.3208 13600.0 0.06 716806.2827 43300.0 0.23 0.2069 0.8681 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B09 compound treatment 807441.1765 108000.0 0.5 721663.3166 48200.0 0.26 0.532 0.9523 3237320 Sulf1.1-A_000027 Cc1ccccc1S(=O)(=O)NC[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B10 mock treatment 789671.2963 89900.0 0.41 841923.0769 168000.0 0.89 0.9251 0.9391 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B11 compound treatment 599239.1304 -100000.0 -0.46 562370.5584 -111000.0 -0.59 -0.7443 -0.9929 3237427 Sulf1.1-A_000028 Cc1ccc(F)cc1S(=O)(=O)N[C@@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B12 mock treatment 702868.5446 3140.0 0.01 679520.7373 6060.0 0.03 0.033 0.9349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B13 mock treatment 946575.6098 247000.0 1.14 795226.601 122000.0 0.65 1.2616 0.964 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B14 mock treatment 672433.1797 -27300.0 -0.13 706981.6514 33500.0 0.18 0.0367 0.1685 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B15 compound treatment 741206.7308 41500.0 0.19 803490.991 130000.0 0.69 0.6229 0.8703 3237372 Sulf1.1-A_000029 Cc1ccccc1S(=O)(=O)NCC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B16 mock treatment 821910.7143 122000.0 0.56 683226.1307 9770.0 0.05 0.435 0.7689 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B17 compound treatment 621151.5152 -78600.0 -0.36 794473.6842 121000.0 0.64 0.1976 0.2681 3237289 Sulf1.1-A_000030 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B18 mock treatment 794419.8113 94700.0 0.44 655547.9452 -17900.0 -0.09 0.2416 0.5406 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B19 compound treatment 50769.2308 -649000.0 -2.99 62978.7234 -610000.0 -3.24 -4.4058 -0.9992 3237235 Sulf1.1-A_000031 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B20 mock treatment 811009.3458 111000.0 0.51 761645.1613 88200.0 0.47 0.6936 0.9989 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B21 compound treatment 717537.1179 17800.0 0.08 558155.0 -115000.0 -0.61 -0.3744 -0.6067 3237435 Sulf1.1-A_000032 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3cccc(F)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B22 mock treatment 632741.784 -67000.0 -0.31 759345.6221 85900.0 0.46 0.1037 0.1883 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B23 compound treatment 676242.7184 -23500.0 -0.11 633825.2427 -39600.0 -0.21 -0.2252 -0.9525 3237254 Sulf1.1-A_000033 Cc1nc(cn1C)S(=O)(=O)NC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 B24 mock treatment 653875.0 -45900.0 -0.21 659827.907 -13600.0 -0.07 -0.2007 -0.8978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C01 compound treatment 627399.0148 -72300.0 -0.33 632527.6382 -40900.0 -0.22 -0.3894 -0.9784 3237301 Sulf1.1-A_000034 CC(C)S(=O)(=O)N[C@@H]1CCN(Cc2ccc(OCCO)cc2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C02 compound treatment 760456.621 60700.0 0.28 723119.0476 49700.0 0.26 0.3843 0.9995 3237158 Sulf1.1-A_000035 OCCOc1ccc(CN2CCC[C@@H](CN3C(=O)c4ccccc4C3=O)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C03 compound treatment 737968.254 38200.0 0.18 665387.2549 -8070.0 -0.04 0.0944 0.5203 3237256 Sulf1.1-A_000036 CC(C)S(=O)(=O)NC1CCN(Cc2ccc(OCCO)cc2)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C04 compound treatment 121525.4237 -578000.0 -2.67 132698.1132 -541000.0 -2.87 -3.9136 -0.9993 3237156 Sulf1.1-A_000037 OCCOc1ccc(CN2CCC[C@H](C2)N3C(=O)c4ccccc4C3=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C05 compound treatment 691522.5225 -8210.0 -0.04 746296.6507 72800.0 0.39 0.2464 0.6348 3237312 Sulf1.1-A_000038 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccc(cc3)c4ccccc4)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C06 compound treatment 634560.5381 -65200.0 -0.3 629086.5385 -44400.0 -0.24 -0.3789 -0.9927 3237455 Sulf1.1-A_000039 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccccc3[N+](=O)[O-])c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C07 compound treatment 709847.1338 10100.0 0.05 839764.1026 166000.0 0.88 0.6567 0.7435 3237443 Sulf1.1-A_000040 Cc1ccc(F)cc1S(=O)(=O)N2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C08 compound treatment 722824.5614 23100.0 0.11 733720.339 60300.0 0.32 0.3013 0.8944 3237464 Sulf1.1-A_000041 Cc1ccccc1S(=O)(=O)N2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C09 compound treatment 547539.7727 -152000.0 -0.7 667717.0732 -5740.0 -0.03 -0.5178 -0.7371 3237452 Sulf1.1-A_000042 CC(C)S(=O)(=O)N1CCN(Cc2ccc(OCCO)cc2)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C10 compound treatment 565813.8298 -134000.0 -0.62 873186.8132 200000.0 1.06 0.3124 0.2547 3237191 Sulf1.1-A_000043 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3cccc(F)c3)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C11 mock treatment 809722.5131 110000.0 0.51 797467.7419 124000.0 0.66 0.8238 0.9918 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C12 mock treatment 756841.629 57100.0 0.26 910043.4783 237000.0 1.25 1.0735 0.8373 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C13 compound treatment 575271.7391 -124000.0 -0.57 884644.4444 211000.0 1.12 0.3862 0.3068 3237189 Sulf1.1-A_000044 Cc1nc(cn1C)S(=O)(=O)NC[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C14 compound treatment 662834.2246 -36900.0 -0.17 784036.2694 111000.0 0.59 0.2944 0.4821 3237360 Sulf1.1-A_000045 Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C15 mock treatment 677715.1515 -22000.0 -0.1 745933.3333 72500.0 0.38 0.2 0.5031 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C16 mock treatment 774056.0345 74300.0 0.34 830042.4528 157000.0 0.83 0.8296 0.9234 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C17 compound treatment 763171.9457 63400.0 0.29 668648.6486 -4810.0 -0.03 0.1888 0.643 3237358 Sulf1.1-A_000046 CC(C)S(=O)(=O)N[C@@H]1CCCN(Cc2cccc(OCCO)c2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C18 compound treatment 737576.7196 37800.0 0.17 784546.3415 111000.0 0.59 0.54 0.8788 3237390 Sulf1.1-A_000047 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3cccc(F)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C19 compound treatment 817045.8716 117000.0 0.54 796403.9409 123000.0 0.65 0.8437 0.9957 3237243 Sulf1.1-A_000048 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C20 compound treatment 805609.3023 106000.0 0.49 974444.4444 301000.0 1.6 1.4741 0.883 3237467 Sulf1.1-A_000049 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3cccc(F)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C21 compound treatment 625914.2857 -73800.0 -0.34 595543.7788 -77900.0 -0.41 -0.5329 -0.9954 3237185 Sulf1.1-A_000050 Cc1ccccc1S(=O)(=O)NC[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C22 compound treatment 766960.9756 67200.0 0.31 713982.8571 40500.0 0.21 0.3712 0.984 3237163 Sulf1.1-A_000051 OCCOc1cccc(CN2CCC(CC2)N3C(=O)c4ccccc4C3=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C23 compound treatment 650702.439 -49000.0 -0.23 577306.7485 -96200.0 -0.51 -0.5205 -0.933 3237285 Sulf1.1-A_000052 Cc1ccc(cc1)S(=O)(=O)N[C@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 C24 compound treatment 767328.4314 67600.0 0.31 763169.3122 89700.0 0.48 0.5569 0.979 3237265 Sulf1.1-A_000053 Cc1ccc(F)cc1S(=O)(=O)N[C@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D01 compound treatment 639275.5102 -60500.0 -0.28 583720.0 -89700.0 -0.48 -0.5337 -0.9675 3237408 Sulf1.1-A_000054 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3cccc4cccnc34)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D02 mock treatment 681510.101 -18200.0 -0.08 796853.9326 123000.0 0.65 0.4034 0.6113 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D03 compound treatment 449801.2821 -250000.0 -1.15 435755.1867 -238000.0 -1.26 -1.7065 -0.999 3237375 Sulf1.1-A_000055 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3cccc(F)c3)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D04 mock treatment 745636.3636 45900.0 0.21 692432.4324 19000.0 0.1 0.2208 0.9422 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D05 compound treatment 656890.411 -42800.0 -0.2 768261.1111 94800.0 0.5 0.2159 0.3995 3237458 Sulf1.1-A_000056 COc1ccc(cc1)S(=O)(=O)N2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D06 mock treatment 782463.3028 82700.0 0.38 778896.5517 105000.0 0.56 0.6652 0.9826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D07 compound treatment 617894.9772 -81800.0 -0.38 637167.5127 -36300.0 -0.19 -0.403 -0.9512 3237247 Sulf1.1-A_000057 Cc1ccc(F)cc1S(=O)(=O)NC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D08 mock treatment 920921.9512 221000.0 1.02 867126.1682 194000.0 1.03 1.4476 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D09 compound treatment 844644.1441 145000.0 0.67 723815.9204 50400.0 0.27 0.6614 0.919 3237279 Sulf1.1-A_000058 Cc1nc(cn1C)S(=O)(=O)N[C@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D10 mock treatment 839746.3415 140000.0 0.65 756484.5361 83000.0 0.44 0.768 0.9826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D11 mock treatment 840389.6104 141000.0 0.65 711800.0 38300.0 0.2 0.6025 0.8863 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D12 mock treatment 766702.2222 67000.0 0.31 712828.125 39400.0 0.21 0.366 0.9818 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D13 compound treatment 558203.0457 -142000.0 -0.65 569807.377 -104000.0 -0.55 -0.8503 -0.9964 3237383 Sulf1.1-A_000059 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3ccc(cc3)c4ccccc4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D14 mock treatment 825984.127 126000.0 0.58 660436.6197 -13000.0 -0.07 0.3629 0.6189 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D15 mock treatment 674725.8065 -25000.0 -0.12 708839.4495 35400.0 0.19 0.0511 0.2322 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D16 mock treatment 801130.8901 101000.0 0.47 772396.9849 98900.0 0.52 0.7017 0.9983 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D17 compound treatment 508126.5823 -192000.0 -0.88 511680.7229 -162000.0 -0.86 -1.2316 -0.9999 3237175 Sulf1.1-A_000060 Cc1ccc(F)cc1S(=O)(=O)NC[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D18 mock treatment 797038.6473 97300.0 0.45 722323.0769 48900.0 0.26 0.5006 0.966 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D19 compound treatment 647359.447 -52400.0 -0.24 586862.4339 -86600.0 -0.46 -0.4956 -0.955 3237205 Sulf1.1-A_000061 Cc1ccc(F)cc1S(=O)(=O)N[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D20 mock treatment 708225.5319 8490.0 0.04 647251.046 -26200.0 -0.14 -0.0706 -0.4889 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D21 compound treatment 499155.5556 -201000.0 -0.92 595196.4286 -78300.0 -0.42 -0.9476 -0.9346 3237238 Sulf1.1-A_000062 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3ccc4ccccc4c3)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D22 mock treatment 690258.9641 -9470.0 -0.04 639807.1749 -33700.0 -0.18 -0.1571 -0.855 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D23 compound treatment 566575.3425 -133000.0 -0.61 576124.3523 -97300.0 -0.52 -0.7993 -0.9963 3237342 Sulf1.1-A_000063 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccc(cc3)c4ccccc4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 D24 mock treatment 671960.6987 -27800.0 -0.13 601636.7521 -71800.0 -0.38 -0.3599 -0.8956 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E01 mock treatment 659104.3956 -40600.0 -0.19 613500.0 -60000.0 -0.32 -0.3574 -0.9682 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E02 mock treatment 900663.5071 201000.0 0.93 887441.7476 214000.0 1.13 1.4578 0.9949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E03 compound treatment 618329.1139 -81400.0 -0.38 685106.7416 11600.0 0.06 -0.2218 -0.5829 3237456 Sulf1.1-A_000064 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E04 compound treatment 742714.2857 43000.0 0.2 787557.2917 114000.0 0.61 0.5681 0.8921 3237281 Sulf1.1-A_000065 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3cccc(F)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E05 compound treatment 578534.3915 -121000.0 -0.56 670030.7692 -3430.0 -0.02 -0.4081 -0.7297 3237430 Sulf1.1-A_000066 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E06 compound treatment 841507.8534 142000.0 0.65 865239.7959 192000.0 1.02 1.1816 0.9772 3237248 Sulf1.1-A_000067 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3ccc(cc3)c4ccccc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E07 compound treatment 690512.1951 -9220.0 -0.04 747366.6667 73900.0 0.39 0.2471 0.6267 3237392 Sulf1.1-A_000068 Cc1ccc(cc1)S(=O)(=O)NC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E08 compound treatment 792697.9167 93000.0 0.43 721406.0914 47900.0 0.25 0.483 0.9689 3237369 Sulf1.1-A_000069 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3cc(Cl)ccc3Cl)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E09 mock treatment 978728.5714 279000.0 1.29 747684.2105 74200.0 0.39 1.1882 0.8831 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E10 mock treatment 835834.9515 136000.0 0.63 672974.0933 -484.0 0.0 0.442 0.7042 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E11 compound treatment 685323.9437 -14400.0 -0.07 786452.1277 113000.0 0.6 0.3768 0.6249 3237294 Sulf1.1-A_000070 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3cc(Cl)ccc3Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E12 compound treatment 567713.3758 -132000.0 -0.61 627367.2316 -46100.0 -0.24 -0.6034 -0.9197 3237436 Sulf1.1-A_000071 CC(C)S(=O)(=O)N[C@@H]1CCN(Cc2cccc(OCCO)c2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E13 compound treatment 620158.5366 -79600.0 -0.37 639551.2821 -33900.0 -0.18 -0.3867 -0.9461 3237379 Sulf1.1-A_000072 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E14 compound treatment 597201.2579 -103000.0 -0.47 879977.5281 207000.0 1.1 0.4402 0.369 3237253 Sulf1.1-A_000073 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3ccc4ccccc4c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E15 compound treatment 669687.8307 -30000.0 -0.14 853944.4444 180000.0 0.96 0.5789 0.5985 3237322 Sulf1.1-A_000074 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccc4ccccc4c3)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E16 compound treatment 737229.9465 37500.0 0.17 868467.9803 195000.0 1.03 0.8537 0.814 3237219 Sulf1.1-A_000075 Cc1nc(cn1C)S(=O)(=O)N[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E17 mock treatment 710333.3333 10600.0 0.05 846469.3878 173000.0 0.92 0.6834 0.7437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E18 mock treatment 737905.8296 38200.0 0.18 796839.8058 123000.0 0.65 0.5872 0.8665 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E19 compound treatment 486175.8242 -214000.0 -0.98 582712.5749 -90700.0 -0.48 -1.0367 -0.9458 3237298 Sulf1.1-A_000076 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccc4ccccc4c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E20 compound treatment 645647.3684 -54100.0 -0.25 569292.5532 -104000.0 -0.55 -0.567 -0.9354 3237439 Sulf1.1-A_000077 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3ccccc3[N+](=O)[O-])cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E21 compound treatment 787279.4118 87500.0 0.4 837099.5025 164000.0 0.87 0.8992 0.9394 3237225 Sulf1.1-A_000078 Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E22 compound treatment 567075.8294 -133000.0 -0.61 599061.674 -74400.0 -0.39 -0.7116 -0.9775 3237306 Sulf1.1-A_000079 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccc(Cl)cc3)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E23 compound treatment 646634.1463 -53100.0 -0.24 618519.3133 -54900.0 -0.29 -0.3792 -0.9963 3237420 Sulf1.1-A_000080 Cc1ccc(cc1)S(=O)(=O)N[C@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 E24 compound treatment 587225.8065 -113000.0 -0.52 671436.7816 -2020.0 -0.01 -0.3745 -0.7216 3237469 Sulf1.1-A_000081 Cc1ccc(cc1)S(=O)(=O)N2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F01 mock treatment 931576.5306 232000.0 1.07 721088.2353 47600.0 0.25 0.9347 0.8508 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F02 mock treatment 775579.235 75800.0 0.35 711606.5574 38100.0 0.2 0.3904 0.9661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F03 compound treatment 545370.9677 -154000.0 -0.71 644359.116 -29100.0 -0.15 -0.6125 -0.8409 3237364 Sulf1.1-A_000082 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3ccccc3)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F04 mock treatment 877627.551 178000.0 0.82 894666.6667 221000.0 1.17 1.4097 0.9847 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F05 compound treatment 584565.2174 -115000.0 -0.53 675475.4902 2020.0 0.01 -0.368 -0.6927 3237352 Sulf1.1-A_000083 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccc4ccccc4c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F06 mock treatment 940608.6957 241000.0 1.11 828030.0 155000.0 0.82 1.3652 0.9888 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F07 compound treatment 513628.3784 -186000.0 -0.86 559403.5088 -114000.0 -0.6 -1.0346 -0.9853 3237271 Sulf1.1-A_000084 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F08 mock treatment 966306.2201 267000.0 1.23 781452.1739 108000.0 0.57 1.2743 0.9396 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F09 mock treatment 835230.7692 135000.0 0.62 809193.3962 136000.0 0.72 0.9509 0.9975 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F10 mock treatment 738431.1111 38700.0 0.18 814842.1053 141000.0 0.75 0.6564 0.8516 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F11 compound treatment 658154.2553 -41600.0 -0.19 688920.0 15500.0 0.08 -0.0776 -0.3721 3237444 Sulf1.1-A_000085 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3ccc(cc3)c4ccccc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F12 mock treatment 803000.0 103000.0 0.48 719090.9091 45600.0 0.24 0.5079 0.9507 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F13 compound treatment 719381.1659 19600.0 0.09 862622.2222 189000.0 1.0 0.7735 0.7678 3237438 Sulf1.1-A_000086 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F14 mock treatment 812963.7306 113000.0 0.52 752267.3267 78800.0 0.42 0.6648 0.9939 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F15 compound treatment 804500.0 105000.0 0.48 856713.5678 183000.0 0.97 1.0289 0.9479 3237422 Sulf1.1-A_000087 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F16 mock treatment 656561.8557 -43200.0 -0.2 905517.2414 232000.0 1.23 0.7296 0.5851 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F17 mock treatment 689657.4074 -10100.0 -0.05 736493.0876 63000.0 0.33 0.2036 0.603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F18 mock treatment 833132.4201 133000.0 0.62 786938.0952 113000.0 0.6 0.8606 0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F19 compound treatment 614471.4286 -85300.0 -0.39 610895.1965 -62600.0 -0.33 -0.5127 -0.9964 3237453 Sulf1.1-A_000088 Cc1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F20 mock treatment 710404.878 10700.0 0.05 764855.814 91400.0 0.48 0.3776 0.7749 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F21 compound treatment 580281.6327 -119000.0 -0.55 612398.1043 -61100.0 -0.32 -0.6185 -0.9679 3237203 Sulf1.1-A_000089 COc1ccc(cc1)S(=O)(=O)N[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F22 mock treatment 716128.0788 16400.0 0.08 699698.4925 26200.0 0.14 0.1519 0.9589 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F23 compound treatment 494945.0 -205000.0 -0.94 541356.8075 -132000.0 -0.7 -1.1632 -0.9892 3237326 Sulf1.1-A_000090 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3cccc(F)c3)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 F24 mock treatment 750402.8436 50700.0 0.23 814027.2727 141000.0 0.75 0.6924 0.8862 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G01 compound treatment 608921.5686 -90800.0 -0.42 599529.7619 -73900.0 -0.39 -0.5734 -0.9995 3237230 Sulf1.1-A_000091 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G02 compound treatment 618900.9434 -80800.0 -0.37 682357.8947 8900.0 0.05 -0.2302 -0.6127 3237376 Sulf1.1-A_000092 CC(C)S(=O)(=O)NCC1CCN(Cc2cccc(OCCO)c2)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G03 mock treatment 735866.6667 36100.0 0.17 678177.3399 4720.0 0.03 0.1355 0.8043 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G04 mock treatment 693042.1053 -6690.0 -0.03 762928.5714 89500.0 0.47 0.3137 0.6597 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G05 compound treatment 635958.5253 -63800.0 -0.29 658711.5385 -14700.0 -0.08 -0.2633 -0.8651 3237466 Sulf1.1-A_000093 Cc1nc(cn1C)S(=O)(=O)N2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G06 compound treatment 589639.0244 -110000.0 -0.51 535358.0786 -138000.0 -0.73 -0.877 -0.984 3237165 Sulf1.1-A_000094 OCCOc1cccc(CN2CCC[C@H](C2)N3C(=O)c4ccccc4C3=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G07 compound treatment 415741.7582 -284000.0 -1.31 484932.0388 -189000.0 -1.0 -1.6331 -0.9911 3237290 Sulf1.1-A_000095 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccc(Cl)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G08 compound treatment 544926.8293 -155000.0 -0.71 584534.8837 -88900.0 -0.47 -0.8383 -0.9798 3237199 Sulf1.1-A_000096 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G09 compound treatment 591209.607 -109000.0 -0.5 561385.4749 -112000.0 -0.59 -0.7742 -0.9963 3237213 Sulf1.1-A_000097 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3cccc4cccnc34)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G10 compound treatment 621718.3099 -78000.0 -0.36 616066.9643 -57400.0 -0.3 -0.4696 -0.9965 3237354 Sulf1.1-A_000098 Cc1nc(cn1C)S(=O)(=O)N[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G11 compound treatment 583606.4815 -116000.0 -0.54 549782.3834 -124000.0 -0.66 -0.8425 -0.9949 3237348 Sulf1.1-A_000099 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3cccc4cccnc34)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G12 compound treatment 556968.5864 -143000.0 -0.66 541388.0597 -132000.0 -0.7 -0.9609 -0.9995 3237154 Sulf1.1-A_000100 OCCOc1ccc(CN2CCC(CC2)N3C(=O)c4ccccc4C3=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G13 compound treatment 510769.6629 -189000.0 -0.87 504038.2514 -169000.0 -0.9 -1.2516 -0.9999 3237231 Sulf1.1-A_000101 COc1ccc(cc1)S(=O)(=O)NCC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G14 compound treatment 685415.2542 -14300.0 -0.07 574050.4202 -99400.0 -0.53 -0.4195 -0.7895 3237160 Sulf1.1-A_000102 OCCOc1cccc(CN2CC[C@H](C2)N3C(=O)c4ccccc4C3=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G15 compound treatment 568771.028 -131000.0 -0.6 525961.39 -147000.0 -0.78 -0.9802 -0.9918 3237336 Sulf1.1-A_000103 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccc(Cl)cc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G16 compound treatment 463988.0952 -236000.0 -1.09 521925.0 -152000.0 -0.8 -1.3371 -0.989 3237258 Sulf1.1-A_000104 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G17 compound treatment 558172.4138 -142000.0 -0.65 558461.5385 -115000.0 -0.61 -0.8929 -0.9994 3237440 Sulf1.1-A_000105 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G18 compound treatment 555853.4483 -144000.0 -0.66 571441.048 -102000.0 -0.54 -0.8518 -0.9949 3237173 Sulf1.1-A_000106 COc1ccc(cc1)S(=O)(=O)NC[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G19 mock treatment 515393.2039 -184000.0 -0.85 582855.9322 -90600.0 -0.48 -0.9409 -0.9635 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G20 mock treatment 567973.2143 -132000.0 -0.61 563865.7407 -110000.0 -0.58 -0.8407 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G21 compound treatment 634252.1368 -65500.0 -0.3 619185.7923 -54300.0 -0.29 -0.4171 -0.9997 3237368 Sulf1.1-A_000107 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3ccc(cc3)c4ccccc4)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G22 compound treatment 481522.6337 -218000.0 -1.01 501158.1633 -172000.0 -0.91 -1.3578 -0.9988 3237402 Sulf1.1-A_000108 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccc(cc3)c4ccccc4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G23 compound treatment 693576.5766 -6160.0 -0.03 595524.8619 -77900.0 -0.41 -0.3124 -0.7539 3237211 Sulf1.1-A_000109 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 G24 compound treatment 534538.835 -165000.0 -0.76 500288.4615 -173000.0 -0.92 -1.1882 -0.9957 3237251 Sulf1.1-A_000110 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3cccc4cccnc34)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H01 compound treatment 60393.9394 -639000.0 -2.95 403419.3548 -270000.0 -1.43 -3.0976 -0.945 3237316 Sulf1.1-A_000111 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H02 mock treatment 835675.9259 136000.0 0.63 785188.9401 112000.0 0.59 0.8623 0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H03 mock treatment 741340.0 41600.0 0.19 685457.5472 12000.0 0.06 0.1807 0.8938 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H04 mock treatment 643000.0 -56700.0 -0.26 739411.215 66000.0 0.35 0.0624 0.1427 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H05 compound treatment 648512.6904 -51200.0 -0.24 716385.5932 42900.0 0.23 -0.006 -0.0184 3237215 Sulf1.1-A_000112 Cc1ccccc1S(=O)(=O)N[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H06 mock treatment 789221.1982 89500.0 0.41 630096.1538 -43400.0 -0.23 0.1292 0.2734 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H07 compound treatment 637143.5644 -62600.0 -0.29 727853.3333 54400.0 0.29 -1.0E-4 -2.0E-4 3237447 Sulf1.1-A_000113 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3cccc4cccnc34)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H08 mock treatment 699200.0 -534.0 0.0 655218.1818 -18200.0 -0.1 -0.0701 -0.7249 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H09 compound treatment 661629.6296 -38100.0 -0.18 667170.8543 -6290.0 -0.03 -0.1478 -0.8265 3237209 Sulf1.1-A_000114 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3cc(Cl)ccc3Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H10 mock treatment 652932.0 -46800.0 -0.22 585820.1058 -87600.0 -0.46 -0.4813 -0.9391 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H11 compound treatment 469497.3545 -230000.0 -1.06 478273.8095 -195000.0 -1.04 -1.4828 -0.9999 3237245 Sulf1.1-A_000115 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3ccc(Cl)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H12 mock treatment 630186.722 -69500.0 -0.32 645500.0 -28000.0 -0.15 -0.3316 -0.9386 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H13 compound treatment 447098.0392 -253000.0 -1.17 463898.2036 -210000.0 -1.11 -1.6098 -0.9997 3237367 Sulf1.1-A_000116 Cc1ccc(F)cc1S(=O)(=O)NCC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H14 mock treatment 623357.1429 -76400.0 -0.35 632525.8621 -40900.0 -0.22 -0.4026 -0.973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H15 compound treatment 354990.3846 -345000.0 -1.59 226720.4301 -447000.0 -2.37 -2.7997 -0.9812 3237250 Sulf1.1-A_000117 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H16 mock treatment 622097.4576 -77600.0 -0.36 606720.524 -66700.0 -0.35 -0.5035 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H17 compound treatment 523603.0928 -176000.0 -0.81 530828.2828 -143000.0 -0.76 -1.1093 -0.9994 3237195 Sulf1.1-A_000118 Cc1ccc(cc1)S(=O)(=O)NC[C@@H]2CCCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H18 mock treatment 612477.4436 -87300.0 -0.4 582227.4678 -91200.0 -0.48 -0.6267 -0.9958 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H19 mock treatment 571424.2424 -128000.0 -0.59 584152.8384 -89300.0 -0.47 -0.7533 -0.9939 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H20 mock treatment 575504.5872 -124000.0 -0.57 534433.1797 -139000.0 -0.74 -0.9265 -0.9922 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H21 compound treatment 523995.4338 -176000.0 -0.81 522773.5849 -151000.0 -0.8 -1.1382 -1.0 3237330 Sulf1.1-A_000119 Cc1ccc(cc1)S(=O)(=O)NC[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H22 mock treatment 565747.8632 -134000.0 -0.62 589154.2056 -84300.0 -0.45 -0.7531 -0.9874 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H23 compound treatment 576517.7866 -123000.0 -0.57 496160.9195 -177000.0 -0.94 -1.0667 -0.9709 3237275 Sulf1.1-A_000120 Cc1ccccc1S(=O)(=O)N[C@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 H24 mock treatment 626502.008 -73200.0 -0.34 604154.9296 -69300.0 -0.37 -0.4987 -0.9991 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I01 compound treatment 558689.6552 -141000.0 -0.65 543607.6555 -130000.0 -0.69 -0.9469 -0.9996 3237314 Sulf1.1-A_000121 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3cc(Cl)ccc3Cl)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I02 compound treatment 674108.5973 -25600.0 -0.12 778134.0206 105000.0 0.56 0.309 0.5444 3237346 Sulf1.1-A_000122 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I03 compound treatment 576861.8785 -123000.0 -0.57 736677.5956 63200.0 0.34 -0.1636 -0.2484 3237404 Sulf1.1-A_000123 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3cc(Cl)ccc3Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I04 compound treatment 588903.3816 -111000.0 -0.51 627145.7286 -46300.0 -0.25 -0.5351 -0.9436 3237340 Sulf1.1-A_000124 Cc1ccc(F)cc1S(=O)(=O)N[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I05 mock treatment 885116.7513 185000.0 0.85 660905.6604 -12600.0 -0.07 0.5574 0.6501 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I06 mock treatment 1106633.803 407000.0 1.88 784173.7288 111000.0 0.59 1.7421 0.886 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I07 compound treatment 576421.5686 -123000.0 -0.57 609349.0566 -64100.0 -0.34 -0.6425 -0.9698 3237334 Sulf1.1-A_000125 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I08 compound treatment 548436.4641 -151000.0 -0.7 658353.7736 -15100.0 -0.08 -0.55 -0.7832 3237162 Sulf1.1-A_000126 OCCOc1cccc(CN2CC[C@@H](C2)N3C(=O)c4ccccc4C3=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I09 compound treatment 498526.3158 -201000.0 -0.93 511240.7407 -162000.0 -0.86 -1.2645 -0.9993 3237468 Sulf1.1-A_000127 CC(C)S(=O)(=O)N1CCN(Cc2cccc(OCCO)c2)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I10 compound treatment 596014.2857 -104000.0 -0.48 571947.1366 -102000.0 -0.54 -0.7189 -0.9983 3237295 Sulf1.1-A_000128 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I11 compound treatment 595519.802 -104000.0 -0.48 591652.4064 -81800.0 -0.43 -0.6466 -0.9987 3237424 Sulf1.1-A_000129 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I12 compound treatment 593948.1865 -106000.0 -0.49 544819.6721 -129000.0 -0.68 -0.8274 -0.9865 3237287 Sulf1.1-A_000130 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I13 compound treatment 635735.2941 -64000.0 -0.3 561786.3636 -112000.0 -0.59 -0.6275 -0.9482 3237269 Sulf1.1-A_000131 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3cc(Cl)ccc3Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I14 compound treatment 589047.8723 -111000.0 -0.51 541198.3471 -132000.0 -0.7 -0.857 -0.9878 3237155 Sulf1.1-A_000132 OCCOc1ccc(CN2CCC(CN3C(=O)c4ccccc4C3=O)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I15 compound treatment 578307.3394 -121000.0 -0.56 545004.6729 -128000.0 -0.68 -0.8777 -0.9953 3237463 Sulf1.1-A_000133 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3cccc4cccnc34)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I16 compound treatment 624108.3744 -75600.0 -0.35 676085.3081 2630.0 0.01 -0.2368 -0.6783 3237410 Sulf1.1-A_000134 Cc1ccccc1S(=O)(=O)N[C@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I17 compound treatment 677595.2381 -22100.0 -0.1 538165.9751 -135000.0 -0.72 -0.5796 -0.7997 3237385 Sulf1.1-A_000135 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3ccc(Cl)c(Cl)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I18 compound treatment 563314.8936 -136000.0 -0.63 661472.4771 -12000.0 -0.06 -0.4898 -0.7746 3237167 Sulf1.1-A_000136 OCCOc1cccc(CN2CCC[C@@H](CN3C(=O)c4ccccc4C3=O)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I19 compound treatment 594603.5242 -105000.0 -0.48 672067.6692 -1390.0 -0.01 -0.348 -0.7178 3237450 Sulf1.1-A_000137 Cc1nc(cn1C)S(=O)(=O)N2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I20 compound treatment 603776.4228 -96000.0 -0.44 600926.6409 -72500.0 -0.38 -0.5849 -0.9976 3237221 Sulf1.1-A_000138 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3cccc(F)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I21 mock treatment 676038.2775 -23700.0 -0.11 747009.4787 73600.0 0.39 0.1986 0.4902 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I22 mock treatment 724196.347 24500.0 0.11 596591.133 -76900.0 -0.41 -0.2085 -0.4929 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I23 compound treatment 711972.1116 12200.0 0.06 637433.3333 -36000.0 -0.19 -0.0952 -0.4778 3237187 Sulf1.1-A_000139 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccc4ccccc4c3)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 I24 compound treatment 585000.0 -115000.0 -0.53 655795.3216 -17700.0 -0.09 -0.4404 -0.8196 3237393 Sulf1.1-A_000140 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J01 compound treatment 717118.5567 17400.0 0.08 772774.8691 99300.0 0.53 0.4292 0.8055 3237433 Sulf1.1-A_000141 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccc4ccccc4c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J02 mock treatment 712486.3636 12800.0 0.06 794385.4167 121000.0 0.64 0.4951 0.7687 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J03 compound treatment 747389.4231 47700.0 0.22 554315.7895 -119000.0 -0.63 -0.2914 -0.4356 3237382 Sulf1.1-A_000142 Cc1ccc(F)cc1S(=O)(=O)NC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J04 mock treatment 887211.2676 187000.0 0.86 844447.8261 171000.0 0.91 1.2526 0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J05 mock treatment 805879.668 106000.0 0.49 840076.9231 167000.0 0.88 0.971 0.9612 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J06 mock treatment 722935.3234 23200.0 0.11 705716.1572 32300.0 0.17 0.1966 0.9745 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J07 compound treatment 442098.4456 -258000.0 -1.19 501076.555 -172000.0 -0.91 -1.4866 -0.9916 3237388 Sulf1.1-A_000143 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3ccc4ccccc4c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J08 mock treatment 690139.738 -9590.0 -0.04 752179.6117 78700.0 0.42 0.264 0.6287 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J09 compound treatment 567364.0167 -132000.0 -0.61 639118.8119 -34300.0 -0.18 -0.5604 -0.8798 3237381 Sulf1.1-A_000144 COc1ccc(cc1)S(=O)(=O)NC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J10 mock treatment 649959.0909 -49800.0 -0.23 579713.7255 -93700.0 -0.5 -0.5139 -0.9384 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J11 compound treatment 460748.2517 -239000.0 -1.1 546056.962 -127000.0 -0.68 -1.2571 -0.9724 3237373 Sulf1.1-A_000145 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3ccc4ccccc4c3)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J12 mock treatment 738460.3175 38700.0 0.18 601579.4872 -71900.0 -0.38 -0.1433 -0.3404 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J13 compound treatment 551842.9752 -148000.0 -0.68 553808.4112 -120000.0 -0.63 -0.931 -0.9994 3237412 Sulf1.1-A_000146 OCCOc1cccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccc4ccccc4c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J14 mock treatment 642367.6471 -57400.0 -0.26 542066.2021 -131000.0 -0.7 -0.6798 -0.912 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J15 compound treatment 598107.8838 -102000.0 -0.47 579520.5479 -93900.0 -0.5 -0.6837 -0.9995 3237344 Sulf1.1-A_000147 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3cc(Cl)ccc3Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J16 mock treatment 589996.124 -110000.0 -0.51 576498.0545 -97000.0 -0.51 -0.7215 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J17 compound treatment 549007.6923 -151000.0 -0.7 547595.2381 -126000.0 -0.67 -0.9636 -0.9998 3237448 Sulf1.1-A_000148 Cc1ccccc1S(=O)(=O)N2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J18 mock treatment 589003.5088 -111000.0 -0.51 549493.8776 -124000.0 -0.66 -0.826 -0.9922 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J19 compound treatment 634884.7584 -64800.0 -0.3 613688.0734 -59800.0 -0.32 -0.4356 -0.9996 3237362 Sulf1.1-A_000149 OCCOc1cccc(CN2CCC[C@H](C2)NS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J20 mock treatment 682311.2583 -17400.0 -0.08 550328.9474 -123000.0 -0.65 -0.5186 -0.7882 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J21 mock treatment 642253.9063 -57500.0 -0.27 627161.4173 -46300.0 -0.25 -0.3611 -0.9993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J22 mock treatment 593647.6868 -106000.0 -0.49 513781.746 -160000.0 -0.85 -0.9448 -0.966 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J23 compound treatment 558864.1975 -141000.0 -0.65 696088.6076 22600.0 0.12 -0.3745 -0.5669 3237283 Sulf1.1-A_000150 CC(C)S(=O)(=O)N[C@H]1CCN(Cc2ccc(OCCO)cc2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 J24 mock treatment 685277.7778 -14500.0 -0.07 604855.2036 -68600.0 -0.36 -0.3044 -0.823 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K01 compound treatment 678325.9669 -21400.0 -0.1 654990.991 -18500.0 -0.1 -0.1391 -1.0 3237445 Sulf1.1-A_000151 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3cc(Cl)ccc3Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K02 compound treatment 743820.5128 44100.0 0.2 696127.6596 22700.0 0.12 0.2288 0.9686 3237164 Sulf1.1-A_000152 OCCOc1cccc(CN2CCC(CN3C(=O)c4ccccc4C3=O)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K03 compound treatment 802791.8367 103000.0 0.48 949945.4545 276000.0 1.47 1.373 0.8907 3237239 Sulf1.1-A_000153 Cc1nc(cn1C)S(=O)(=O)NCC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K04 compound treatment 528715.0259 -171000.0 -0.79 619451.4286 -54000.0 -0.29 -0.7602 -0.906 3237465 Sulf1.1-A_000154 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccc4ccccc4c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K05 compound treatment 613684.6847 -86000.0 -0.4 656808.4112 -16600.0 -0.09 -0.343 -0.8438 3237233 Sulf1.1-A_000155 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3ccc(cc3)c4ccccc4)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K06 compound treatment 810693.6937 111000.0 0.51 641097.7778 -32400.0 -0.17 0.2405 0.4455 3237201 Sulf1.1-A_000156 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccc(Cl)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K07 mock treatment 665136.5854 -34600.0 -0.16 714901.2876 41400.0 0.22 0.0426 0.1569 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K08 mock treatment 781900.7353 82200.0 0.38 784047.619 111000.0 0.59 0.6827 0.9776 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K09 compound treatment 521375.0 -178000.0 -0.82 532323.6994 -141000.0 -0.75 -1.1109 -0.9989 3237297 Sulf1.1-A_000157 Cc1ccccc1S(=O)(=O)N[C@@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K10 compound treatment 683511.7188 -16200.0 -0.07 655507.5758 -18000.0 -0.1 -0.1202 -0.9929 3237183 Sulf1.1-A_000158 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3cccc4cccnc34)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K11 compound treatment 644816.1435 -54900.0 -0.25 557327.957 -116000.0 -0.62 -0.6146 -0.9229 3237171 Sulf1.1-A_000159 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccc(Cl)cc3)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K12 compound treatment 578314.2857 -121000.0 -0.56 559195.9799 -114000.0 -0.61 -0.8245 -0.9992 3237418 Sulf1.1-A_000160 CC(C)S(=O)(=O)N[C@H]1CCN(Cc2cccc(OCCO)c2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K13 compound treatment 596738.2813 -103000.0 -0.47 632939.3939 -40500.0 -0.21 -0.4878 -0.9357 3237386 Sulf1.1-A_000161 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3cccc4cccnc34)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K14 compound treatment 567731.9588 -132000.0 -0.61 578730.4965 -94700.0 -0.5 -0.7857 -0.9955 3237261 Sulf1.1-A_000162 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccc(Cl)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K15 mock treatment 640855.4688 -58900.0 -0.27 642345.0 -31100.0 -0.17 -0.3087 -0.9715 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K16 mock treatment 749858.2375 50100.0 0.23 686974.9104 13500.0 0.07 0.2141 0.8848 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K17 compound treatment 582161.2903 -118000.0 -0.54 663324.8731 -10100.0 -0.05 -0.4214 -0.7734 3237223 Sulf1.1-A_000163 CC(C)S(=O)(=O)N[C@@H]1CCCN(Cc2ccc(OCCO)cc2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K18 compound treatment 660179.2453 -39600.0 -0.18 552010.1351 -121000.0 -0.64 -0.5845 -0.873 3237441 Sulf1.1-A_000164 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K19 compound treatment 550417.4757 -149000.0 -0.69 519731.4286 -154000.0 -0.82 -1.0635 -0.9965 3237400 Sulf1.1-A_000165 Cc1ccc(F)cc1S(=O)(=O)N[C@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K20 compound treatment 662858.6387 -36900.0 -0.17 614155.914 -59300.0 -0.31 -0.3427 -0.9583 3237398 Sulf1.1-A_000166 COc1ccc(cc1)S(=O)(=O)N[C@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K21 compound treatment 600980.315 -98800.0 -0.46 566662.7907 -107000.0 -0.57 -0.7226 -0.9941 3237299 Sulf1.1-A_000167 Cc1nc(cn1C)S(=O)(=O)N[C@@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K22 compound treatment 820336.2832 121000.0 0.56 689991.1504 16500.0 0.09 0.4553 0.8086 3237277 Sulf1.1-A_000168 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccc4ccccc4c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K23 mock treatment 646233.945 -53500.0 -0.25 682651.3761 9190.0 0.05 -0.14 -0.5566 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 K24 mock treatment 670241.2281 -29500.0 -0.14 583975.3086 -89500.0 -0.47 -0.4318 -0.8745 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L01 compound treatment 509794.702 -190000.0 -0.88 818034.6821 145000.0 0.77 -0.0771 -0.0663 3237324 Sulf1.1-A_000169 Cc1nc(cn1C)S(=O)(=O)NC[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L02 mock treatment 829658.0087 130000.0 0.6 749067.6329 75600.0 0.4 0.7072 0.9809 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L03 compound treatment 803117.9039 103000.0 0.48 773831.5217 100000.0 0.53 0.7136 0.9985 3237179 Sulf1.1-A_000170 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3cc(Cl)ccc3Cl)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L04 mock treatment 746905.0 47200.0 0.22 822265.1163 149000.0 0.79 0.7119 0.8696 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L05 compound treatment 592788.2353 -107000.0 -0.49 613976.7442 -59500.0 -0.32 -0.5718 -0.9767 3237242 Sulf1.1-A_000171 Cc1ccc(cc1)S(=O)(=O)NCC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L06 mock treatment 913538.1526 214000.0 0.99 758129.4118 84700.0 0.45 1.0148 0.9366 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L07 mock treatment 692004.6729 -7730.0 -0.04 789617.4242 116000.0 0.62 0.4105 0.6651 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L08 mock treatment 716144.0329 16400.0 0.08 861090.9091 188000.0 1.0 0.7572 0.7587 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L09 compound treatment 581118.3432 -119000.0 -0.55 657791.2621 -15700.0 -0.08 -0.4456 -0.8053 3237293 Sulf1.1-A_000172 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccc(cc3)c4ccccc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L10 mock treatment 686853.3333 -12900.0 -0.06 662334.8018 -11100.0 -0.06 -0.0837 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L11 compound treatment 622622.3404 -77100.0 -0.36 550704.7619 -123000.0 -0.65 -0.7118 -0.9595 3237255 Sulf1.1-A_000173 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3cccc(F)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L12 mock treatment 751290.5983 51600.0 0.24 633793.5223 -39700.0 -0.21 0.0194 0.061 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L13 compound treatment 850270.936 151000.0 0.69 740180.4124 66700.0 0.35 0.7411 0.9511 3237296 Sulf1.1-A_000174 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3cccc4cccnc34)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L14 mock treatment 680995.9016 -18700.0 -0.09 611309.2784 -62100.0 -0.33 -0.2942 -0.8633 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L15 mock treatment 693710.9005 -6020.0 -0.03 632561.753 -40900.0 -0.22 -0.173 -0.7912 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L16 mock treatment 594783.6879 -105000.0 -0.48 592769.8113 -80700.0 -0.43 -0.6449 -0.9981 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L17 compound treatment 689046.8085 -10700.0 -0.05 622389.6104 -51100.0 -0.27 -0.2264 -0.8223 3237338 Sulf1.1-A_000175 COc1ccc(cc1)S(=O)(=O)N[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L18 mock treatment 677154.7619 -22600.0 -0.1 577839.2283 -95600.0 -0.51 -0.4322 -0.8349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L19 compound treatment 554747.6038 -145000.0 -0.67 555453.7815 -118000.0 -0.63 -0.9154 -0.9995 3237459 Sulf1.1-A_000176 Cc1ccc(F)cc1S(=O)(=O)N2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L20 mock treatment 568639.4052 -131000.0 -0.6 613804.7619 -59700.0 -0.32 -0.6512 -0.9544 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L21 compound treatment 581826.3473 -118000.0 -0.54 568338.0952 -105000.0 -0.56 -0.7787 -0.9999 3237267 Sulf1.1-A_000177 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccc(cc3)c4ccccc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L22 mock treatment 565905.5944 -134000.0 -0.62 684452.459 11000.0 0.06 -0.3952 -0.6375 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L23 mock treatment 630360.8696 -69400.0 -0.32 569280.1556 -104000.0 -0.55 -0.6169 -0.9662 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 L24 mock treatment 624104.0 -75600.0 -0.35 522851.5901 -151000.0 -0.8 -0.8115 -0.931 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M01 compound treatment 588934.3434 -111000.0 -0.51 606154.5455 -67300.0 -0.36 -0.6137 -0.9846 3237244 Sulf1.1-A_000178 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M02 compound treatment 629640.4494 -70100.0 -0.32 539160.221 -134000.0 -0.71 -0.7322 -0.9361 3237308 Sulf1.1-A_000179 COc1ccc(cc1)S(=O)(=O)NC[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M03 compound treatment 680904.1667 -18800.0 -0.09 698859.1549 25400.0 0.13 0.0339 0.2113 3237252 Sulf1.1-A_000180 Cc1ccccc1S(=O)(=O)NC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M04 compound treatment 686483.871 -13200.0 -0.06 647975.6098 -25500.0 -0.14 -0.1388 -0.9356 3237470 Sulf1.1-A_000181 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M05 compound treatment 813364.4444 114000.0 0.52 814844.2211 141000.0 0.75 0.9008 0.9846 3237431 Sulf1.1-A_000182 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3cccc4cccnc34)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M06 compound treatment 628165.9919 -71600.0 -0.33 659099.1379 -14400.0 -0.08 -0.2872 -0.848 3237350 Sulf1.1-A_000183 Cc1ccccc1S(=O)(=O)N[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M07 compound treatment 610577.6699 -89200.0 -0.41 806474.8858 133000.0 0.71 0.2081 0.2549 3237259 Sulf1.1-A_000184 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M08 compound treatment 482696.6825 -217000.0 -1.0 526909.0909 -147000.0 -0.78 -1.2574 -0.9922 3237378 Sulf1.1-A_000185 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M09 mock treatment 760823.0769 61100.0 0.28 636205.0209 -37300.0 -0.2 0.0595 0.1729 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M10 mock treatment 729401.6736 29700.0 0.14 701130.0813 27700.0 0.15 0.2005 0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M11 compound treatment 588544.9438 -111000.0 -0.51 671810.0 -1650.0 -0.01 -0.3688 -0.7191 3237227 Sulf1.1-A_000186 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M12 compound treatment 658962.963 -40800.0 -0.19 640922.7642 -32500.0 -0.17 -0.255 -0.9991 3237234 Sulf1.1-A_000187 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3cc(Cl)ccc3Cl)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M13 mock treatment 852831.2236 153000.0 0.71 628576.7442 -44900.0 -0.24 0.3309 0.4441 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M14 mock treatment 697290.6977 -2440.0 -0.01 651297.7941 -22200.0 -0.12 -0.0911 -0.7713 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M15 compound treatment 633617.5115 -66100.0 -0.3 577475.0958 -96000.0 -0.51 -0.5756 -0.9699 3237462 Sulf1.1-A_000188 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccc(Cl)c(Cl)c3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M16 compound treatment 571392.2652 -128000.0 -0.59 630828.5714 -42600.0 -0.23 -0.5784 -0.9129 3237169 Sulf1.1-A_000189 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccccc3)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M17 compound treatment 551477.4775 -148000.0 -0.68 501787.234 -172000.0 -0.91 -1.1273 -0.99 3237377 Sulf1.1-A_000190 Cc1ccc(cc1)S(=O)(=O)NCC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M18 compound treatment 660047.8088 -39700.0 -0.18 688851.6746 15400.0 0.08 -0.0717 -0.3577 3237217 Sulf1.1-A_000191 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccc4ccccc4c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M19 compound treatment 587457.7114 -112000.0 -0.52 553036.8664 -120000.0 -0.64 -0.8178 -0.9946 3237291 Sulf1.1-A_000192 COc1ccc(cc1)S(=O)(=O)N[C@@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M20 compound treatment 518376.0331 -181000.0 -0.84 522745.5357 -151000.0 -0.8 -1.1566 -0.9997 3237442 Sulf1.1-A_000193 COc1ccc(cc1)S(=O)(=O)N2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M21 compound treatment 571646.2882 -128000.0 -0.59 573684.6154 -99800.0 -0.53 -0.7919 -0.9985 3237302 Sulf1.1-A_000194 Cc1ccc(cc1)S(=O)(=O)N[C@@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M22 compound treatment 600455.516 -99300.0 -0.46 553415.7303 -120000.0 -0.64 -0.774 -0.9869 3237370 Sulf1.1-A_000195 OCCOc1cccc(CN2CCC(CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)CC2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M23 compound treatment 560915.7088 -139000.0 -0.64 512052.0446 -161000.0 -0.86 -1.058 -0.9897 3237303 Sulf1.1-A_000196 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3cc(ccc3Cl)C(F)(F)F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 M24 compound treatment 531975.2066 -168000.0 -0.77 445748.2517 -228000.0 -1.21 -1.4011 -0.9768 3237229 Sulf1.1-A_000197 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3ccccc3)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N01 compound treatment 679590.3084 -20100.0 -0.09 743850.4673 70400.0 0.37 0.1983 0.5155 3237387 Sulf1.1-A_000198 Cc1ccccc1S(=O)(=O)NC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N02 mock treatment 778248.7562 78500.0 0.36 823058.296 150000.0 0.79 0.8171 0.9368 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N03 compound treatment 673207.9208 -26500.0 -0.12 688124.4444 14700.0 0.08 -0.0315 -0.2172 3237207 Sulf1.1-A_000199 OCCOc1ccc(CN2CCC[C@H](C2)NS(=O)(=O)c3ccc(cc3)c4ccccc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N04 mock treatment 854103.2028 154000.0 0.71 1292985.612 620000.0 3.29 2.8269 0.8408 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N05 compound treatment 709849.5935 10100.0 0.05 683579.7101 10100.0 0.05 0.0709 0.9976 3237249 Sulf1.1-A_000200 OCCOc1ccc(CN2CCC(CC2)NS(=O)(=O)c3cc(Cl)ccc3Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N06 mock treatment 718030.4348 18300.0 0.08 701962.7907 28500.0 0.15 0.1666 0.9621 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N07 compound treatment 789385.4167 89700.0 0.41 634803.1915 -38700.0 -0.21 0.1474 0.3193 3237236 Sulf1.1-A_000201 OCCOc1ccc(CN2CCC(CNS(=O)(=O)c3cccc4cccnc34)CC2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N08 mock treatment 708336.3636 8600.0 0.04 746995.1456 73500.0 0.39 0.3039 0.775 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N09 mock treatment 745204.6332 45500.0 0.21 632057.9151 -41400.0 -0.22 -0.007 -0.023 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N10 mock treatment 677886.0759 -21800.0 -0.1 742342.4658 68900.0 0.37 0.1871 0.4937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N11 mock treatment 666852.8139 -32900.0 -0.15 659304.3478 -14200.0 -0.08 -0.1603 -0.9474 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N12 mock treatment 721185.022 21500.0 0.1 676553.7849 3100.0 0.02 0.0816 0.8133 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N13 mock treatment 624775.9336 -75000.0 -0.35 660683.9378 -12800.0 -0.07 -0.2923 -0.8299 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N14 mock treatment 699070.5394 -663.0 0.0 665349.345 -8110.0 -0.04 -0.0326 -0.7555 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N15 mock treatment 605554.6875 -94200.0 -0.43 628160.1563 -45300.0 -0.24 -0.477 -0.961 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N16 mock treatment 670162.6984 -29600.0 -0.14 571804.9793 -102000.0 -0.54 -0.4777 -0.8589 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N17 mock treatment 540026.7559 -160000.0 -0.74 632007.9365 -41400.0 -0.22 -0.6762 -0.8798 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N18 mock treatment 684942.6523 -14800.0 -0.07 628124.031 -45300.0 -0.24 -0.2183 -0.8732 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N19 mock treatment 717966.0377 18200.0 0.08 590904.5802 -82600.0 -0.44 -0.2502 -0.5611 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N20 mock treatment 614195.4545 -85500.0 -0.39 585345.5285 -88100.0 -0.47 -0.6094 -0.9964 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N21 mock treatment 542665.5172 -157000.0 -0.72 564643.1718 -109000.0 -0.58 -0.9203 -0.9937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N22 mock treatment 611322.9167 -88400.0 -0.41 520652.1739 -153000.0 -0.81 -0.8614 -0.9495 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N23 mock treatment 579660.6335 -120000.0 -0.55 504507.1429 -169000.0 -0.9 -1.0252 -0.9732 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 N24 mock treatment 543575.6303 -156000.0 -0.72 533453.2374 -140000.0 -0.74 -1.0343 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O01 compound treatment 614973.0942 -84800.0 -0.39 618647.8261 -54800.0 -0.29 -0.482 -0.9894 3237273 Sulf1.1-A_000202 OCCOc1ccc(CN2CC[C@@H](C2)NS(=O)(=O)c3cccc4cccnc34)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O02 compound treatment 570166.0079 -130000.0 -0.6 632711.0092 -40700.0 -0.22 -0.5753 -0.9055 3237426 Sulf1.1-A_000203 COc1ccc(cc1)S(=O)(=O)N[C@@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O03 compound treatment 641255.5066 -58500.0 -0.27 694965.9574 21500.0 0.11 -0.11 -0.3758 3237429 Sulf1.1-A_000204 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3cc(Cl)ccc3Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O04 compound treatment 674504.065 -25200.0 -0.12 679271.5517 5810.0 0.03 -0.0605 -0.5024 3237432 Sulf1.1-A_000205 Cc1ccccc1S(=O)(=O)N[C@@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O05 compound treatment 623572.0339 -76200.0 -0.35 729882.0961 56400.0 0.3 -0.0367 -0.0796 3237425 Sulf1.1-A_000206 OCCOc1cccc(CN2CC[C@H](C2)NS(=O)(=O)c3ccc(Cl)cc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O06 compound treatment 616871.1111 -82900.0 -0.38 554734.0426 -119000.0 -0.63 -0.7155 -0.9713 3237304 Sulf1.1-A_000207 OCCOc1cccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccccc3)C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O07 compound treatment 550479.798 -149000.0 -0.69 633310.6383 -40100.0 -0.21 -0.6373 -0.8845 3237232 Sulf1.1-A_000208 Cc1ccc(F)cc1S(=O)(=O)NCC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O08 compound treatment 530878.1513 -169000.0 -0.78 527914.4385 -146000.0 -0.77 -1.0965 -1.0 3237328 Sulf1.1-A_000209 CC(C)S(=O)(=O)NC[C@@H]1CCCN(Cc2cccc(OCCO)c2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O09 compound treatment 518816.4251 -181000.0 -0.83 544719.8068 -129000.0 -0.68 -1.0728 -0.9951 3237366 Sulf1.1-A_000210 COc1ccc(cc1)S(=O)(=O)NCC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O10 compound treatment 633985.5072 -65700.0 -0.3 674589.4737 1130.0 0.01 -0.2102 -0.693 3237292 Sulf1.1-A_000211 Cc1ccc(F)cc1S(=O)(=O)N[C@@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O11 mock treatment 618281.8182 -81500.0 -0.38 653004.8077 -20500.0 -0.11 -0.3423 -0.8755 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O12 mock treatment 701062.5 1330.0 0.01 686254.4643 12800.0 0.07 0.0523 0.7678 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O13 compound treatment 596480.0 -103000.0 -0.48 569298.5075 -104000.0 -0.55 -0.7273 -0.9973 3237389 Sulf1.1-A_000212 Cc1nc(cn1C)S(=O)(=O)NC2CCN(Cc3cccc(OCCO)c3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O14 compound treatment 490800.8299 -209000.0 -0.96 504871.6578 -169000.0 -0.89 -1.3136 -0.9993 3237457 Sulf1.1-A_000213 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3ccc(Cl)cc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O15 compound treatment 588524.0385 -111000.0 -0.51 539718.0851 -134000.0 -0.71 -0.8642 -0.9873 3237181 Sulf1.1-A_000214 OCCOc1ccc(CN2CCC[C@@H](CNS(=O)(=O)c3ccc(Cl)c(Cl)c3)C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O16 compound treatment 338901.7857 -361000.0 -1.66 349754.386 -324000.0 -1.72 -2.3907 -0.9999 3237310 Sulf1.1-A_000215 Cc1ccc(F)cc1S(=O)(=O)NC[C@@H]2CCCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O17 compound treatment 509324.1758 -190000.0 -0.88 493636.8421 -180000.0 -0.95 -1.2953 -0.9991 3237451 Sulf1.1-A_000216 OCCOc1ccc(CN2CCN(CC2)S(=O)(=O)c3cccc(F)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O18 compound treatment 561107.1429 -139000.0 -0.64 518038.4615 -155000.0 -0.82 -1.0349 -0.9921 3237434 Sulf1.1-A_000217 Cc1nc(cn1C)S(=O)(=O)N[C@@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O19 compound treatment 611434.1463 -88300.0 -0.41 708213.9303 34800.0 0.18 -0.1576 -0.3525 3237263 Sulf1.1-A_000218 COc1ccc(cc1)S(=O)(=O)N[C@H]2CCN(Cc3ccc(OCCO)cc3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O20 compound treatment 582669.7248 -117000.0 -0.54 519977.2727 -153000.0 -0.81 -0.9574 -0.9801 3237300 Sulf1.1-A_000219 OCCOc1ccc(CN2CC[C@H](C2)NS(=O)(=O)c3cccc(F)c3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O21 compound treatment 564052.6316 -136000.0 -0.63 484223.4043 -189000.0 -1.0 -1.1522 -0.9741 3237461 Sulf1.1-A_000220 OCCOc1cccc(CN2CCN(CC2)S(=O)(=O)c3cc(Cl)ccc3Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O22 compound treatment 509868.7783 -190000.0 -0.88 493627.3585 -180000.0 -0.95 -1.2936 -0.9991 3237237 Sulf1.1-A_000221 Cc1ccccc1S(=O)(=O)NCC2CCN(Cc3ccc(OCCO)cc3)CC2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O23 compound treatment 348471.5447 -351000.0 -1.62 411617.8344 -262000.0 -1.39 -2.1275 -0.9971 3237384 Sulf1.1-A_000222 OCCOc1cccc(CN2CCC(CC2)NS(=O)(=O)c3cc(Cl)ccc3Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 O24 compound treatment 493656.4885 -206000.0 -0.95 499713.1148 -174000.0 -0.92 -1.3236 -0.9999 3237414 Sulf1.1-A_000223 Cc1nc(cn1C)S(=O)(=O)N[C@H]2CCN(Cc3cccc(OCCO)c3)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P01 mock treatment 605072.9167 -94700.0 -0.44 590509.901 -82900.0 -0.44 -0.6198 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P02 mock treatment 704522.1239 4790.0 0.02 586155.3398 -87300.0 -0.46 -0.3118 -0.6726 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P03 mock treatment 660987.395 -38700.0 -0.18 660666.6667 -12800.0 -0.07 -0.1743 -0.9121 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P04 mock treatment 655810.8108 -43900.0 -0.2 659145.9227 -14300.0 -0.08 -0.1969 -0.9103 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P05 mock treatment 678008.6207 -21700.0 -0.1 640787.8788 -32700.0 -0.17 -0.1934 -0.9661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P06 mock treatment 637934.8837 -61800.0 -0.28 641547.8261 -31900.0 -0.17 -0.3212 -0.969 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P07 mock treatment 633434.9776 -66300.0 -0.31 619142.1569 -54300.0 -0.29 -0.4199 -0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P08 mock treatment 675707.4236 -24000.0 -0.11 599809.2784 -73600.0 -0.39 -0.3546 -0.8732 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P09 mock treatment 600459.2275 -99300.0 -0.46 638724.6964 -34700.0 -0.18 -0.454 -0.92 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P10 mock treatment 589995.6522 -110000.0 -0.51 613615.7205 -59800.0 -0.32 -0.5823 -0.9747 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P11 mock treatment 618986.7841 -80700.0 -0.37 605440.1914 -68000.0 -0.36 -0.5184 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P12 mock treatment 602022.1239 -97700.0 -0.45 678271.8894 4810.0 0.03 -0.3006 -0.666 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P13 mock treatment 533556.8182 -166000.0 -0.77 574954.7511 -98500.0 -0.52 -0.9113 -0.9826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P14 mock treatment 616096.2343 -83600.0 -0.39 633336.4929 -40100.0 -0.21 -0.4232 -0.9607 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P15 mock treatment 608267.6056 -91500.0 -0.42 499680.3279 -174000.0 -0.92 -0.95 -0.9372 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P16 mock treatment 572310.5023 -127000.0 -0.59 549258.0645 -124000.0 -0.66 -0.8813 -0.9984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P17 mock treatment 612100.0 -87600.0 -0.4 489792.9688 -184000.0 -0.97 -0.9746 -0.9241 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P18 mock treatment 550281.106 -149000.0 -0.69 534527.0758 -139000.0 -0.74 -1.0084 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P19 mock treatment 485044.8276 -215000.0 -0.99 482982.0144 -190000.0 -1.01 -1.4145 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P20 mock treatment 553963.1148 -146000.0 -0.67 492468.75 -181000.0 -0.96 -1.1541 -0.9848 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P21 mock treatment 481393.2584 -218000.0 -1.01 421470.5882 -252000.0 -1.34 -1.6571 -0.9903 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P22 mock treatment 508845.6376 -191000.0 -0.88 424893.4708 -249000.0 -1.32 -1.5547 -0.9807 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P23 mock treatment 517486.59 -182000.0 -0.84 447274.0214 -226000.0 -1.2 -1.4426 -0.9848 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2168 P24 mock treatment 520276.4977 -179000.0 -0.83 495490.7407 -178000.0 -0.94 -1.2527 -0.9979 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A01 mock treatment 602466.3462 -70400.0 -0.32 549933.3333 -123000.0 -0.65 -0.6915 -0.948 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A02 compound treatment 647408.8398 -25500.0 -0.12 479866.3102 -193000.0 -1.02 -0.8078 -0.7831 3555546 CMLD3_000001 COc1ccc2O[C@@H]([C@@H](OC(=O)Nc3cc(OC)c(OC)c(OC)c3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A03 mock treatment 778487.6847 106000.0 0.49 734788.0184 61700.0 0.33 0.5757 0.9813 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A04 compound treatment 612695.6522 -60200.0 -0.28 626816.3265 -46300.0 -0.25 -0.3698 -0.9981 3555566 CMLD3_000002 COc1ccc2C(=O)[C@@H](OC(=O)NCCOc3ccccc3)[C@@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A05 compound treatment 647153.11 -25700.0 -0.12 673241.8605 154.0 0.0 -0.0834 -0.7022 3555570 CMLD3_000003 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C[C@H]2OC(=O)NS(=O)(=O)c4ccc(C)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A06 compound treatment 736120.7729 63200.0 0.29 630685.446 -42400.0 -0.22 0.0472 0.1281 3555574 CMLD3_000004 COc1ccc2O[C@H]([C@H](O)C(=O)c2c1)c3ccc(OC)c(Br)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A07 mock treatment 719618.6047 46700.0 0.22 627253.7313 -45800.0 -0.24 -0.0195 -0.0601 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A08 compound treatment 610055.8659 -62800.0 -0.29 620989.7959 -52100.0 -0.28 -0.4003 -0.9997 3555579 CMLD3_000005 COc1ccc2O[C@H]([C@H](OC(=O)NCCOc3ccccc3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A09 compound treatment 670631.2849 -2260.0 -0.01 646709.0909 -26400.0 -0.14 -0.1063 -0.7577 3555584 CMLD3_000006 Brc1ccc2O[C@H]([C@H](OC(=O)NCc3ccc4OCOc4c3)C(=O)c2c1)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A10 compound treatment 484312.7753 -189000.0 -0.87 532320.9302 -141000.0 -0.75 -1.1429 -0.9971 3555589 CMLD3_000007 COC(=O)[C@H](COC(C)(C)C)NC(=O)O[C@@H]1Cc2cc(Br)ccc2O[C@H]1c3cccc(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A11 mock treatment 688068.9655 15200.0 0.07 628421.8009 -44700.0 -0.24 -0.118 -0.4778 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A12 compound treatment 621189.7436 -51700.0 -0.24 636379.3103 -36700.0 -0.19 -0.3063 -0.9949 3555594 CMLD3_000008 COC(=O)[C@H](COC(C)(C)C)NC(=O)O[C@@H]1[C@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A13 mock treatment 770568.4211 97700.0 0.45 682695.4315 9610.0 0.05 0.3545 0.7821 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A14 mock treatment 732900.0 60000.0 0.28 643040.0 -30000.0 -0.16 0.083 0.2599 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A15 compound treatment 759383.4197 86500.0 0.4 668041.0256 -5050.0 -0.03 0.2631 0.6582 3555598 CMLD3_000009 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)OCC)c2cc(C)cc(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A16 compound treatment 780308.9431 107000.0 0.5 837427.4194 164000.0 0.87 0.9666 0.9641 3555600 CMLD3_000010 Cc1cc(C)cc(/C=C/[C@H]2OC[C@@H](O)[C@H]2Oc3ccc(cc3)C4CCCC4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A17 compound treatment 141745.098 -531000.0 -2.45 138160.0 -535000.0 -2.84 -3.7383 -0.9973 3555605 CMLD3_000011 COc1ccc(C#C[C@H]2O[C@H](CO)[C@@H](Oc3cc(C)cc(C)c3)C=C2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A18 compound treatment 640113.5135 -32800.0 -0.15 511523.3645 -162000.0 -0.86 -0.7128 -0.8192 3555609 CMLD3_000012 CC(C)(C)OC(=O)C1=NOC2(C1)C=CC(=O)C=C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A19 compound treatment 601854.4601 -71000.0 -0.33 609441.6244 -63600.0 -0.34 -0.4704 -0.9999 3555611 CMLD3_000013 COC(=O)N[C@@H](c1ccccc1)[C@@]2(CCCC2=O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A20 compound treatment 660828.125 -12100.0 -0.06 582700.0 -90400.0 -0.48 -0.3783 -0.7839 3555615 CMLD3_000014 CCCCCCCC#Cc1ccccc1C(NC(=O)OC)C(C(=O)OC)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A21 compound treatment 796816.7539 124000.0 0.57 635645.5026 -37400.0 -0.2 0.2637 0.4358 3555617 CMLD3_000015 CC(C)(C)OC1C2C3C2C4C1C3CC=CC4(O)CC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A22 compound treatment 646155.2511 -26700.0 -0.12 687274.3363 14200.0 0.08 -0.034 -0.2352 3555619 CMLD3_000016 COCn1c2ccccc2c3nnc(nc13)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A23 compound treatment 669418.9189 -3470.0 -0.02 641477.6786 -31600.0 -0.17 -0.1299 -0.7711 3555621 CMLD3_000017 COC(=O)N[C@H](/C(=C(\C)/NCc1ccccc1)/C(=O)OC)c2cccs2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 A24 compound treatment 720140.7767 47200.0 0.22 594233.5025 -78900.0 -0.42 -0.1417 -0.3004 3555626 CMLD3_000018 CC(=CCC/C(=C/C=C/C1=CC2(C)CC1(C)C(CC2=O)\C=C(/C)\CCC=C(C)C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B01 compound treatment 616766.9173 -56100.0 -0.26 589508.1967 -83600.0 -0.44 -0.4965 -0.9672 3555630 CMLD3_000019 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C[C@H]2OC(=O)NS(=O)(=O)c4ccc(C)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B02 compound treatment 567671.6418 -105000.0 -0.49 565683.7209 -107000.0 -0.57 -0.7459 -0.9968 3555635 CMLD3_000020 COc1ccc2C(=O)[C@H](OC(=O)Nc3cc(OC)c(OC)c(OC)c3)[C@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B03 compound treatment 667063.8298 -5830.0 -0.03 698320.0 25200.0 0.13 0.0756 0.5541 3555639 CMLD3_000021 COc1ccc2C(=O)[C@@H](OC(=O)Nc3ccc(OC(F)F)cc3)[C@@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B04 compound treatment 527890.4762 -145000.0 -0.67 608403.7559 -64700.0 -0.34 -0.7154 -0.9519 3555643 CMLD3_000022 COc1ccc2C(=O)[C@@H](OC(=O)N[C@H]3CCCc4ccccc34)[C@@H](Oc2c1)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B05 compound treatment 848628.1407 176000.0 0.81 878177.3399 205000.0 1.09 1.3422 0.9895 3555647 CMLD3_000023 COc1ccc2C(=O)[C@@H](O)[C@@H](Oc2c1)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B06 compound treatment 764885.5721 92000.0 0.42 803345.4545 130000.0 0.69 0.7885 0.9726 3555651 CMLD3_000024 COc1ccc2C(=O)[C@H](O)[C@H](Oc2c1)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B07 compound treatment 891675.6757 219000.0 1.01 873307.2917 200000.0 1.06 1.4644 0.9997 3555653 CMLD3_000025 CCOC(=O)CNC(=O)O[C@H]1[C@@H](Oc2ccc(Br)cc2C1=O)c3cccc(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B08 compound treatment 619402.7778 -53500.0 -0.25 660376.1905 -12700.0 -0.07 -0.2221 -0.8685 3555657 CMLD3_000026 COc1ccc2C(=O)[C@H](OC(=O)N[C@H]3CCCc4ccccc34)[C@H](Oc2c1)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B09 compound treatment 590944.1341 -81900.0 -0.38 776605.5556 104000.0 0.55 0.121 0.1816 3555659 CMLD3_000027 COc1ccc2C(=O)[C@H](OC(=O)N[C@H](C)C3CCCCC3)[C@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B10 compound treatment 627647.8873 -45200.0 -0.21 647889.4472 -25200.0 -0.13 -0.242 -0.9768 3555663 CMLD3_000028 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B11 compound treatment 561290.8163 -112000.0 -0.51 615865.4709 -57200.0 -0.3 -0.5785 -0.9683 3555666 CMLD3_000029 COc1ccc2O[C@H]([C@H](OC(=O)Nc3ccc(C)c(Br)c3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B12 compound treatment 636365.8537 -36500.0 -0.17 569623.1884 -103000.0 -0.55 -0.5071 -0.8835 3555670 CMLD3_000030 COc1ccc2C(=O)[C@H](OC(=O)NCCOc3ccccc3)[C@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B13 mock treatment 712675.0 39800.0 0.18 671668.4783 -1420.0 -0.01 0.1244 0.6775 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B14 mock treatment 798781.25 126000.0 0.58 721975.9615 48900.0 0.26 0.5939 0.934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B15 compound treatment 556193.2367 -117000.0 -0.54 558880.4348 -114000.0 -0.61 -0.8089 -0.9983 3555672 CMLD3_000031 CC(=O)c1ccc(cc1)[C@H]2O[C@H](CO)[C@@H](Oc3ccc(cc3)c4ccccc4)C=C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B16 compound treatment 528613.3333 -144000.0 -0.67 526569.8324 -147000.0 -0.78 -1.02 -0.997 3555676 CMLD3_000032 CC(C)(C)c1ccc(O[C@@H]2[C@H](O)CO[C@H]2/C=C/C#Cc3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B17 compound treatment 139338.9831 -534000.0 -2.46 173745.7627 -499000.0 -2.65 -3.6126 -0.9993 3555680 CMLD3_000033 CC(=O)c1ccc(O[C@H]2C=C[C@H](O[C@@H]2CO)C#Cc3ccc(Br)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B18 compound treatment 742578.4314 69700.0 0.32 714626.8657 41500.0 0.22 0.383 0.983 3555686 CMLD3_000034 COc1ccc(/C=C/C2=CC3(C)CC2(C)C(CC3=O)c4ccc(OC)cc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B19 compound treatment 775598.2533 103000.0 0.47 741311.2245 68200.0 0.36 0.5908 0.9912 3555689 CMLD3_000035 COC(=O)N[C@H](CC(=O)C)c1ccc2OCOc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B20 mock treatment 665652.968 -7240.0 -0.03 672778.3505 -310.0 0.0 -0.0248 -0.741 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B21 compound treatment 689818.1818 16900.0 0.08 665346.8468 -7740.0 -0.04 0.0262 0.2966 3555694 CMLD3_000036 COCO[C@@H]1[C@@H](C)C(=O)N2[C@@H]1[C@@H](Oc3ccc(OC)cc23)/C=C/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B22 compound treatment 604854.5455 -68000.0 -0.31 633318.1818 -39800.0 -0.21 -0.371 -0.9813 3555700 CMLD3_000037 C[C@@H]1C=CCCO[C@H]1c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B23 compound treatment 675637.3057 2750.0 0.01 536379.1469 -137000.0 -0.73 -0.5038 -0.6946 3555703 CMLD3_000038 CCCCCCCC#Cc1ccccc1/C=N/S(=O)c2ccc(C)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 B24 compound treatment 700567.6856 27700.0 0.13 682318.6275 9230.0 0.05 0.1249 0.9134 3555707 CMLD3_000039 COc1ccc(/C=C/N(CCc2ccc(OC)c(OC)c2)C(=O)c3ccccn3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C01 compound treatment 627628.7129 -45300.0 -0.21 519227.4882 -154000.0 -0.82 -0.7246 -0.8603 3555711 CMLD3_000040 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C02 compound treatment 697288.4615 24400.0 0.11 688578.7037 15500.0 0.08 0.1377 0.9881 3555810 CMLD3_000041 COc1ccc2C(=O)[C@@H](OC(=O)NCCc3ccc(OC)c(OC)c3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C03 compound treatment 724678.2178 51800.0 0.24 687024.1546 13900.0 0.07 0.2211 0.8846 3555814 CMLD3_000042 CCOC(=O)CNC(=O)O[C@@H]1[C@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C04 compound treatment 639854.0541 -33000.0 -0.15 558356.7568 -115000.0 -0.61 -0.538 -0.8577 3555817 CMLD3_000043 COC(=O)[C@H](Cc1ccccc1)NC(=O)O[C@@H]2[C@H](Oc3ccc(OC)cc3C2=O)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C05 compound treatment 755482.3009 82600.0 0.38 762524.8869 89400.0 0.47 0.6048 0.9941 3555820 CMLD3_000044 COc1ccc2O[C@@H]([C@@H](OC(=O)NS(=O)(=O)c3ccc(F)cc3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C06 compound treatment 734738.8889 61800.0 0.29 769964.8241 96900.0 0.51 0.565 0.9614 3555823 CMLD3_000045 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C[C@H]2OC(=O)Nc4ccc(C)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C07 compound treatment 758087.4317 85200.0 0.39 953769.6335 281000.0 1.49 1.3305 0.8641 3555825 CMLD3_000046 CCOC(=O)CNC(=O)O[C@H]1[C@@H](Oc2ccc(OC)cc2C1=O)c3cccc(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C08 compound treatment 621299.0654 -51600.0 -0.24 703280.543 30200.0 0.16 -0.055 -0.1918 3555829 CMLD3_000047 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)NC4CCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C09 compound treatment 655879.397 -17000.0 -0.08 597446.6019 -75600.0 -0.4 -0.3392 -0.8297 3555833 CMLD3_000048 COC(=O)[C@H](Cc1ccccc1)NC(=O)O[C@@H]2[C@H](Oc3cc(OC)ccc3C2=O)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C10 compound treatment 795005.4348 122000.0 0.56 799181.3472 126000.0 0.67 0.8711 0.9963 3555837 CMLD3_000049 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C[C@H]2OC(=O)NS(=O)(=O)c4ccc(F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C11 mock treatment 750488.8889 77600.0 0.36 822617.801 150000.0 0.79 0.8138 0.9354 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C12 mock treatment 618281.25 -54600.0 -0.25 739517.0732 66400.0 0.35 0.0711 0.1641 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C13 compound treatment 687770.0535 14900.0 0.07 819219.5122 146000.0 0.78 0.5966 0.7667 3555841 CMLD3_000050 COC(=O)[C@H](Cc1ccccc1)NC(=O)O[C@@H]2Cc3cc(OC)ccc3O[C@H]2c4cccc(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C14 compound treatment 614438.0952 -58500.0 -0.27 675763.0332 2670.0 0.01 -0.1806 -0.669 3555844 CMLD3_000051 CC(=O)c1ccc(O[C@H]2C=C[C@H](O[C@@H]2CO)c3ccc(Cl)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C15 mock treatment 590178.5714 -82700.0 -0.38 816890.8297 144000.0 0.76 0.2696 0.3162 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C16 mock treatment 737860.1036 65000.0 0.3 682710.4072 9620.0 0.05 0.2479 0.8158 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C17 compound treatment 624711.2299 -48200.0 -0.22 604582.0896 -68500.0 -0.36 -0.414 -0.9721 3555848 CMLD3_000052 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1Oc2cccc(c2)N(C)C)C#Cc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C18 compound treatment 813350.4673 140000.0 0.65 753675.6757 80600.0 0.43 0.7603 0.9796 3555853 CMLD3_000053 COC(=O)C1(CC2(CCC3C4C5C41)OCCO2)C3C5OCc6ccccc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C19 compound treatment 642418.8482 -30500.0 -0.14 626182.6087 -46900.0 -0.25 -0.2753 -0.9634 3555855 CMLD3_000054 COc1cccc(/C=C/C2=CC3(C)CC2(C)C(CC3=O)c4cccc(OC)c4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C20 compound treatment 676989.5833 4100.0 0.02 700896.3964 27800.0 0.15 0.1177 0.7913 3555859 CMLD3_000055 COC(=O)[C@@H]1[C@H]([C@H]2C(=O)c3c(OC)cc(OC)cc3O[C@@]12c4ccc(OC)cc4)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C21 compound treatment 665803.1088 -7090.0 -0.03 583734.9398 -89400.0 -0.47 -0.3582 -0.7541 831758 CMLD3_000056 Oc1ccc(/C=C/C(=O)c2ccc(O)cc2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C22 compound treatment 740000.0 67100.0 0.31 773027.6498 99900.0 0.53 0.5937 0.9672 3555865 CMLD3_000057 COC(=O)N[C@H](C(C(=O)C)C(=O)OC)c1cccc(C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C23 compound treatment 699861.1111 27000.0 0.12 795834.8624 123000.0 0.65 0.5483 0.8272 3555869 CMLD3_000058 COC(=O)N[C@H](CC(=O)C)c1ccc(F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 C24 compound treatment 857846.5347 185000.0 0.85 713622.1198 40500.0 0.21 0.7551 0.8585 3555873 CMLD3_000059 CCCCCCCC1=CC2=CC(=O)C(C)(O)C(=O)C2=CN1CCCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D01 compound treatment 567183.9623 -106000.0 -0.49 623060.1852 -50000.0 -0.27 -0.5323 -0.9591 3555876 CMLD3_000060 Cc1ccc(cc1)S(=O)(=O)NC(=O)O[C@H]2[C@@H](Oc3ccc(Br)cc3C2=O)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D02 compound treatment 554061.5385 -119000.0 -0.55 730225.0 57100.0 0.3 -0.1732 -0.2766 3555884 CMLD3_000061 COc1ccc2C(=O)[C@@H](OC(=O)NC3CCCC3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D03 compound treatment 550255.102 -123000.0 -0.57 580425.2336 -92700.0 -0.49 -0.7474 -0.9976 3555888 CMLD3_000062 COc1ccc2C(=O)[C@@H](OC(=O)Nc3ccc(C)c(Br)c3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D04 mock treatment 706923.4694 34000.0 0.16 632190.9548 -40900.0 -0.22 -0.0424 -0.1584 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D05 compound treatment 647143.5407 -25700.0 -0.12 688434.7826 15300.0 0.08 -0.0264 -0.1834 3555892 CMLD3_000063 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C[C@H]2OC(=O)N[C@H]4CCCc5ccccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D06 compound treatment 574150.9434 -98700.0 -0.46 662413.0435 -10700.0 -0.06 -0.362 -0.789 3555896 CMLD3_000064 COC(=O)[C@@H](NC(=O)O[C@H]1[C@@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D07 compound treatment 783972.2222 111000.0 0.51 759387.2549 86300.0 0.46 0.6859 0.9984 3555901 CMLD3_000065 COc1ccc2C(=O)[C@@H](OC(=O)NC3CCCC3)[C@@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D08 mock treatment 781372.1973 108000.0 0.5 862796.1165 190000.0 1.01 1.0652 0.948 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D09 compound treatment 565834.1709 -107000.0 -0.49 625790.5759 -47300.0 -0.25 -0.5265 -0.9507 3555905 CMLD3_000066 COc1cc(NC(=O)O[C@H]2[C@@H](Oc3ccc(Br)cc3C2=O)c4ccc5OCOc5c4)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D10 compound treatment 644649.3506 -28200.0 -0.13 615820.6278 -57300.0 -0.3 -0.3069 -0.9285 3555908 CMLD3_000067 COc1ccc2O[C@@H]([C@@H](OC(=O)NS(=O)(=O)c3ccc(C)cc3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D11 mock treatment 809527.0936 137000.0 0.63 703575.3425 30500.0 0.16 0.5599 0.8607 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D12 mock treatment 734060.9137 61200.0 0.28 732459.2275 59400.0 0.31 0.4221 0.9985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D13 mock treatment 841679.7753 169000.0 0.78 814871.2871 142000.0 0.75 1.0822 0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D14 compound treatment 756454.5455 83600.0 0.39 713462.3656 40400.0 0.21 0.4239 0.9616 3555912 CMLD3_000068 CN(C)c1cccc(O[C@H]2C=C[C@H](O[C@@H]2CO)C#Cc3ccccc3)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D15 mock treatment 673040.0 149.0 0.0 665107.6923 -7980.0 -0.04 -0.0294 -0.6955 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D16 mock treatment 769549.5495 96700.0 0.45 692934.2723 19800.0 0.11 0.3896 0.8507 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D17 compound treatment 731716.4179 58800.0 0.27 670646.3415 -2440.0 -0.01 0.1827 0.6726 3555916 CMLD3_000069 OC[C@H]1O[C@@H](C=C[C@@H]1Oc2ccc(C=O)cc2)C#Cc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D18 compound treatment 803445.7143 131000.0 0.6 696471.5909 23400.0 0.12 0.5134 0.8352 3555921 CMLD3_000070 COc1ccccc1/C=C/C2=CC3(C)CC2(C)C(CC3=O)c4ccccc4OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D19 compound treatment 693254.0541 20400.0 0.09 693734.0426 20600.0 0.11 0.1438 0.9971 3555925 CMLD3_000071 CCC/C=C/C1C(CO)C2(OCC(CC)(CC)CO2)[C@@H]3O[C@@H]3C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D20 compound treatment 734194.5701 61300.0 0.28 669819.8529 -3270.0 -0.02 0.1876 0.6625 3555929 CMLD3_000072 COc1ccc(/C=C/N(CCc2ccc(OC)c(OC)c2)C(=O)C(F)(F)F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D21 compound treatment 632918.6047 -40000.0 -0.18 633131.9149 -40000.0 -0.21 -0.2802 -0.9976 3555933 CMLD3_000073 COc1ccc(cc1)C(=O)CC(=O)c2c(O)cc(OC)cc2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D22 compound treatment 683639.2694 10700.0 0.05 579818.1818 -93300.0 -0.49 -0.3148 -0.6331 3555935 CMLD3_000074 COC(=O)N[C@@H](c1ccco1)[C@@]2(CCCC2=O)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D23 mock treatment 655880.7339 -17000.0 -0.08 664767.7725 -8320.0 -0.04 -0.0867 -0.963 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 D24 compound treatment 641751.3228 -31100.0 -0.14 594021.6216 -79100.0 -0.42 -0.3981 -0.898 3555939 CMLD3_000075 COC(=O)N[C@H](C(C(=O)C)C(=O)OC)c1cccc(F)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E01 mock treatment 555865.1685 -117000.0 -0.54 689437.8109 16300.0 0.09 -0.3203 -0.586 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E02 mock treatment 622651.4286 -50200.0 -0.23 776965.5172 104000.0 0.55 0.2258 0.3777 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E03 mock treatment 827112.8205 154000.0 0.71 887617.6471 215000.0 1.14 1.3075 0.9744 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E04 compound treatment 685192.7711 12300.0 0.06 759398.8439 86300.0 0.46 0.3638 0.7887 3555943 CMLD3_000076 CC[C@H](C)[C@@H](NC(=O)O[C@H]1[C@@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E05 compound treatment 855009.4787 182000.0 0.84 732974.4681 59900.0 0.32 0.8185 0.9115 3555945 CMLD3_000077 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)NS(=O)(=O)c4ccc(C)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E06 compound treatment 767071.4286 94200.0 0.43 715883.4951 42800.0 0.23 0.4676 0.9542 3555948 CMLD3_000078 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)NS(=O)(=O)c4ccc(F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E07 compound treatment 670040.404 -2850.0 -0.01 741674.6411 68600.0 0.36 0.2479 0.6811 3555952 CMLD3_000079 COc1ccc2C(=O)[C@@H](OC(=O)N[C@H](C)C3CCCCC3)[C@@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E08 compound treatment 800794.7368 128000.0 0.59 733723.8095 60600.0 0.32 0.6445 0.9593 3555954 CMLD3_000080 COc1ccc2O[C@@H]([C@@H](OC(=O)NCc3ccc4OCOc4c3)C(=O)c2c1)c5ccc(OC)c(Br)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E09 mock treatment 760358.9744 87500.0 0.4 878517.5879 205000.0 1.09 1.0557 0.9086 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E10 mock treatment 712983.4254 40100.0 0.18 770783.5052 97700.0 0.52 0.4971 0.9036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E11 compound treatment 695451.3889 22600.0 0.1 750189.5425 77100.0 0.41 0.3627 0.8596 3555958 CMLD3_000081 Brc1ccc2O[C@H]([C@H](OC(=O)NCc3ccco3)C(=O)c2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E12 compound treatment 676810.9453 3920.0 0.02 694593.6073 21500.0 0.11 0.0934 0.8091 3555962 CMLD3_000082 CC[C@H](C)[C@@H](NC(=O)O[C@@H]1[C@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E13 compound treatment 717868.8525 45000.0 0.21 602789.4737 -70300.0 -0.37 -0.117 -0.2742 3555964 CMLD3_000083 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C[C@H]2OC(=O)N[C@H]4CCCc5ccccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E14 compound treatment 730896.3964 58000.0 0.27 625534.8837 -47600.0 -0.25 0.0108 0.0294 3555968 CMLD3_000084 CCOC(=O)OC[C@H]1O[C@H](CCc2ccccc2)CC[C@@H]1Oc3ccc(OC)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E15 compound treatment 142211.5385 -531000.0 -2.45 184470.5882 -489000.0 -2.59 -3.5631 -0.9996 3555972 CMLD3_000085 CC(C)(C)c1ccc(O[C@H]2C=C[C@H](O[C@@H]2CO)C#Cc3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E16 compound treatment 682305.8252 9410.0 0.04 661347.619 -11700.0 -0.06 -0.0133 -0.1756 3555975 CMLD3_000086 CC(C)(C)c1ccc(O[C@@H]2[C@H](O)CO[C@@H]2/C=C/C#Cc3ccccc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E17 mock treatment 723602.1505 50700.0 0.23 895250.0 222000.0 1.18 0.9986 0.8312 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E18 mock treatment 764107.8431 91200.0 0.42 767009.3023 93900.0 0.5 0.6497 0.9965 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E19 compound treatment 711604.0 38700.0 0.18 723176.7956 50100.0 0.27 0.3141 0.9813 3555978 CMLD3_000087 C[C@H](O)CCCCCCC/C=C/C=C/C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E20 compound treatment 667270.1422 -5620.0 -0.03 644380.9524 -28700.0 -0.15 -0.126 -0.8157 3555982 CMLD3_000088 CC1(C)O[C@H]([C@@H](O1)C(O)(c2cccc3c4ccccc4oc23)c5cccc6c7ccccc7oc56)C(O)(c8cccc9c%10ccccc%10oc89)c%11cccc%12c%13ccccc%13oc%11%12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E21 mock treatment 716714.9758 43800.0 0.2 660296.2963 -12800.0 -0.07 0.0949 0.4453 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E22 compound treatment 766304.5685 93400.0 0.43 798028.6885 125000.0 0.66 0.7732 0.9782 3555987 CMLD3_000089 COC(=O)N[C@@H](c1cccc(C)c1)[C@@]2(CCCC2=O)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E23 compound treatment 595984.7716 -76900.0 -0.35 694007.9051 20900.0 0.11 -0.1723 -0.4637 3555990 CMLD3_000090 CC1(CC2(C)C(CC1=O)c3ccc(cc3)C(F)(F)F)C=C2/C=C/c4ccc(cc4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 E24 mock treatment 678467.7419 5580.0 0.03 662095.5056 -11000.0 -0.06 -0.023 -0.3616 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F01 mock treatment 801227.9793 128000.0 0.59 692359.116 19300.0 0.1 0.4908 0.8171 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F02 mock treatment 822294.7368 149000.0 0.69 873462.6866 200000.0 1.06 1.2387 0.978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F03 compound treatment 570537.6884 -102000.0 -0.47 631652.5822 -41400.0 -0.22 -0.4892 -0.9395 3555993 CMLD3_000091 CC[C@H](C)[C@@H](NC(=O)O[C@H]1[C@@H](Oc2ccc(Br)cc2C1=O)c3cccc(OC)c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F04 compound treatment 678648.0447 5760.0 0.03 551188.7755 -122000.0 -0.65 -0.4384 -0.6775 3555995 CMLD3_000092 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)N[C@H]4CCCc5ccccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F05 compound treatment 798488.2629 126000.0 0.58 708935.7798 35800.0 0.19 0.544 0.8924 3555997 CMLD3_000093 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)NS(=O)(=O)c4ccc(C)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F06 mock treatment 713962.766 41100.0 0.19 919616.0714 247000.0 1.31 1.0585 0.8012 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F07 compound treatment 756695.4315 83800.0 0.39 840510.5263 167000.0 0.89 0.9012 0.9305 3555999 CMLD3_000094 COC(=O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2[C@@H](Oc3cc(OC)ccc3C2=O)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F08 compound treatment 566064.8148 -107000.0 -0.49 772624.3386 99500.0 0.53 0.025 0.0346 3556000 CMLD3_000095 COc1ccc2O[C@@H]([C@@H](OC(=O)N[C@H]3CCCc4ccccc34)C(=O)c2c1)c5ccc(OC)c(Br)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F09 mock treatment 706408.8398 33500.0 0.15 682893.2584 9800.0 0.05 0.1461 0.8957 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F10 mock treatment 675659.292 2770.0 0.01 770597.0874 97500.0 0.52 0.3747 0.7243 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F11 mock treatment 687170.3297 14300.0 0.07 724817.2589 51700.0 0.27 0.2406 0.8526 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F12 compound treatment 643882.3529 -29000.0 -0.13 670588.4477 -2500.0 -0.01 -0.104 -0.7734 3556002 CMLD3_000096 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)NCc4ccco4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F13 compound treatment 725000.0 52100.0 0.24 641267.4419 -31800.0 -0.17 0.0506 0.1722 3556004 CMLD3_000097 CC[C@H](C)[C@@H](NC(=O)O[C@@H]1[C@H](Oc2ccc(OC)cc2C1=O)c3ccc(OC)c(Br)c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F14 compound treatment 154607.1429 -518000.0 -2.39 160203.7037 -513000.0 -2.72 -3.6136 -0.9979 3556006 CMLD3_000098 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)OCC)C#Cc2ccc(Br)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F15 compound treatment 562284.7682 -111000.0 -0.51 620122.449 -53000.0 -0.28 -0.5593 -0.9605 3556008 CMLD3_000099 COc1ccc(O[C@H]2C=C[C@H](O[C@@H]2CO)C#Cc3ccc(F)cc3F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F16 compound treatment 656776.0417 -16100.0 -0.07 702259.4595 29200.0 0.15 0.0569 0.3312 3556010 CMLD3_000100 COc1ccc(O[C@@H]2[C@H](O)CO[C@H]2/C=C/C#Cc3ccc(F)cc3F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F17 mock treatment 590894.0678 -82000.0 -0.38 760358.3333 87300.0 0.46 0.0599 0.1003 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F18 mock treatment 739840.5797 66900.0 0.31 802359.6059 129000.0 0.69 0.7031 0.9351 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F19 compound treatment 797886.2559 125000.0 0.58 782979.3814 110000.0 0.58 0.8197 1.0 3556012 CMLD3_000101 COc1ccccc1/C=C/C(O)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F20 compound treatment 659970.297 -12900.0 -0.06 799231.1321 126000.0 0.67 0.431 0.6416 3556014 CMLD3_000102 COCn1c2ccccc2c3nnc(nc13)C(=O)OC(C)C#C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F21 compound treatment 617019.2308 -55900.0 -0.26 750135.8696 77000.0 0.41 0.1068 0.221 3556015 CMLD3_000103 CCCCCCC1=Cc2cc(OC)c(OC)cc2C(O1)C3(CCCC3=O)C(=O)OCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F22 compound treatment 691048.7805 18200.0 0.08 599790.9091 -73300.0 -0.39 -0.2157 -0.5424 1952239 CMLD3_000104 O=C1/C(=C/c2ccccc2)/Oc3ccccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F23 compound treatment 599763.4855 -73100.0 -0.34 621786.3636 -51300.0 -0.27 -0.4309 -0.9943 3556016 CMLD3_000105 Cc1c2OCOc2ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 F24 compound treatment 658898.9899 -14000.0 -0.06 635751.1521 -37300.0 -0.2 -0.1857 -0.8914 3556017 CMLD3_000106 COC(=O)N[C@H](C(C(=O)C)C(=O)OC)c1ccc2ccccc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G01 compound treatment 580233.9181 -92700.0 -0.43 534022.4719 -139000.0 -0.74 -0.8237 -0.9663 3556019 CMLD3_000107 COc1ccc2O[C@H]([C@H](OC(=O)Nc3cc(OC)c(OC)c(OC)c3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G02 mock treatment 639808.0808 -33100.0 -0.15 637861.1111 -35200.0 -0.19 -0.24 -0.9949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G03 mock treatment 717388.6256 44500.0 0.21 600390.8046 -72700.0 -0.39 -0.1275 -0.292 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G04 mock treatment 673467.9803 577.0 0.0 605937.8531 -67200.0 -0.36 -0.25 -0.7018 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G05 compound treatment 574050.5618 -98800.0 -0.46 537966.1017 -135000.0 -0.72 -0.8291 -0.9761 3556020 CMLD3_000108 COc1ccc2C(=O)[C@@H](OC(=O)Nc3ccc(C)c(Br)c3)[C@@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G06 compound treatment 680664.7727 7770.0 0.04 612893.617 -60200.0 -0.32 -0.2004 -0.6238 3556022 CMLD3_000109 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)N[C@H](C)C4CCCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G07 compound treatment 608577.2358 -64300.0 -0.3 689440.9449 16400.0 0.09 -0.1484 -0.4802 3556024 CMLD3_000110 CCOC(=O)CNC(=O)O[C@H]1[C@@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G08 mock treatment 704019.4175 31100.0 0.14 661737.1134 -11400.0 -0.06 0.0589 0.3786 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G09 compound treatment 599500.0 -73400.0 -0.34 554328.9474 -119000.0 -0.63 -0.6847 -0.9576 3556025 CMLD3_000111 COC(=O)[C@H](COC(C)(C)C)NC(=O)O[C@H]1[C@@H](Oc2ccc(Br)cc2C1=O)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G10 compound treatment 531600.0 -141000.0 -0.65 477313.3047 -196000.0 -1.04 -1.195 -0.9748 3556027 CMLD3_000112 COc1ccc2C(=O)[C@@H](OC(=O)Nc3ccc(OC(F)F)cc3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G11 mock treatment 635567.5676 -37300.0 -0.17 598708.5427 -74400.0 -0.39 -0.4007 -0.9309 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G12 compound treatment 535015.3846 -138000.0 -0.64 508763.5468 -164000.0 -0.87 -1.0659 -0.988 3556029 CMLD3_000113 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C[C@H]2OC(=O)Nc4ccc(OC(F)F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G13 compound treatment 527184.1004 -146000.0 -0.67 573584.9057 -99500.0 -0.53 -0.8483 -0.9929 3556031 CMLD3_000114 CC[C@H](C)[C@@H](NC(=O)O[C@@H]1Cc2cc(OC)ccc2O[C@H]1c3cccc(OC)c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G14 compound treatment 238725.0 -434000.0 -2.0 239859.375 -433000.0 -2.3 -3.0406 -0.9976 3556033 CMLD3_000115 COc1ccc(O[C@H]2C=C[C@H](O[C@@H]2CO)C#Cc3ccc(Br)cc3)c(c1)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G15 compound treatment 100771.9298 -572000.0 -2.64 101714.2857 -571000.0 -3.03 -4.0086 -0.9976 3556035 CMLD3_000116 COc1ccc(O[C@H]2C=C[C@H](O[C@@H]2CO)C#Cc3ccc(cc3)C(C)(C)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G16 compound treatment 521656.4885 -151000.0 -0.7 563588.4774 -109000.0 -0.58 -0.9038 -0.9959 3556037 CMLD3_000117 COc1ccc(O[C@@H]2[C@H](O)CO[C@@H]2/C=C/C#Cc3ccc(F)cc3F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G17 mock treatment 558299.5951 -115000.0 -0.53 554210.9091 -119000.0 -0.63 -0.8195 -0.9961 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G18 compound treatment 758837.5635 85900.0 0.4 573589.4737 -99500.0 -0.53 -0.0929 -0.1408 3556038 CMLD3_000118 CC(=C)C(O)/C=C/C=C/c1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G19 mock treatment 541101.2658 -132000.0 -0.61 631748.954 -41300.0 -0.22 -0.5848 -0.9051 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G20 mock treatment 611176.7442 -61700.0 -0.28 564017.9372 -109000.0 -0.58 -0.6103 -0.9466 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G21 compound treatment 633582.9596 -39300.0 -0.18 616109.8901 -57000.0 -0.3 -0.3419 -0.9701 3556040 CMLD3_000119 COC(=O)N[C@H](CC(=O)C)c1ccc(Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G22 compound treatment 662783.0688 -10100.0 -0.05 605257.6419 -67800.0 -0.36 -0.2874 -0.7921 3556042 CMLD3_000120 CCCCCCCC1=CC2=CC(=O)C(C)(OC(=O)C)C(=O)C2=CN1CCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G23 compound treatment 617874.3455 -55000.0 -0.25 638061.1111 -35000.0 -0.19 -0.3108 -0.9883 3556043 CMLD3_000121 CCCCCCC(=O)Cc1cc(OC)c(OC)cc1C=C(C(=O)OCC)C(=O)OCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 G24 compound treatment 624766.6667 -48100.0 -0.22 681427.5862 8340.0 0.04 -0.1257 -0.5553 3556044 CMLD3_000122 CCCCCCC(=O)Cc1cc(OC)c(OC)cc1/C=C(/C(=O)C)\C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H01 compound treatment 525215.9091 -148000.0 -0.68 508550.0 -165000.0 -0.87 -1.0987 -0.9925 3556046 CMLD3_000123 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)Nc4cc(OC)c(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H02 compound treatment 710614.6341 37700.0 0.17 568453.125 -105000.0 -0.55 -0.2694 -0.4632 3556048 CMLD3_000124 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C[C@H]2OC(=O)Nc4cc(OC)c(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H03 mock treatment 691535.8852 18600.0 0.09 612119.5652 -61000.0 -0.32 -0.1679 -0.5017 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H04 mock treatment 687432.6923 14500.0 0.07 640596.5909 -32500.0 -0.17 -0.0744 -0.4025 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H05 compound treatment 667634.1463 -5260.0 -0.02 656370.1923 -16700.0 -0.09 -0.0798 -0.8685 3556050 CMLD3_000125 COc1ccc2C(=O)[C@@H](OC(=O)N[C@H](C)C3CCCCC3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H06 compound treatment 618063.9269 -54800.0 -0.25 674875.0 1790.0 0.01 -0.1721 -0.6801 3556052 CMLD3_000126 COC(=O)[C@@H](NC(=O)O[C@@H]1[C@H](Oc2ccc(OC)cc2C1=O)c3ccc(OC)c(Br)c3)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H07 compound treatment 317774.1935 -355000.0 -1.64 382873.8739 -290000.0 -1.54 -2.2465 -0.9995 3556054 CMLD3_000127 COc1ccc2C(=O)[C@@H](OC(=O)NCc3ccco3)[C@@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H08 compound treatment 548000.0 -125000.0 -0.58 580187.8173 -92900.0 -0.49 -0.7557 -0.997 3556056 CMLD3_000128 COC(=O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2[C@@H](Oc3ccc(Br)cc3C2=O)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H09 compound treatment 481328.0 -192000.0 -0.88 518421.4876 -155000.0 -0.82 -1.2047 -0.9993 3556058 CMLD3_000129 Brc1ccc2O[C@H]([C@H](OC(=O)NCCOc3ccccc3)C(=O)c2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H10 compound treatment 586189.3204 -86700.0 -0.4 577118.8525 -96000.0 -0.51 -0.6427 -0.9929 3556060 CMLD3_000130 Fc1ccc(cc1)S(=O)(=O)NC(=O)O[C@H]2[C@@H](Oc3ccc(Br)cc3C2=O)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H11 compound treatment 534477.0115 -138000.0 -0.64 738172.2689 65100.0 0.35 -0.2073 -0.2856 3556062 CMLD3_000131 COc1ccc2C(=O)[C@@H](OC(=O)NS(=O)(=O)c3ccc(F)cc3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H12 compound treatment 520776.4706 -152000.0 -0.7 603903.0612 -69200.0 -0.37 -0.7555 -0.9543 3556064 CMLD3_000132 COc1ccc2C(=O)[C@H](OC(=O)Nc3ccc(OC(F)F)cc3)[C@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H13 mock treatment 600980.0 -71900.0 -0.33 619613.1687 -53500.0 -0.28 -0.4351 -0.997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H14 compound treatment 164627.451 -508000.0 -2.34 180360.0 -493000.0 -2.61 -3.5054 -0.9985 3556065 CMLD3_000133 CC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)C)C#Cc2ccc(cc2)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H15 compound treatment 339841.7722 -333000.0 -1.54 370313.5135 -303000.0 -1.61 -2.2216 -0.9998 3556067 CMLD3_000134 Cc1cc(C)cc(C#C[C@H]2O[C@H](CO)[C@@H](Oc3ccc(cc3)C4CCCC4)C=C2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H16 compound treatment 529105.4852 -144000.0 -0.66 524768.9531 -148000.0 -0.79 -1.0251 -0.9964 3556069 CMLD3_000135 Cc1ccc(O[C@@H]2[C@H](O)CO[C@H]2/C=C/C#Cc3ccc(cc3)C(C)(C)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H17 compound treatment 598355.8559 -74500.0 -0.34 575337.1648 -97800.0 -0.52 -0.6097 -0.9801 3556071 CMLD3_000136 CC(=O)c1ccc(cc1)[C@H]2O[C@H](CO)[C@@H](Oc3ccc(F)cc3C)C=C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H18 compound treatment 511548.0 -161000.0 -0.74 501793.8931 -171000.0 -0.91 -1.1686 -0.9951 3556073 CMLD3_000137 Clc1cc2nc3-c4ccccc4OC(CC=C)(c5ccccc5)c3nc2cc1Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H19 mock treatment 569300.3802 -104000.0 -0.48 531941.704 -141000.0 -0.75 -0.8672 -0.9765 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H20 mock treatment 561167.4641 -112000.0 -0.52 621977.4775 -51100.0 -0.27 -0.556 -0.955 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H21 compound treatment 93741.3793 -579000.0 -2.67 88750.0 -584000.0 -3.1 -4.0801 -0.9973 3556074 CMLD3_000138 CCCc1cc2C(=O)[C@H]3O[C@H]3[C@H](O)c2c(=O)o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H22 compound treatment 541898.0583 -131000.0 -0.6 515734.0426 -157000.0 -0.83 -1.0173 -0.9874 3556076 CMLD3_000139 COC(=O)N[C@H](C(C(=O)C)C(=O)OCC=C)c1ccc2ccccc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H23 mock treatment 526443.299 -146000.0 -0.68 539902.1277 -133000.0 -0.71 -0.9771 -0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 H24 compound treatment 447557.9399 -225000.0 -1.04 508341.9689 -165000.0 -0.87 -1.3527 -0.9963 3556078 CMLD3_000140 COC(=O)N[C@@H](c1cccc(F)c1)[C@@]2(CCCC2=O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I01 compound treatment 582830.1887 -90100.0 -0.42 568497.4093 -105000.0 -0.55 -0.6859 -0.9898 3556080 CMLD3_000141 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)Nc4cc(OC)c(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I02 compound treatment 344835.443 -328000.0 -1.51 209200.0 -464000.0 -2.46 -2.8096 -0.9727 3556082 CMLD3_000142 COc1ccc2C(=O)[C@@H](OC(=O)NCc3ccco3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I03 compound treatment 733819.5122 60900.0 0.28 624914.2857 -48200.0 -0.26 0.018 0.0474 3555962 CMLD3_000143 CC[C@H](C)[C@@H](NC(=O)O[C@@H]1[C@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I04 mock treatment 796843.8819 124000.0 0.57 919102.9412 246000.0 1.3 1.3269 0.9314 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I05 mock treatment 738303.0303 65400.0 0.3 712935.1852 39800.0 0.21 0.3627 0.9849 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I06 mock treatment 749408.1633 76500.0 0.35 656824.0741 -16300.0 -0.09 0.1885 0.519 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I07 compound treatment 643953.125 -28900.0 -0.13 598278.0488 -74800.0 -0.4 -0.3749 -0.8956 3556084 CMLD3_000144 COc1ccc2C(=O)[C@@H](OC(=O)NCc3ccc4OCOc4c3)[C@@H](Oc2c1)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I08 compound treatment 546778.4431 -126000.0 -0.58 553133.3333 -120000.0 -0.64 -0.8611 -0.999 3556086 CMLD3_000145 Brc1ccc2O[C@H]([C@H](OC(=O)NC3CCCC3)C(=O)c2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I09 compound treatment 530078.8382 -143000.0 -0.66 697495.6522 24400.0 0.13 -0.3742 -0.5574 3556088 CMLD3_000146 CC[C@H](C)[C@@H](NC(=O)O[C@H]1[C@@H](Oc2ccc(Br)cc2C1=O)c3ccc4OCOc4c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I10 compound treatment 562691.358 -110000.0 -0.51 738943.3962 65900.0 0.35 -0.1124 -0.1822 3556090 CMLD3_000147 CC[C@H](C)[C@@H](NC(=O)O[C@@H]1Cc2cc(Br)ccc2O[C@H]1c3cccc(OC)c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I11 compound treatment 699431.5789 26500.0 0.12 700427.9279 27300.0 0.15 0.1891 0.9964 3556092 CMLD3_000148 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)NCc4ccco4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I12 compound treatment 489754.8077 -183000.0 -0.84 624632.4786 -48500.0 -0.26 -0.7789 -0.8823 3556094 CMLD3_000149 CCOC(=O)CNC(=O)O[C@H]1[C@@H](Oc2ccc(Br)cc2C1=O)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I13 compound treatment 612753.9267 -60100.0 -0.28 506041.8605 -167000.0 -0.89 -0.8226 -0.886 3011535 CMLD3_000150 COCOc1cc(OC)ccc1C(=O)/C=C/c2ccc3OCOc3c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I14 compound treatment 281744.6809 -391000.0 -1.8 235916.6667 -437000.0 -2.32 -2.9151 -0.9923 3556096 CMLD3_000151 CC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)C)C#Cc2ccc(C)cc2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I15 compound treatment 604484.6939 -68400.0 -0.32 607131.3131 -66000.0 -0.35 -0.4704 -0.9987 3556098 CMLD3_000152 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1Oc2ccc(cc2)c3ccccc3)c4ccc(cc4)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I16 compound treatment 444462.8571 -228000.0 -1.05 572363.1841 -101000.0 -0.53 -1.1227 -0.9505 3556100 CMLD3_000153 Cc1ccc(O[C@@H]2[C@H](O)CO[C@@H]2/C=C/C#Cc3ccc(cc3)C(C)(C)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I17 compound treatment 615062.5 -57800.0 -0.27 676196.6527 3110.0 0.02 -0.1769 -0.6621 3556101 CMLD3_000154 Cc1cc(F)ccc1O[C@H]2C=C[C@@H](CC=C)O[C@@H]2CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I18 compound treatment 626595.122 -46300.0 -0.21 734537.3832 61400.0 0.33 0.0795 0.204 3556103 CMLD3_000155 COC(=O)N(CCc1ccc(OC)c(OC)c1)/C=C/c2ccc(OC)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I19 compound treatment 772544.4444 99700.0 0.46 753238.6364 80200.0 0.43 0.6256 0.9992 3556105 CMLD3_000156 CCCCCCC1=Cc2cc(OC)c(OC)cc2C(O1)C(C(=O)C)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I20 compound treatment 746632.9787 73700.0 0.34 667666.6667 -5420.0 -0.03 0.2201 0.645 3556106 CMLD3_000157 CC(C)(C)OC1C2C3C2C(CC(O)CC=C)C1C3CC(O)CC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I21 mock treatment 620949.5413 -51900.0 -0.24 607800.8475 -65300.0 -0.35 -0.4142 -0.9838 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I22 mock treatment 657434.7826 -15500.0 -0.07 710013.1579 36900.0 0.2 0.0881 0.4226 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I23 compound treatment 608117.1171 -64800.0 -0.3 623265.1163 -49800.0 -0.26 -0.3981 -0.9981 2119115 CMLD3_000158 COc1ccc(/C=C/C(=O)c2ccc(OC)cc2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 I24 compound treatment 666529.4118 -6360.0 -0.03 607131.4554 -66000.0 -0.35 -0.2681 -0.7637 3556107 CMLD3_000159 COC(=O)N[C@H](C(C(=O)C)C(=O)OCC=C)c1ccc(Cl)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J01 compound treatment 558391.7526 -114000.0 -0.53 572172.7749 -101000.0 -0.54 -0.7519 -1.0 3556109 CMLD3_000160 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C[C@H]2OC(=O)NS(=O)(=O)c4ccc(F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J02 compound treatment 690588.5167 17700.0 0.08 569099.5261 -104000.0 -0.55 -0.3323 -0.596 3556112 CMLD3_000161 CCOC(=O)CNC(=O)O[C@@H]1[C@H](Oc2ccc(OC)cc2C1=O)c3ccc(OC)c(Br)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J03 compound treatment 708510.5263 35600.0 0.16 615971.9101 -57100.0 -0.3 -0.0981 -0.2846 3556115 CMLD3_000162 COC(=O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2[C@@H](Oc3ccc(Br)cc3C2=O)c4cccc(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J04 mock treatment 832876.1905 160000.0 0.74 738123.2877 65000.0 0.34 0.7656 0.94 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J05 mock treatment 736984.7716 64100.0 0.3 736875.5365 63800.0 0.34 0.4482 0.9977 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J06 mock treatment 713957.4468 41100.0 0.19 724330.0493 51200.0 0.27 0.3261 0.9844 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J07 compound treatment 682511.9617 9620.0 0.04 611313.1868 -61800.0 -0.33 -0.2003 -0.6058 3556117 CMLD3_000163 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)NCCOc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J08 compound treatment 559193.7173 -114000.0 -0.52 536013.9535 -137000.0 -0.73 -0.8849 -0.9871 3556119 CMLD3_000164 COC(=O)[C@@H](NC(=O)O[C@H]1[C@@H](Oc2ccc(Br)cc2C1=O)c3ccc4OCOc4c3)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J09 compound treatment 567552.8846 -105000.0 -0.49 610786.7299 -62300.0 -0.33 -0.5772 -0.9824 3556123 CMLD3_000165 CC[C@H](C)[C@@H](NC(=O)O[C@H]1[C@@H](Oc2ccc(OC)cc2C1=O)c3ccc(OC)c(Br)c3)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J10 compound treatment 620064.6766 -52800.0 -0.24 765004.2918 91900.0 0.49 0.1725 0.3165 3556129 CMLD3_000166 COc1ccc2O[C@H]([C@H](OC(=O)NS(=O)(=O)c3ccc(F)cc3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J11 compound treatment 548198.5816 -125000.0 -0.58 569726.3682 -103000.0 -0.55 -0.7943 -0.9997 3556130 CMLD3_000167 COc1ccc2O[C@@H]([C@@H](OC(=O)NCc3ccco3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J12 compound treatment 748946.1883 76100.0 0.35 614710.9635 -58400.0 -0.31 0.0291 0.0621 3556132 CMLD3_000168 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)NCc4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J13 compound treatment 525664.6707 -147000.0 -0.68 472033.6538 -201000.0 -1.07 -1.2341 -0.9762 3556134 CMLD3_000169 COCOc1ccc(OC)cc1C(=O)/C=C/c2ccc(OC)c(Br)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J14 compound treatment 249076.9231 -424000.0 -1.95 394351.3514 -279000.0 -1.48 -2.4274 -0.9905 3556136 CMLD3_000170 CC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)C)C#Cc2ccc(F)cc2F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J15 compound treatment 503933.3333 -169000.0 -0.78 522737.0892 -150000.0 -0.8 -1.1148 -0.9999 3556138 CMLD3_000171 CCOC(=O)OC[C@H]1O[C@@H]([C@@H](C=C1)c2cc(ccc2O)c3ccccc3)c4ccc(cc4)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J16 mock treatment 648930.7359 -24000.0 -0.11 694127.907 21000.0 0.11 8.0E-4 0.0049 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J17 compound treatment 253491.5254 -419000.0 -1.93 296206.8966 -377000.0 -2.0 -2.7811 -0.9999 3556140 CMLD3_000172 COC(=O)C1(CC(=CCc2ccccc2C1C[N+](=O)[O-])C=C)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J18 mock treatment 565112.069 -108000.0 -0.5 504597.3154 -168000.0 -0.89 -0.9834 -0.9617 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J19 compound treatment 589350.5155 -83500.0 -0.39 644011.7188 -29100.0 -0.15 -0.3815 -0.9192 3556141 CMLD3_000173 COc1cccc(/C=C/C(O)C(=C)C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J20 compound treatment 598787.1287 -74100.0 -0.34 528236.0 -145000.0 -0.77 -0.7849 -0.9335 3556143 CMLD3_000174 COC(=O)N1CCc2cc(OC)c(OC)cc2C1Cc3ccc(OC)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J21 mock treatment 646210.9375 -26700.0 -0.12 695718.2131 22600.0 0.12 -0.0021 -0.0124 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J22 mock treatment 636214.6341 -36700.0 -0.17 656045.9364 -17000.0 -0.09 -0.1835 -0.9569 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J23 compound treatment 531606.6946 -141000.0 -0.65 534310.6383 -139000.0 -0.74 -0.9812 -0.9982 3556144 CMLD3_000175 CCOC(=O)[C@]1(CCCC1=O)[C@@H](NC(=O)OC)c2cccc(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 J24 compound treatment 586407.4074 -86500.0 -0.4 634159.1837 -38900.0 -0.21 -0.428 -0.953 3556146 CMLD3_000176 OC[C@@H]1CCCN1C(=O)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K01 compound treatment 571011.5607 -102000.0 -0.47 542758.794 -130000.0 -0.69 -0.821 -0.9823 3556148 CMLD3_000177 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)NC4CCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K02 compound treatment 672583.7104 -307.0 0.0 686338.0282 13200.0 0.07 0.0487 0.6927 3556150 CMLD3_000178 COC(=O)[C@H](COC(C)(C)C)NC(=O)O[C@H]1[C@@H](Oc2cc(OC)ccc2C1=O)c3cccc(c3)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K03 compound treatment 719375.0 46500.0 0.21 692428.5714 19300.0 0.1 0.2241 0.9431 3556152 CMLD3_000179 COc1ccc2C(=O)[C@@H](OC(=O)NCc3ccc4OCOc4c3)[C@@H](Oc2c1)c5cccc(c5)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K04 mock treatment 760691.9192 87800.0 0.4 794354.3689 121000.0 0.64 0.7411 0.9751 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K05 compound treatment 720679.6537 47800.0 0.22 778140.0778 105000.0 0.56 0.5498 0.9176 3011485 CMLD3_000180 COc1ccc2C(=O)[C@@H](O)[C@@H](Oc2c1)c3cccc(c3)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K06 compound treatment 704707.1823 31800.0 0.15 607802.0833 -65300.0 -0.35 -0.1411 -0.3752 3556154 CMLD3_000181 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)Nc4ccc(C)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K07 mock treatment 718116.4659 45200.0 0.21 681843.9024 8760.0 0.05 0.1803 0.8439 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K08 mock treatment 709880.0 37000.0 0.17 663419.0871 -9670.0 -0.05 0.0844 0.4736 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K09 compound treatment 617510.3734 -55400.0 -0.26 570385.3211 -103000.0 -0.54 -0.5658 -0.9404 3556156 CMLD3_000182 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)Nc4ccc(OC(F)F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K10 compound treatment 598810.4089 -74100.0 -0.34 563450.5929 -110000.0 -0.58 -0.6528 -0.9679 3556158 CMLD3_000183 COc1ccc2O[C@H]([C@H](OC(=O)NS(=O)(=O)c3ccc(C)cc3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K11 compound treatment 627491.7355 -45400.0 -0.21 601376.2376 -71700.0 -0.38 -0.417 -0.9604 3556159 CMLD3_000184 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)NCCc4ccc(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K12 compound treatment 566608.5106 -106000.0 -0.49 628766.6667 -44300.0 -0.24 -0.5128 -0.9434 3556161 CMLD3_000185 COc1ccc2O[C@H]([C@H](OC(=O)NCc3ccc4OCOc4c3)C(=O)c2c1)c5ccc(OC)c(Br)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K13 mock treatment 635540.2299 -37400.0 -0.17 712541.2844 39500.0 0.21 0.0262 0.0966 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K14 compound treatment 726162.5 53300.0 0.25 693362.3188 20300.0 0.11 0.2498 0.9313 3556162 CMLD3_000186 CC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)C)c2cc(C)cc(C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K15 mock treatment 617860.3774 -55000.0 -0.25 604386.5248 -68700.0 -0.36 -0.4371 -0.9844 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K16 mock treatment 613111.5108 -59800.0 -0.28 630996.3235 -42100.0 -0.22 -0.3528 -0.9945 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K17 compound treatment 769134.9206 96200.0 0.44 704204.8193 31100.0 0.17 0.4305 0.9092 3556164 CMLD3_000187 COC(=O)N[C@H](CC(=O)C)c1cccc(C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K18 compound treatment 609007.1429 -63900.0 -0.29 640080.1527 -33000.0 -0.18 -0.3321 -0.9691 3556166 CMLD3_000188 COC(=O)N[C@H](CC(=O)C)c1ccco1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K19 compound treatment 687627.1777 14700.0 0.07 610090.9091 -63000.0 -0.33 -0.1882 -0.552 3556168 CMLD3_000189 COc1ccc(OC)c(c1)[C@@H]2OCCC=C[C@H]2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K20 compound treatment 555661.8357 -117000.0 -0.54 510250.0 -163000.0 -0.86 -0.993 -0.9745 3556170 CMLD3_000190 CC1=C(C)CC(C(C1)C(=O)c2ccccc2O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K21 mock treatment 667003.9526 -5890.0 -0.03 635348.7395 -37700.0 -0.2 -0.1607 -0.7957 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K22 compound treatment 819408.867 147000.0 0.68 822890.3226 150000.0 0.79 1.0396 0.9967 3556171 CMLD3_000191 CCCCCCC1=Cc2cc(OC)c(OC)cc2C(O1)C(C(=O)C)C(=O)OCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K23 mock treatment 689862.4339 17000.0 0.08 646939.8148 -26100.0 -0.14 -0.0427 -0.2683 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 K24 mock treatment 600230.4833 -72700.0 -0.34 701612.069 28500.0 0.15 -0.13 -0.3535 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L01 mock treatment 813312.7753 140000.0 0.65 698025.1256 24900.0 0.13 0.5514 0.8343 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L02 compound treatment 755579.235 82700.0 0.38 609065.8683 -64000.0 -0.34 0.0295 0.0578 3556172 CMLD3_000192 COc1ccc2O[C@H]([C@H](OC(=O)NCc3ccco3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L03 mock treatment 741467.0051 68600.0 0.32 790761.658 118000.0 0.62 0.665 0.9504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L04 mock treatment 938300.0 265000.0 1.22 782818.6275 110000.0 0.58 1.277 0.9422 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L05 compound treatment 806859.5745 134000.0 0.62 667702.4793 -5390.0 -0.03 0.4167 0.6737 3556173 CMLD3_000193 O[C@H]1[C@@H](Oc2ccc(Br)cc2C1=O)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L06 compound treatment 773796.7033 101000.0 0.47 770004.902 96900.0 0.51 0.6925 0.9988 3556175 CMLD3_000194 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)Nc4ccc(OC(F)F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L07 mock treatment 694301.8868 21400.0 0.1 729371.7949 56300.0 0.3 0.2809 0.8934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L08 mock treatment 743878.9238 71000.0 0.33 683481.4815 10400.0 0.06 0.2705 0.8147 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L09 compound treatment 662590.9091 -10300.0 -0.05 620437.9845 -52700.0 -0.28 -0.2311 -0.8157 3556177 CMLD3_000195 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)NS(=O)(=O)c4ccc(F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L10 compound treatment 558672.619 -114000.0 -0.53 600977.2727 -72100.0 -0.38 -0.6429 -0.9876 3556179 CMLD3_000196 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)Nc4ccc(C)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L11 compound treatment 700450.2165 27600.0 0.13 667577.2727 -5510.0 -0.03 0.0692 0.5306 3556181 CMLD3_000197 COC(=O)[C@@H](NC(=O)O[C@@H]1[C@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L12 compound treatment 539984.4961 -133000.0 -0.61 681717.7419 8630.0 0.05 -0.401 -0.6525 3556182 CMLD3_000198 COc1ccc2C(=O)[C@H](OC(=O)NCc3ccc4OCOc4c3)[C@H](Oc2c1)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L13 compound treatment 190117.6471 -483000.0 -2.23 196129.6296 -477000.0 -2.53 -3.3631 -0.998 3556183 CMLD3_000199 CCCCCCC#C[C@H]1O[C@H](COC(=O)C)[C@@H](OC(=O)C)C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L14 compound treatment 118115.3846 -555000.0 -2.56 133779.661 -539000.0 -2.86 -3.8317 -0.9985 3556185 CMLD3_000200 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)OCC)C#Cc2ccc(cc2)C(C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L15 mock treatment 576473.029 -96400.0 -0.44 649440.1709 -23600.0 -0.13 -0.4031 -0.8725 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L16 mock treatment 611453.9249 -61400.0 -0.28 670467.2131 -2620.0 -0.01 -0.2102 -0.7409 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L17 compound treatment 624042.7046 -48800.0 -0.23 629418.7726 -43700.0 -0.23 -0.3231 -0.9999 3556187 CMLD3_000201 COC(=O)CC1=CO[C@@H](O)[C@H]2[C@@H]1CC=C2CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L18 compound treatment 188076.9231 -485000.0 -2.24 193096.7742 -480000.0 -2.55 -3.3811 -0.9979 3556189 CMLD3_000202 COC(=O)C1=NOC2(C1)C=C(Br)C(=C(Br)C2=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L19 compound treatment 716924.3697 44000.0 0.2 704051.6605 31000.0 0.16 0.2597 0.9945 3556190 CMLD3_000203 O=C1OC(=NC21CC2)C3=CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L20 mock treatment 578213.5231 -94700.0 -0.44 567397.9592 -106000.0 -0.56 -0.7051 -0.9924 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L21 compound treatment 619289.7196 -53600.0 -0.25 640741.8033 -32300.0 -0.17 -0.2961 -0.9841 3556191 CMLD3_000204 CCCCCCC1Cc2cc(OC)c(OC)cc2C(O1)C(C(=O)OCC)C(=O)OCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L22 compound treatment 465534.0502 -207000.0 -0.96 486486.4865 -187000.0 -0.99 -1.376 -0.9999 3556192 CMLD3_000205 COC(=O)[C@@H](OCc1ccccc1)/C=C/[C@H](C)Cc2cc(Br)cc(OCc3ccccc3)c2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L23 mock treatment 568802.6316 -104000.0 -0.48 552173.1449 -121000.0 -0.64 -0.7929 -0.9898 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 L24 mock treatment 541169.4915 -132000.0 -0.61 573925.9259 -99200.0 -0.53 -0.8014 -0.9974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M01 mock treatment 630306.5327 -42600.0 -0.2 603666.6667 -69400.0 -0.37 -0.3992 -0.9567 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M02 compound treatment 653365.3846 -19500.0 -0.09 628658.8785 -44400.0 -0.24 -0.2303 -0.9129 3556194 CMLD3_000206 COC(=O)[C@H](COC(C)(C)C)NC(=O)O[C@H]1[C@@H](Oc2ccc(OC)cc2C1=O)c3ccc(OC)c(Br)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M03 compound treatment 682413.7931 9520.0 0.04 755760.9562 82700.0 0.44 0.3411 0.7741 3556196 CMLD3_000207 COC(=O)[C@@H](NC(=O)O[C@H]1[C@@H](Oc2ccc(Br)cc2C1=O)c3cccc(OC)c3)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M04 compound treatment 731203.252 58300.0 0.27 798638.7665 126000.0 0.67 0.661 0.9204 3556198 CMLD3_000208 COc1ccc2C(=O)[C@@H](OC(=O)Nc3cc(OC)c(OC)c(OC)c3)[C@@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M05 compound treatment 785742.3581 113000.0 0.52 689193.0502 16100.0 0.09 0.4284 0.8123 3556199 CMLD3_000209 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C[C@H]2OC(=O)N[C@H](C)C4CCCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M06 compound treatment 592781.1159 -80100.0 -0.37 569004.4053 -104000.0 -0.55 -0.6516 -0.9809 3556201 CMLD3_000210 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)N[C@H](C)C4CCCCC4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M07 compound treatment 701237.5 28300.0 0.13 676068.5921 2980.0 0.02 0.1036 0.7869 3556203 CMLD3_000211 COc1ccc2C(=O)[C@@H](OC(=O)NCCc3ccc(OC)c(OC)c3)[C@@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M08 compound treatment 578198.2379 -94700.0 -0.44 535514.5228 -138000.0 -0.73 -0.8248 -0.9699 3556205 CMLD3_000212 COC(=O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2[C@@H](Oc3ccc(OC)cc3C2=O)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M09 mock treatment 683917.9688 11000.0 0.05 605357.4144 -67700.0 -0.36 -0.2181 -0.601 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M10 mock treatment 671474.7899 -1420.0 -0.01 620350.2304 -52700.0 -0.28 -0.2024 -0.7234 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M11 compound treatment 560157.1429 -113000.0 -0.52 542015.0376 -131000.0 -0.7 -0.8592 -0.9898 3556206 CMLD3_000213 COc1ccc2O[C@@H]([C@@H](OC(=O)NCCc3ccc(OC)c(OC)c3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M12 compound treatment 605717.5573 -67200.0 -0.31 530132.5758 -143000.0 -0.76 -0.7552 -0.922 2060493 CMLD3_000214 COc1ccc2c(=O)c(coc2c1)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M13 mock treatment 538390.411 -135000.0 -0.62 608513.8889 -64600.0 -0.34 -0.6808 -0.9608 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M14 mock treatment 662305.3435 -10600.0 -0.05 611952.7897 -61100.0 -0.32 -0.2638 -0.8045 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M15 mock treatment 806558.952 134000.0 0.62 567961.2403 -105000.0 -0.56 0.0416 0.0501 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M16 mock treatment 678765.625 5870.0 0.03 631166.6667 -41900.0 -0.22 -0.1381 -0.6164 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M17 compound treatment 565754.8638 -107000.0 -0.49 584720.6478 -88400.0 -0.47 -0.6808 -0.9997 3556208 CMLD3_000215 COC(=O)N[C@@H](c1ccccc1)[C@@]2(CCCC2=O)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M18 compound treatment 578142.8571 -94700.0 -0.44 609547.2441 -63500.0 -0.34 -0.5473 -0.9918 3556210 CMLD3_000216 COc1ccc(/C=C/NC(=O)Cc2ccc(OC)c(OC)c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M19 compound treatment 644226.6187 -28700.0 -0.13 576137.3391 -97000.0 -0.51 -0.4571 -0.8609 3556212 CMLD3_000217 CCOP(=O)(CC(C(O)c1ccccc1)C(=O)C)OCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M20 compound treatment 621687.0504 -51200.0 -0.24 642395.3488 -30700.0 -0.16 -0.2821 -0.9835 3556213 CMLD3_000218 CCOC(=O)[C@]1(CCCC1=O)[C@@H](NC(=O)OC)/C=C/c2ccco2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M21 compound treatment 500581.6993 -172000.0 -0.79 550634.1463 -122000.0 -0.65 -1.0211 -0.995 3556215 CMLD3_000219 CC1(C)O[C@H]([C@@H](O1)C(O)(c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c3cc(cc(c3)C(F)(F)F)C(F)(F)F)C(O)(c4cc(cc(c4)C(F)(F)F)C(F)(F)F)c5cc(cc(c5)C(F)(F)F)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M22 compound treatment 578848.4848 -94000.0 -0.43 671188.0342 -1900.0 -0.01 -0.3138 -0.7233 3556217 CMLD3_000220 COC(=O)[C@]1(CCCC1=O)[C@@H](NC(=O)O/C=C/C)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M23 compound treatment 698908.7302 26000.0 0.12 629847.3282 -43200.0 -0.23 -0.0773 -0.2988 3556219 CMLD3_000221 CC1(O)C(=O)C=C2C=C(CCCCOCc3ccccc3)OC=C2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 M24 compound treatment 550163.6364 -123000.0 -0.57 567657.277 -105000.0 -0.56 -0.7956 -1.0 3556220 CMLD3_000222 COC(=O)N[C@H](/C(=C(\C)/NCc1ccccc1)/C(=O)OC)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N01 compound treatment 465397.8102 -207000.0 -0.96 550967.4419 -122000.0 -0.65 -1.1346 -0.9819 3556222 CMLD3_000223 COc1ccc2C(=O)[C@@H](OC(=O)Nc3cc(OC)c(OC)c(OC)c3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N02 mock treatment 677393.7824 4500.0 0.02 690223.8095 17100.0 0.09 0.0789 0.8468 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N03 compound treatment 642235.2941 -30700.0 -0.14 582398.01 -90700.0 -0.48 -0.4401 -0.8778 3556224 CMLD3_000224 COc1ccc2O[C@@H]([C@@H](OC(=O)Nc3ccc(OC(F)F)cc3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N04 compound treatment 700179.1045 27300.0 0.13 565516.129 -108000.0 -0.57 -0.3145 -0.5382 3556226 CMLD3_000225 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N05 compound treatment 689303.0303 16400.0 0.08 659300.8475 -13800.0 -0.07 0.0018 0.0172 3556228 CMLD3_000226 COc1ccc2O[C@@H]([C@@H](O)C(=O)c2c1)c3ccc(OC)c(Br)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N06 compound treatment 634635.514 -38300.0 -0.18 650943.9252 -22100.0 -0.12 -0.2078 -0.9805 3556229 CMLD3_000227 COC(=O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2[C@@H](Oc3ccc(OC)cc3C2=O)c4cccc(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N07 compound treatment 768050.4202 95200.0 0.44 811556.9106 138000.0 0.73 0.8296 0.9697 3556231 CMLD3_000228 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)NCCc4ccc(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N08 compound treatment 651527.0936 -21400.0 -0.1 620345.7944 -52700.0 -0.28 -0.2675 -0.9018 3556233 CMLD3_000229 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2OC(=O)NCCOc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N09 mock treatment 648189.7233 -24700.0 -0.11 722242.0091 49200.0 0.26 0.1038 0.3648 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N10 mock treatment 703824.2678 30900.0 0.14 661553.1136 -11500.0 -0.06 0.0576 0.3711 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N11 mock treatment 710052.2388 37200.0 0.17 768379.9127 95300.0 0.51 0.4786 0.8967 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N12 compound treatment 667004.6083 -5890.0 -0.03 646347.8261 -26700.0 -0.14 -0.1195 -0.8274 3556235 CMLD3_000230 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C[C@H]2OC(=O)NCc4ccco4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N13 mock treatment 699804.5455 26900.0 0.12 774784.2324 102000.0 0.54 0.4692 0.8477 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N14 mock treatment 638782.8283 -34100.0 -0.16 570173.7452 -103000.0 -0.55 -0.4972 -0.8753 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N15 compound treatment 649926.8293 -23000.0 -0.11 541118.8811 -132000.0 -0.7 -0.5698 -0.8049 3556237 CMLD3_000231 CC(=O)c1ccc(O[C@@H]2[C@H](O)CO[C@@H]2/C=C/c3ccc(Cl)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N16 compound treatment 553349.3976 -120000.0 -0.55 671372.8814 -1720.0 -0.01 -0.3962 -0.7187 3556239 CMLD3_000232 CCCCC#C[C@H]1O[C@H](CO)[C@@H](Oc2ccc(OC)cc2)C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N17 compound treatment 686683.2579 13800.0 0.06 746591.1111 73500.0 0.39 0.3206 0.8117 3556241 CMLD3_000233 COC(=O)N[C@H](C(C(=O)C)C(=O)OCC=C)c1cccc(c1)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N18 compound treatment 640024.2915 -32900.0 -0.15 672215.0538 -873.0 0.0 -0.1105 -0.7284 3556243 CMLD3_000234 COC(=O)N[C@H](C(C(=O)C)C(=O)OCC=C)c1cccs1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N19 compound treatment 676822.2222 3930.0 0.02 594619.7719 -78500.0 -0.42 -0.2815 -0.6757 3556191 CMLD3_000235 CCCCCCC1Cc2cc(OC)c(OC)cc2C(O1)C(C(=O)OCC)C(=O)OCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N20 compound treatment 571586.7159 -101000.0 -0.47 524075.5396 -149000.0 -0.79 -0.8892 -0.9685 3556245 CMLD3_000236 COc1ccc(/C=C/N(CCc2ccc(OC)c(OC)c2)C(=O)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N21 mock treatment 520763.7795 -152000.0 -0.7 562174.9175 -111000.0 -0.59 -0.9121 -0.9962 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N22 compound treatment 478837.2093 -194000.0 -0.89 407083.6237 -266000.0 -1.41 -1.6304 -0.9759 3556247 CMLD3_000237 CCC1(CC2(CC)C(CC1=O)c3ccccc3)C=C2/C=C/c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N23 compound treatment 511066.4207 -162000.0 -0.75 531370.2422 -142000.0 -0.75 -1.0592 -1.0 3556249 CMLD3_000238 CC1(CC2(C)C(CC1=O)c3ccc(F)cc3)C=C2/C=C/c4ccc(F)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 N24 mock treatment 503285.7143 -170000.0 -0.78 601807.5314 -71300.0 -0.38 -0.8204 -0.9444 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O01 compound treatment 520416.6667 -152000.0 -0.7 575599.0991 -97500.0 -0.52 -0.8628 -0.9886 3556251 CMLD3_000239 COc1ccc2O[C@@H]([C@@H](OC(=O)N[C@H](C)C3CCCCC3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O02 compound treatment 631165.8768 -41700.0 -0.19 627846.8468 -45200.0 -0.24 -0.3057 -0.994 3556253 CMLD3_000240 COC(=O)[C@H](COC(C)(C)C)NC(=O)O[C@H]1[C@@H](Oc2cc(OC)ccc2C1=O)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O03 compound treatment 572672.7273 -100000.0 -0.46 541826.087 -131000.0 -0.7 -0.8191 -0.9802 3556254 CMLD3_000241 COc1ccc2C(=O)[C@@H](OC(=O)N[C@H]3CCCc4ccccc34)[C@@H](Oc2c1)c5cccc(c5)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O04 compound treatment 559218.6047 -114000.0 -0.52 590313.1868 -82800.0 -0.44 -0.6811 -0.9961 3556256 CMLD3_000242 COc1ccc2C(=O)[C@H](OC(=O)Nc3ccc(C)c(Br)c3)[C@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O05 compound treatment 450375.9124 -223000.0 -1.03 740033.0579 66900.0 0.36 -0.4745 -0.437 3131449 CMLD3_000243 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O06 compound treatment 585989.418 -86900.0 -0.4 605875.0 -67200.0 -0.36 -0.5355 -0.9983 3556257 CMLD3_000244 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C(=O)[C@H]2OC(=O)N[C@H]4CCCc5ccccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O07 mock treatment 718928.2511 46000.0 0.21 711209.4862 38100.0 0.2 0.2931 0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O08 mock treatment 652971.0744 -19900.0 -0.09 677214.9533 4130.0 0.02 -0.0495 -0.524 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O09 mock treatment 608257.0281 -64600.0 -0.3 624721.0526 -48400.0 -0.26 -0.3922 -0.9972 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O10 compound treatment 546082.9694 -127000.0 -0.58 589203.8835 -83900.0 -0.44 -0.7281 -0.9909 3556259 CMLD3_000245 COc1cccc(c1)[C@@H]2Oc3ccc(OC)cc3C[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O11 mock treatment 643426.4706 -29500.0 -0.14 588196.5066 -84900.0 -0.45 -0.4145 -0.8812 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O12 mock treatment 585135.8025 -87800.0 -0.4 673513.834 426.0 0.0 -0.2846 -0.7032 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O13 compound treatment 147104.1667 -526000.0 -2.42 138244.898 -535000.0 -2.84 -3.7205 -0.9969 3556261 CMLD3_000246 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)OCC)C#Cc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O14 compound treatment 146117.6471 -527000.0 -2.43 168000.0 -505000.0 -2.68 -3.6121 -0.9988 3556263 CMLD3_000247 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)OCC)C#Cc2ccc(C)cc2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O15 compound treatment 616302.0408 -56600.0 -0.26 660518.6722 -12600.0 -0.07 -0.2317 -0.8601 3556265 CMLD3_000248 CC(=O)c1ccc(O[C@@H]2[C@H](O)CO[C@H]2/C=C/c3ccc(Cl)cc3)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O16 compound treatment 605156.0284 -67700.0 -0.31 620457.6271 -52600.0 -0.28 -0.4183 -0.9984 3556008 CMLD3_000249 COc1ccc(O[C@H]2C=C[C@H](O[C@@H]2CO)C#Cc3ccc(F)cc3F)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O17 compound treatment 511215.0538 -162000.0 -0.75 525858.8235 -147000.0 -0.78 -1.0794 -0.9997 3556266 CMLD3_000250 CC(=CCC1(CC=C(C)C)C(=O)C(=C2OC(C)(C)CCC2(CC=C(C)C)C1=O)C(=O)c3ccccc3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O18 compound treatment 511727.2727 -161000.0 -0.74 566214.0078 -107000.0 -0.57 -0.9264 -0.9911 3556267 CMLD3_000251 CC1(CC2(C)C(CC1=O)/C=C/c3ccccc3)C=C2/C=C/C=C/c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O19 compound treatment 559481.3084 -113000.0 -0.52 589729.064 -83400.0 -0.44 -0.6825 -0.9965 1125649 CMLD3_000252 CNc1ccccc1C(=O)OCC(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O20 mock treatment 560797.5207 -112000.0 -0.52 535062.5 -138000.0 -0.73 -0.8832 -0.9855 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O21 mock treatment 630210.3175 -42700.0 -0.2 601610.687 -71500.0 -0.38 -0.4073 -0.9534 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O22 compound treatment 563075.2212 -110000.0 -0.51 605222.2222 -67900.0 -0.36 -0.6126 -0.986 3556269 CMLD3_000253 CNc1ccccc1C(=O)OCC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O23 compound treatment 528368.6441 -145000.0 -0.67 575593.1559 -97500.0 -0.52 -0.8369 -0.9921 3556270 CMLD3_000254 COc1ccc(/C=C/NC(=O)c2ccc(OC)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 O24 compound treatment 481484.0 -191000.0 -0.88 544356.4356 -129000.0 -0.68 -1.107 -0.9919 3556272 CMLD3_000255 COC(=O)N[C@H](/C(=C(\C)/NCc1ccccc1)/C(=O)OC)c2ccc(Cl)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P01 compound treatment 507069.5187 -166000.0 -0.76 541200.8547 -132000.0 -0.7 -1.0354 -0.999 3556274 CMLD3_000256 COC(=O)[C@@H](NC(=O)O[C@H]1[C@@H](Oc2cc(OC)ccc2C1=O)c3cccc(c3)C(F)(F)F)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P02 mock treatment 633368.932 -39500.0 -0.18 555787.3303 -117000.0 -0.62 -0.5688 -0.8774 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P03 mock treatment 651255.814 -21600.0 -0.1 640591.9283 -32500.0 -0.17 -0.1924 -0.9662 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P04 compound treatment 499653.8462 -173000.0 -0.8 445473.9336 -228000.0 -1.21 -1.4186 -0.9799 3556276 CMLD3_000257 COc1ccc2O[C@@H]([C@@H](OC(=O)Nc3ccc(C)c(Br)c3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P05 compound treatment 513566.0377 -159000.0 -0.73 558676.2295 -114000.0 -0.61 -0.9486 -0.9955 3011477 CMLD3_000258 COc1cccc(c1)[C@@H]2Oc3ccc(Br)cc3C(=O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P06 compound treatment 661333.3333 -11600.0 -0.05 571982.7586 -101000.0 -0.54 -0.4169 -0.7736 3556277 CMLD3_000259 COC(=O)[C@H](COC(C)(C)C)NC(=O)O[C@H]1[C@@H](Oc2ccc(OC)cc2C1=O)c3cccc(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P07 compound treatment 593546.2963 -79300.0 -0.37 635784.2324 -37300.0 -0.2 -0.3986 -0.9583 3556279 CMLD3_000260 COc1ccc2O[C@H]([C@H](OC(=O)NCCc3ccc(OC)c(OC)c3)C(=O)c2c1)c4ccc(OC)c(Br)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P08 compound treatment 554618.0258 -118000.0 -0.55 564281.5884 -109000.0 -0.58 -0.7938 -0.9996 3556280 CMLD3_000261 COc1ccc2C(=O)[C@@H](OC(=O)NS(=O)(=O)c3ccc(C)cc3)[C@@H](Oc2c1)c4cccc(c4)C(F)(F)F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P09 mock treatment 577135.9649 -95800.0 -0.44 567861.7886 -105000.0 -0.56 -0.7069 -0.9933 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P10 compound treatment 565144.7964 -108000.0 -0.5 567034.632 -106000.0 -0.56 -0.7491 -0.9981 3556282 CMLD3_000262 COc1ccc2C(=O)[C@H](OC(=O)NS(=O)(=O)c3ccc(C)cc3)[C@H](Oc2c1)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P11 mock treatment 580945.0 -91900.0 -0.42 535596.6387 -137000.0 -0.73 -0.8155 -0.9667 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P12 mock treatment 593041.4747 -79800.0 -0.37 541475.4098 -132000.0 -0.7 -0.754 -0.9553 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P13 compound treatment 600794.5736 -72100.0 -0.33 593053.719 -80000.0 -0.42 -0.5353 -0.9927 3556284 CMLD3_000263 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)OCC)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P14 compound treatment 146830.1887 -526000.0 -2.43 140777.7778 -532000.0 -2.82 -3.7119 -0.9971 3556286 CMLD3_000264 CCOC(=O)OC[C@H]1O[C@@H](C=C[C@@H]1OC(=O)OCC)C#Cc2ccc(F)cc2F 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P15 compound treatment 447888.8889 -225000.0 -1.04 436080.2139 -237000.0 -1.26 -1.6226 -0.9955 3556288 CMLD3_000265 Cc1cc(C)cc(/C=C/[C@@H]2OC[C@@H](O)[C@H]2Oc3ccc(cc3)C4CCCC4)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P16 compound treatment 478047.1698 -195000.0 -0.9 506051.5021 -167000.0 -0.89 -1.2618 -1.0 3556289 CMLD3_000266 Cc1cc(F)ccc1O[C@H]2C=C[C@H](O[C@@H]2CO)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P17 compound treatment 628661.9718 -44200.0 -0.2 573539.823 -99500.0 -0.53 -0.5176 -0.9144 3556073 CMLD3_000267 Clc1cc2nc3-c4ccccc4OC(CC=C)(c5ccccc5)c3nc2cc1Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P18 compound treatment 520147.8261 -153000.0 -0.7 534494.2529 -139000.0 -0.74 -1.0179 -0.9998 3556291 CMLD3_000268 COc1ccc(cc1)C(=O)Oc2cc(OC)cc(OC)c2C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P19 compound treatment 531794.2387 -141000.0 -0.65 546754.3103 -126000.0 -0.67 -0.9339 -0.9999 3556292 CMLD3_000269 CC(=C)C(O)/C=C/c1ccc(Br)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P20 mock treatment 567514.4033 -105000.0 -0.49 538391.791 -135000.0 -0.71 -0.8488 -0.9824 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P21 compound treatment 469064.9819 -204000.0 -0.94 494641.6938 -178000.0 -0.95 -1.3339 -1.0 3556294 CMLD3_000270 COC(=O)N[C@@H](/C=C/c1ccco1)[C@@]2(CCCC2=O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P22 compound treatment 388144.9275 -285000.0 -1.31 407281.8792 -266000.0 -1.41 -1.9254 -0.9994 3556296 CMLD3_000271 CC1(C)O[C@H]([C@@H](O1)C(O)(c2cc(F)c(F)c(F)c2)c3cc(F)c(F)c(F)c3)C(O)(c4cc(F)c(F)c(F)c4)c5cc(F)c(F)c(F)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P23 compound treatment 450862.2047 -222000.0 -1.02 518621.0938 -154000.0 -0.82 -1.3033 -0.9939 3556298 CMLD3_000272 COC(=O)N[C@H](C(C(=O)C)C(=O)OCC=C)c1ccco1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2284 P24 mock treatment 469007.874 -204000.0 -0.94 470352.459 -203000.0 -1.08 -1.4252 -0.9978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A01 compound treatment 509538.1166 -176000.0 -0.81 608237.8641 -102000.0 -0.54 -0.9575 -0.9803 1001670 ACon1_000001 COc1cc(O)c2C(=O)CC(Oc2c1)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A02 compound treatment 614963.1579 -71000.0 -0.33 681056.5217 -29100.0 -0.15 -0.3407 -0.9411 1023904 ACon1_000002 Oc1ccc2C(=O)c3cc(O)ccc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A03 compound treatment 594406.0914 -91600.0 -0.42 638373.1343 -71800.0 -0.38 -0.5678 -0.9987 3552049 ACon1_000003 C/C=C(\COC(=O)C)/C(=O)O[C@H]1[C@@H]2[C@H](OC(=O)C2=C)C3C(=C(C)[C@H]1O)C(=O)[C@H]4O[C@]43C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A04 compound treatment 732227.7228 46300.0 0.21 719041.0256 8890.0 0.05 0.1842 0.843 1039 ACon1_000004 CC[C@]1(CCCN2CCc3c4[C@@H]21)CC(=O)n4c5ccccc35 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A05 compound treatment 784688.8889 98700.0 0.46 669293.1034 -40900.0 -0.22 0.1687 0.3345 3559511 ACon1_000005 COC(=O)CC(=O)OC[C@@]1(C)CCC[C@]2(C)[C@H]3CC[C@]4(C)C[C@@]3(CCC12)C=C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A06 compound treatment 702064.3564 16100.0 0.07 883917.0306 174000.0 0.92 0.7042 0.7616 3551992 ACon1_000006 C/C/1=C\CCC2=CC(C\C(=C\C3OC(=O)C(=C)C3CC1)\C)OC2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A07 compound treatment 639785.7143 -46200.0 -0.21 809535.545 99400.0 0.53 0.2221 0.3908 3189572 ACon1_000007 CN1Cc2c3OCOc3ccc2[C@H]4[C@@H](O)Cc5cc6OCOc6cc5[C@H]41 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A08 compound treatment 732879.2271 46900.0 0.22 766136.9863 56000.0 0.3 0.363 0.9879 1116885 ACon1_000008 CCC(C)C1NC(=O)C(=C1O)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A09 compound treatment 772400.9434 86400.0 0.4 708887.3874 -1270.0 -0.01 0.2771 0.6951 3559537 ACon1_000009 C[C@H]1C[C@H]2OC(=O)C(=C)[C@H]2C[C@]3(C)[C@@H](O)[C@@H](O)CC13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A10 compound treatment 681148.5149 -4810.0 -0.02 852493.7238 142000.0 0.75 0.5181 0.686 3559847 ACon1_000010 OC[C@H]1O[C@@H](OCCC(=O)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A11 compound treatment 629638.009 -56300.0 -0.26 771619.5122 61500.0 0.33 0.0469 0.1124 3559600 ACon1_000011 COc1ccc2oc(c(O)c(=O)c2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A12 compound treatment 468732.1429 -217000.0 -1.0 346032.6087 -364000.0 -1.93 -2.074 -0.9533 3557478 ACon1_000012 CC(=CCc1c(O)ccc2C(=O)CC(Oc12)c3ccc(O)c(O)c3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A13 mock treatment 662032.7103 -23900.0 -0.11 825836.4486 116000.0 0.61 0.3558 0.5708 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A14 mock treatment 588945.9459 -97000.0 -0.45 756014.8515 45900.0 0.24 -0.1444 -0.2835 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A15 compound treatment 550273.1481 -136000.0 -0.63 772730.5936 62600.0 0.33 -0.2078 -0.2933 1138815 ACon1_000013 COc1cccc2OC(CC(=O)c12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A16 compound treatment 742576.7635 56600.0 0.26 867881.6327 158000.0 0.84 0.7762 0.8857 3553257 ACon1_000014 CC(=O)N(O)CCCC1NC(=O)CNC(=O)CNC(=O)CNC(=O)C(CCCN(O)C(=O)C)NC(=O)C(CCCN(O)C(=O)C)NC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A17 compound treatment 629224.7706 -56700.0 -0.26 762892.3767 52700.0 0.28 0.0128 0.0334 1527185 ACon1_000015 COc1ccccc1c2cc(=O)c3ccccc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A18 compound treatment 677388.2979 -8570.0 -0.04 647925.1337 -62200.0 -0.33 -0.2614 -0.7862 3558773 ACon1_000016 CC1CC[C@@]2(CC[C@]3(C(=O)O)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)C2C1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A19 compound treatment 673150.2591 -12800.0 -0.06 843882.0513 134000.0 0.71 0.4598 0.646 3559667 ACon1_000017 CCC1=CC2CN3CCc4c([nH]c5ccccc45)[C@@](C2)([C@H]31)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A20 compound treatment 652248.731 -33700.0 -0.16 600026.3158 -110000.0 -0.58 -0.523 -0.8652 3558449 ACon1_000018 C[C@@H]1OC(OC[C@H]2O[C@@H](Oc3cc(O)c4c(=O)cc(oc4c3)c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A21 compound treatment 644610.5263 -41400.0 -0.19 704879.8077 -5270.0 -0.03 -0.1546 -0.8023 1530 ACon1_000019 COc1ccc2c3CCN=C(C)c3[nH]c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A22 compound treatment 636103.7736 -49900.0 -0.23 694035.7143 -16100.0 -0.09 -0.223 -0.9092 3559224 ACon1_000020 CC(=O)c1ccc2OC(Cc2c1)C(=C)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A23 compound treatment 541050.5618 -145000.0 -0.67 605526.8293 -105000.0 -0.55 -0.865 -0.9957 3554786 ACon1_000021 COc1cc(/C=C/2\Oc3cc(O)ccc3C2=O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 A24 compound treatment 682597.2851 -3370.0 -0.02 743495.5357 33300.0 0.18 0.1141 0.6426 3559348 ACon1_000022 CC(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1Oc2ccccc2COC(=O)C3(O)C=CCCC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B01 compound treatment 215663.5514 -470000.0 -2.17 473231.6384 -237000.0 -1.26 -2.4222 -0.9663 3557968 ACon1_000023 CC(=CCc1c(O)c(CC=C(C)C)c2occ(c3ccc(O)cc3)c(=O)c2c1O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B02 compound treatment 658784.141 -27200.0 -0.13 717172.9958 7020.0 0.04 -0.0623 -0.4765 3555955 ACon1_000024 OCC(=C)C(=O)O[C@H]1C[C@@H]2[C@@H]([C@H]3OC(=O)C(=C)[C@@H]3[C@H](CC2=C)OC(=O)C(=C)CO)C1=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B03 compound treatment 802929.2035 117000.0 0.54 820549.1803 110000.0 0.59 0.7955 0.9992 3552206 ACon1_000025 C[C@@]1(CO)C(O)CC[C@@]2(C)[C@H](CCC3=CCOC3=O)C(=C)CC[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B04 compound treatment 727202.765 41200.0 0.19 863875.0 154000.0 0.82 0.711 0.8492 3554785 ACon1_000026 COc1c2occ(COC(=O)C)c2c(C=O)c3c(C)cccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B05 compound treatment 686050.6912 88.2 0.0 767800.0 57600.0 0.31 0.2165 0.708 3557493 ACon1_000027 CC1(C)CCCC2(C3CCC4CC3(CC4(O)CO)CCC12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B06 compound treatment 45616.6667 -640000.0 -2.95 57303.5714 -653000.0 -3.46 -4.5366 -0.9969 3614336 ACon1_000028 CC[C@@H]1OC(=O)[C@@H](C)[C@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@@H](C)[C@H](O)[C@](C)(C[C@H](C)C(=O)[C@@H](C)[C@H](O)[C@@]1(C)O)O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B07 compound treatment 803000.0 117000.0 0.54 938458.1281 228000.0 1.21 1.2379 0.9337 3557846 ACon1_000029 O[C@@H]1[C@@H](O)[C@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)O[C@@H]([C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B08 compound treatment 762021.645 76100.0 0.35 855853.5565 146000.0 0.77 0.7945 0.9361 3557557 ACon1_000030 C/C(=C/CC\C(=C\CC\C(=C\CC/C(=C\CO)/CO)\C)\C)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B09 compound treatment 713720.2073 27800.0 0.13 710990.8257 836.0 0.0 0.0937 0.7312 3554854 ACon1_000031 COc1cc(C)cc(C(=O)O)c1C2=C(O)C(=O)c3c(O)cccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B10 compound treatment 945243.2432 259000.0 1.2 1066632.653 356000.0 1.89 2.1825 0.9756 3553850 ACon1_000032 CC1(C)C[C@H](O)C[C@@]2(C)[C@H]1[C@H](O)C=C3COC(=O)[C@@]32O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B11 compound treatment 511497.7778 -174000.0 -0.8 575250.0 -135000.0 -0.72 -1.0749 -0.9983 2060482 ACon1_000033 CC(C)c1cc2CCC3C(C)(C)CCC[C@]3(C(=O)O)c2c(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B12 compound treatment 756805.5556 70800.0 0.33 832036.4372 122000.0 0.65 0.6881 0.95 3559288 ACon1_000034 CC1OC(OC2C(O)C(O[C@H]3[C@H](C)O[C@@H](OC4C(O)C(O)COC4OC(=O)[C@@]56CCC(C)(C)CC6C7=CCC8[C@@]9(C)C[C@H](O)[C@H](OC%10OC(CO)C(O)C(O)C%10O)[C@@](C)(CO)C9[C@H](O)C[C@@]8(C)[C@]7(C)CC5)[C@H](O)[C@@H]3O)OCC2O[C@H]%11OC[C@](O)(CO)[C@H]%11O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B13 mock treatment 746826.9231 60900.0 0.28 824691.9431 115000.0 0.61 0.628 0.9385 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B14 mock treatment 816418.5022 130000.0 0.6 760062.2407 49900.0 0.26 0.6126 0.932 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B15 compound treatment 652685.3448 -33300.0 -0.15 768713.0802 58600.0 0.31 0.1111 0.3207 3559345 ACon1_000035 CC(=CCc1cc(cc(O)c1O)c2coc3c(CC=C(C)C)c(O)cc(O)c3c2=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B16 compound treatment 777563.5593 91600.0 0.42 858774.4681 149000.0 0.79 0.8561 0.9573 3554649 ACon1_000036 COC(=O)C(=C)[C@]1(O[C@]2(C)CC1=O)[C@H](C[C@@]3(C)OC(=O)/C(=C/C)/[C@]3(O)CC2)OC(=O)C(CO)CN4CCCC4C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B17 compound treatment 715272.7273 29300.0 0.14 842703.8835 133000.0 0.7 0.5927 0.8279 3559460 ACon1_000037 CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B18 compound treatment 770576.1905 84600.0 0.39 819732.7189 110000.0 0.58 0.6869 0.9812 3557695 ACon1_000038 COC(=O)[C@@]1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@H](O)[C@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)C5CC[C@]43C)[C@@H]2C1)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B19 compound treatment 631917.4312 -54000.0 -0.25 833334.6939 123000.0 0.65 0.2857 0.4086 3558409 ACon1_000039 OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](O)C=C(COC(=O)c4ccc(O)cc4)[C@H]32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B20 compound treatment 841154.5455 155000.0 0.72 642757.6923 -67400.0 -0.36 0.2533 0.3166 3557530 ACon1_000040 COC(=O)C(=C)[C@@H]1[C@@H](O)C[C@@]2(COC(=O)C(=C)[C@@H]2[C@H]1O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B21 compound treatment 757409.5238 71400.0 0.33 656358.9744 -53800.0 -0.29 0.0312 0.0716 3559391 ACon1_000041 COc1cc(cc(OC)c1O)C2C(CO[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)C(CO)Cc4cc(OC)c(O)c(O)c24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B22 compound treatment 851610.6195 166000.0 0.76 748700.0 38500.0 0.2 0.6847 0.8659 3557713 ACon1_000042 CO[C@H]1[C@@H](O)[C@@H](C)O[C@@H](O[C@H]2CC[C@]3(C)C4CC[C@]5(C)[C@H](CC[C@]5(O)C4(O)CC(OC(=O)C)C3=C2)C6=CC(=O)OC6)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B23 compound treatment 712383.7209 26400.0 0.12 814663.9004 105000.0 0.55 0.4781 0.8424 3559546 ACon1_000043 CC12CCC=C(CO)C2CC3C(C1)OC(=O)C3=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 B24 compound treatment 646200.8734 -39800.0 -0.18 737511.4155 27400.0 0.15 -0.0271 -0.1157 3557636 ACon1_000044 OC(=O)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C01 compound treatment 554575.3425 -131000.0 -0.61 726460.177 16300.0 0.09 -0.3673 -0.6001 3558824 ACon1_000045 OCC(=C)C(=O)O[C@H]1CC(=C)[C@@H]2C[C@H](O)C(=C)[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C02 compound treatment 827022.9358 141000.0 0.65 740321.608 30200.0 0.16 0.5731 0.8555 3559748 ACon1_000046 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C03 compound treatment 668865.0307 -17100.0 -0.08 595583.9416 -115000.0 -0.61 -0.4854 -0.7922 831758 ACon1_000047 Oc1ccc(/C=C/C(=O)c2ccc(O)cc2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C04 compound treatment 782118.5567 96200.0 0.44 798280.543 88100.0 0.47 0.6441 0.9997 1054577 ACon1_000048 COc1cc(cc(OC)c1OC)c2cc(=O)c3c(O)c(OC)c(OC)c(OC)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C05 compound treatment 779227.5132 93300.0 0.43 763652.6316 53500.0 0.28 0.5048 0.9796 3558524 ACon1_000049 COc1c(O)c2c(=O)c(O)c(oc2c(OC)c1OC)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C06 compound treatment 779560.3865 93600.0 0.43 870158.371 160000.0 0.85 0.9053 0.9508 3559371 ACon1_000050 COC(=O)C1=CO[C@@H](OC2OC(O)C(O)C(O)C2CO)[C@H]3[C@@H]1C=CC43OC(=O)C(=C4)[C@H](C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C07 compound treatment 693565.8537 7600.0 0.04 548547.8723 -162000.0 -0.86 -0.5813 -0.6776 3559455 ACon1_000051 COc1cc(/C=C/C(=O)OC2CC3CCC2(C)C3(C)C)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C08 compound treatment 816578.9474 131000.0 0.6 875706.1856 166000.0 0.88 1.0468 0.9831 3559354 ACon1_000052 CC(CCC1(C)C(C)CCC2(C)C1CC(=O)C=C2C)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C09 compound treatment 830658.1633 145000.0 0.67 879149.7797 169000.0 0.9 1.1057 0.9894 3553479 ACon1_000053 CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C10 compound treatment 505267.0807 -181000.0 -0.83 632046.9799 -78100.0 -0.41 -0.8822 -0.948 3553171 ACon1_000054 CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)[C@H]([C@H](O)C(C)(C)C5CC[C@]43C)C(=O)O)C12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C11 mock treatment 799492.5373 114000.0 0.52 757341.5842 47200.0 0.25 0.5472 0.9429 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C12 mock treatment 795303.3175 109000.0 0.5 730267.2811 20100.0 0.11 0.432 0.8382 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C13 compound treatment 840246.5116 154000.0 0.71 974538.4615 264000.0 1.4 1.4947 0.9505 1016235 ACon1_000055 O=c1cc(oc2ccccc12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C14 compound treatment 724220.1835 38300.0 0.18 817405.4054 107000.0 0.57 0.527 0.8848 3553953 ACon1_000056 CC12CC3(CC2C1CC34)CC(O)C5C(CO)(CO)CC(=O)CC45C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C15 mock treatment 616225.9615 -69700.0 -0.32 796419.8113 86300.0 0.46 0.0961 0.1719 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C16 mock treatment 741240.8377 55300.0 0.25 641337.963 -68800.0 -0.37 -0.0778 -0.1748 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C17 compound treatment 758553.5714 72600.0 0.33 660074.7664 -50100.0 -0.27 0.0489 0.1144 1134 ACon1_000057 CN1C[C@H](CO)C=C2[C@H]1Cc3c[nH]c4cccc2c34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C18 compound treatment 766493.0876 80500.0 0.37 654037.6344 -56100.0 -0.3 0.0521 0.1095 3557809 ACon1_000058 COc1cc(/C=C/CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C19 compound treatment 447161.0738 -239000.0 -1.1 551793.3333 -158000.0 -0.84 -1.3726 -0.9911 3559685 ACon1_000059 COc1cc(O)c(CC=C(C)C)c(O)c1C(=O)CCc2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C20 compound treatment 709461.5385 23500.0 0.11 772909.9099 62800.0 0.33 0.312 0.8913 3559829 ACon1_000060 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C21 compound treatment 854586.3874 169000.0 0.78 854042.328 144000.0 0.76 1.0895 1.0 297849 ACon1_000061 COc1ccc2c(c1)[nH]c3c(C)nccc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C22 compound treatment 685209.0909 -753.0 0.0 731909.8361 21800.0 0.12 0.0791 0.6855 3559835 ACon1_000062 COc1cc2ccc(=O)oc2c(CC=C(C)C)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C23 compound treatment 65229.1667 -621000.0 -2.86 70023.8095 -640000.0 -3.4 -4.425 -0.9964 3559675 ACon1_000063 Oc1ccc(cc1)[C@@H]2Oc3cc(O)cc(O)c3C(=O)[C@@H]2[C@H]4[C@@H](Oc5cc(O)cc(O)c5C4=O)c6ccc(O)cc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 C24 compound treatment 673237.6682 -12700.0 -0.06 845387.234 135000.0 0.72 0.4657 0.6471 3557563 ACon1_000064 CC(=CC(O)C/C(=C/COc1ccc2ccc(=O)oc2c1)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D01 compound treatment 500053.7634 -186000.0 -0.86 559428.5714 -151000.0 -0.8 -1.1715 -0.9994 4614 ACon1_000065 CCCCCCC/C=C\[C@H](O)C#CC#C[C@@H](O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D02 compound treatment 802402.1739 116000.0 0.54 809443.3498 99300.0 0.53 0.7521 1.0 3559481 ACon1_000066 C/C/1=C\[C@H]2OC(=O)C(=C)C2[C@@H](C\C(=C\CC1)\C)OC(=O)\C(=C\CO)\CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D03 compound treatment 691263.6816 5300.0 0.02 823601.7699 113000.0 0.6 0.4428 0.7352 3558310 ACon1_000067 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D04 compound treatment 638489.3617 -47500.0 -0.22 409087.9121 -301000.0 -1.6 -1.284 -0.7966 3559638 ACon1_000068 CC(=CCc1c(O)cc2OC(CC(=O)c2c1O)c3ccc(O)cc3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D05 compound treatment 715884.6154 29900.0 0.14 907881.6327 198000.0 1.05 0.8391 0.7933 3555862 ACon1_000069 OC(=O)CCCCCCC/C=C/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D06 compound treatment 697345.5497 11400.0 0.05 602043.1373 -108000.0 -0.57 -0.3684 -0.6397 3559157 ACon1_000070 COc1c(CO)c(O)cc2C(=O)c3ccccc3C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D07 compound treatment 818305.2632 132000.0 0.61 961533.0579 251000.0 1.33 1.3744 0.9373 3557565 ACon1_000071 CC(=CCC/C(=C/COc1ccc2ccc(=O)oc2c1)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D08 compound treatment 795508.6957 110000.0 0.51 807863.6364 97700.0 0.52 0.7237 0.9999 3554888 ACon1_000072 COc1cc(ccc1O)c2oc3cc(O)c(OC)c(O)c3c(=O)c2O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O[C@@H]6OCC(O)(CO)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D09 compound treatment 585972.8261 -100000.0 -0.46 780044.2478 69900.0 0.37 -0.0639 -0.1081 3558155 ACon1_000073 C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(oc3c2)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D10 compound treatment 817734.5972 132000.0 0.61 722861.1111 12700.0 0.07 0.4774 0.7807 3614338 ACon1_000074 CC(C)C(NC(=O)c1ccc(O)cc1)C(=O)N2CCCC2C(=O)Nc3c(O)cccc3C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D11 mock treatment 732185.7923 46200.0 0.21 772447.3684 62300.0 0.33 0.3844 0.9775 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D12 mock treatment 879752.3364 194000.0 0.89 735247.9675 25100.0 0.13 0.726 0.8036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D13 compound treatment 735926.2673 50000.0 0.23 650962.0853 -59200.0 -0.31 -0.0591 -0.1517 1251 ACon1_000075 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D14 compound treatment 913257.7778 227000.0 1.05 842008.6957 132000.0 0.7 1.2357 0.9807 3554269 ACon1_000076 CCCCCC(O)CC(O)CC(=O)OC(CC(O)CCCCC)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D15 mock treatment 741066.9643 55100.0 0.25 752292.3729 42100.0 0.22 0.3377 0.998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D16 mock treatment 785903.2258 99900.0 0.46 801037.5587 90900.0 0.48 0.6668 0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D17 compound treatment 771721.4612 85800.0 0.4 749929.1667 39800.0 0.21 0.4288 0.9567 3559890 ACon1_000077 COc1c(O)cc2occ(c3ccccc3O)c(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D18 compound treatment 764351.5982 78400.0 0.36 767552.2388 57400.0 0.3 0.4709 0.9963 3557697 ACon1_000078 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@H](O)[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(=O)O)[C@@](C)(CO)C5CC[C@]43C)C2C1)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D19 compound treatment 698579.7872 12600.0 0.06 668262.5 -41900.0 -0.22 -0.116 -0.5049 3557614 ACon1_000079 COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D20 compound treatment 707044.843 21100.0 0.1 803101.1236 92900.0 0.49 0.4173 0.8306 3554651 ACon1_000080 COC(=O)C(=C)[C@H]1[C@H](O)C2C(=C)C(=O)OC[C@]2(C[C@@H]1OC(=O)C(=C)CO)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D21 compound treatment 695119.8157 9160.0 0.04 753342.1053 43200.0 0.23 0.1918 0.8236 3558580 ACon1_000081 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D22 compound treatment 699893.8053 13900.0 0.06 610653.9924 -99500.0 -0.53 -0.3277 -0.6165 3557892 ACon1_000082 CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)C)[C@H]3C[C@H](OC(=O)C)[C@](O)(COC(=O)C)[C@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D23 compound treatment 709366.8122 23400.0 0.11 700154.5455 -10000.0 -0.05 0.0388 0.3228 3559584 ACon1_000083 CC1(C)[C@H](O)CC[C@@]2(C)[C@@H]3CC[C@@](C)(CC3=CC[C@H]12)C(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 D24 compound treatment 608276.0181 -77700.0 -0.36 561044.1767 -149000.0 -0.79 -0.8126 -0.9359 3554996 ACon1_000084 COC1CC(O[C@H]2CC[C@@]3(C)[C@H](CC[C@]4(CC[C@H](C5=CC(=O)OC5)[C@@]6(C)CCC34)C6=O)C2)OC(C)C1OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E01 mock treatment 644068.4211 -41900.0 -0.19 624036.0825 -86100.0 -0.46 -0.4596 -0.9267 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E02 mock treatment 736641.4141 50700.0 0.23 709939.0863 -216.0 0.0 0.1645 0.7036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E03 compound treatment 689942.2222 3980.0 0.02 976899.0385 267000.0 1.41 1.0134 0.7162 451 ACon1_000085 Cn1cnc2n(C)c(=O)n(C)c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E04 compound treatment 713111.6505 27100.0 0.13 946492.823 236000.0 1.25 0.9749 0.7739 687 ACon1_000086 CO[C@H]1[C@@H](C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)c6cc(OC)c(OC)c(OC)c6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E05 compound treatment 851938.0952 166000.0 0.77 943586.7769 233000.0 1.24 1.4167 0.9733 1225 ACon1_000087 Oc1cc(O)c2c(=O)cc(oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E06 compound treatment 686368.8889 406.0 0.0 902178.5714 192000.0 1.02 0.7215 0.7084 3557593 ACon1_000088 C/C(=C/CO)/CC[C@@H]1[C@@](C)(O)CCC2C(C)(C)CCC[C@@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E07 compound treatment 695920.7921 9960.0 0.05 724607.362 14500.0 0.08 0.0867 0.97 3559517 ACon1_000089 C[C@@H]1CC[C@]2(C)[C@H](CCC=C2C)[C@]1(CCc3ccoc3)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E08 compound treatment 853465.812 168000.0 0.77 1025273.109 315000.0 1.67 1.7281 0.9385 3557755 ACon1_000090 COc1cc(CCCO)cc2C(CO)C(Oc21)c3ccc(O[C@H]4O[C@H](C)[C@@H](O)[C@H](O)[C@@H]4O)c(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E09 mock treatment 920490.4762 235000.0 1.08 797302.0833 87100.0 0.46 1.0916 0.9281 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E10 mock treatment 824081.6327 138000.0 0.64 749628.2723 39500.0 0.21 0.5984 0.8926 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E11 compound treatment 801194.3128 115000.0 0.53 780420.7921 70300.0 0.37 0.6393 0.9849 3559616 ACon1_000091 CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E12 compound treatment 734314.554 48400.0 0.22 877536.0825 167000.0 0.89 0.7854 0.8581 3557829 ACon1_000092 CC(C)(O)[C@@H]1CC[C@@]2(C)C[C@@H](O)CC(=C)C2C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E13 compound treatment 906215.6863 220000.0 1.02 829609.5238 119000.0 0.63 1.1662 0.9742 1052342 ACon1_000093 Oc1ccc2c(=O)cc(oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E14 compound treatment 799217.8218 113000.0 0.52 924555.5556 214000.0 1.14 1.1734 0.9377 3555904 ACon1_000094 OC[C@H]1O[C@@H](Oc2cc(O)cc3OC(O)(Cc4ccc(O)cc4)C(=O)c32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E15 compound treatment 747097.2973 61100.0 0.28 831625.0 121000.0 0.64 0.6549 0.9313 3554527 ACon1_000095 COC(=O)[C@@]1(O)C=CC[C@@H]2[C@@]3(C)C[C@H](OC(=O)[C@H]3CC[C@]21C)c4ccoc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E16 compound treatment 812566.5025 127000.0 0.58 833775.8621 124000.0 0.66 0.8765 0.9983 3558041 ACon1_000096 O[C@H]1CO[C@@H](OC[C@H]2O[C@@H](OC/C=C/c3ccccc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E17 mock treatment 652796.1165 -33200.0 -0.15 842909.9099 133000.0 0.7 0.3897 0.5409 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E18 mock treatment 886841.629 201000.0 0.93 807132.7014 97000.0 0.51 1.0188 0.9615 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E19 compound treatment 712376.4045 26400.0 0.12 698402.6549 -11800.0 -0.06 0.0421 0.3074 976 ACon1_000097 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E20 compound treatment 884878.0488 199000.0 0.92 720625.0 10500.0 0.06 0.6879 0.7485 3554687 ACon1_000098 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1C=CC43OC(=O)C(=C4)[C@H](C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E21 compound treatment 679546.9388 -6420.0 -0.03 737286.3436 27100.0 0.14 0.0808 0.5502 3553328 ACon1_000099 CC(=O)O[C@@H]1[C@H]2CC[C@@H]3[C@@]1(C[C@@]2(C)O)C[C@@H](O)[C@@]4(O)[C@@H](C[C@H](O)C4(C)C)[C@]3(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E22 compound treatment 750131.3131 64200.0 0.3 758644.0 48500.0 0.26 0.3911 0.9976 3559845 ACon1_000100 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E23 compound treatment 637343.1373 -48600.0 -0.22 665903.0612 -44300.0 -0.23 -0.3245 -0.9997 1013994 ACon1_000101 Oc1ccc(O)c2C(=O)c3ccccc3C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 E24 compound treatment 589666.6667 -96300.0 -0.44 689088.2353 -21100.0 -0.11 -0.393 -0.8583 3554732 ACon1_000102 COC(=O)c1cccc2nc3c(cccc3nc12)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F01 mock treatment 794276.1905 108000.0 0.5 735710.0 25600.0 0.14 0.449 0.8676 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F02 mock treatment 697115.942 11200.0 0.05 993082.9016 283000.0 1.5 1.0975 0.7309 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F03 compound treatment 734970.297 49000.0 0.23 795900.4329 85700.0 0.45 0.4814 0.9479 3557765 ACon1_000103 C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4cc(O)c(O)c(O)c4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F04 compound treatment 1050668.317 365000.0 1.68 945152.0 235000.0 1.25 2.0706 0.9891 3559590 ACon1_000104 CC1=CC(=O)C2=C(C)CCC3[C@H](OC(=O)C3=C)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F05 compound treatment 676094.0171 -9870.0 -0.05 778654.8673 68500.0 0.36 0.2247 0.6137 3557685 ACon1_000105 CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F06 compound treatment 684215.9624 -1750.0 -0.01 917536.4807 207000.0 1.1 0.7721 0.7019 3554203 ACon1_000106 CCc1c(O)cc(OC)c2C(=O)C[C@@H](C)Oc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F07 compound treatment 884111.6505 198000.0 0.91 812003.937 102000.0 0.54 1.0281 0.9685 3558903 ACon1_000107 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@](C)(CO)C5CC[C@]43C)C2[C@@H]1O)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F08 compound treatment 782558.6854 96600.0 0.45 841741.0359 132000.0 0.7 0.8085 0.9765 3557773 ACon1_000108 COc1cc(/C=C/CO)cc(OC)c1O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F09 mock treatment 754176.7677 68200.0 0.31 829402.5424 119000.0 0.63 0.6697 0.948 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F10 mock treatment 711797.2973 25800.0 0.12 952076.6129 242000.0 1.28 0.9916 0.7695 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F11 compound treatment 699024.5902 13100.0 0.06 729925.0936 19800.0 0.1 0.1167 0.9654 3559308 ACon1_000109 C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](OC(=O)C)[C@@H](O)[C@H]4O)c(oc3c2)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F12 compound treatment 730219.0476 44300.0 0.2 887585.6574 177000.0 0.94 0.8098 0.8409 1216977 ACon1_000110 CC1(C)Oc2ccc3ccc(=O)oc3c2CC1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F13 compound treatment 774425.6198 88500.0 0.41 903449.3243 193000.0 1.03 1.0134 0.9184 3559144 ACon1_000111 CC1CCC2(CCC3(C)C(=CCC4C5(C)C[C@@H](O)[C@@H](O)C(C)(CO)C5CCC43C)C2C1(C)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F14 compound treatment 758990.3382 73000.0 0.34 735379.845 25200.0 0.13 0.3327 0.9182 3552034 ACon1_000112 C/C=C(\C)/C(=O)OC(\C=C\C(O)C(C)O)C1OC(=O)C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F15 compound treatment 574055.1181 -112000.0 -0.52 755052.1327 44900.0 0.24 -0.1965 -0.3458 3552812 ACon1_000113 C[C@@H]1OC(O[C@@H]2[C@@H](O)[C@H](OCCc3ccc(O)c(O)c3)O[C@H](CO)[C@H]2OC(=O)/C=C/c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F16 compound treatment 761971.3115 76000.0 0.35 681442.8571 -28700.0 -0.15 0.1402 0.3668 3557622 ACon1_000114 COc1ccc(CCC(=O)O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F17 mock treatment 611740.7407 -74200.0 -0.34 765709.5436 55600.0 0.29 -0.0337 -0.0746 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F18 mock treatment 808231.5271 122000.0 0.56 708042.0168 -2110.0 -0.01 0.3908 0.6929 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F19 compound treatment 686365.4822 403.0 0.0 694455.3991 -15700.0 -0.08 -0.0576 -0.6912 3552693 ACon1_000115 C[C@@H]1CC[C@@]2(CC[C@]3(C)C4=CCC5C(C)(C)[C@H](CC[C@]5(C)C4CC[C@@]3(C)[C@@H]2[C@H]1C)O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F20 compound treatment 655847.1074 -30100.0 -0.14 676769.9115 -33400.0 -0.18 -0.2234 -0.9928 3554774 ACon1_000116 COc1c(OC/C=C(\C)/CC2OC(=O)C(=C2)C)ccc3ccc(=O)oc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F21 compound treatment 707635.0365 21700.0 0.1 515067.5241 -195000.0 -1.03 -0.661 -0.6358 3559078 ACon1_000117 CC1OC(OC2C(O)C(OC3CCC4(C)C(CCC5(C)C4CC=C6C7CC(C)(C)CCC7(CCC65C)C(=O)OC8OC(CO)C(O)C(O)C8O)C3(C)C)OC(C2O)C(=O)O)C(OC9OC(CO)C(O)C(O)C9O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F22 compound treatment 555424.3902 -131000.0 -0.6 592273.5043 -118000.0 -0.63 -0.8678 -0.9998 3557936 ACon1_000118 Oc1ccc(cc1)c2cc(=O)c3c(O)cc(O)c(c4c(oc5cc(O)cc(O)c5c4=O)c6ccc(O)cc6)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F23 compound treatment 692079.4979 6120.0 0.03 635623.3766 -74500.0 -0.4 -0.2596 -0.655 3553532 ACon1_000119 CC(C)C(=O)OC1c2c(C)coc2C(=O)C3[C@@H](O)CC[C@H](C)[C@@]13C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 F24 compound treatment 557873.7374 -128000.0 -0.59 641346.6135 -68800.0 -0.36 -0.6758 -0.9732 3614339 ACon1_000120 O[C@@H]1C[C@](O)(C[C@@H](O)[C@@H]1OC(=O)/C=C/c2ccc(O)c(O)c2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G01 compound treatment 586194.4444 -99800.0 -0.46 620640.553 -89500.0 -0.47 -0.6611 -0.9999 3559490 ACon1_000121 CC1(C)CCC[C@@]2(C)[C@H](CC/C(=C/CO)/CO)C(=CCC12)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G02 compound treatment 650287.1287 -35700.0 -0.16 631067.2269 -79100.0 -0.42 -0.413 -0.9165 3060043 ACon1_000122 C[C@@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G03 mock treatment 650253.5885 -35700.0 -0.16 681437.5 -28700.0 -0.15 -0.2241 -0.9992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G04 mock treatment 670793.722 -15200.0 -0.07 748440.5941 38300.0 0.2 0.0941 0.4382 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G05 compound treatment 687922.7053 1960.0 0.01 609290.7489 -101000.0 -0.53 -0.3719 -0.6951 3559421 ACon1_000123 C[C@H](C[C@@H]1CC=CC(=O)O1)OC(=O)CCc2ccc(O)c(O)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G06 compound treatment 673212.6697 -12700.0 -0.06 646188.0734 -64000.0 -0.34 -0.2815 -0.8175 3559357 ACon1_000124 COc1cc(OC)c(C(=O)/C=C/c2ccccc2)c(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G07 compound treatment 561714.9533 -124000.0 -0.57 574632.287 -136000.0 -0.72 -0.9134 -0.9937 3559500 ACon1_000125 C[C@@]1(CCC2C(=C1)CCC3[C@@](C)(CCCC23C)C(=O)O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G08 compound treatment 320878.0488 -365000.0 -1.68 416428.5714 -294000.0 -1.56 -2.2921 -0.9992 3553967 ACon1_000126 CC1CC(=O)c2c(O)c3c(O)cc(O)c(c4c(O)cc(O)c5c(O)c6C(=O)CC(C)Oc6cc45)c3cc2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G09 compound treatment 548014.5631 -138000.0 -0.64 639123.6364 -71000.0 -0.38 -0.7162 -0.9687 3559571 ACon1_000127 COC(=O)/C=C(/CC[C@@H]1C(=C)CC[C@@H]2C(C)(C)CCC[C@@]12C)\COC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G10 compound treatment 702409.7744 16400.0 0.08 631477.8481 -78700.0 -0.42 -0.2414 -0.5693 3557671 ACon1_000128 OCCC(=O)c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G11 compound treatment 555330.0 -131000.0 -0.6 645225.1082 -64900.0 -0.34 -0.6695 -0.9648 3559625 ACon1_000129 COC(=O)C1(C)CCCC(=C)C1CC/C(=C/CCc2ccoc2)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G12 compound treatment 567072.8745 -119000.0 -0.55 595323.741 -115000.0 -0.61 -0.8184 -0.9986 3554892 ACon1_000130 COc1cc(ccc1O)c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@H](O)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G13 compound treatment 650256.6372 -35700.0 -0.16 697100.0 -13100.0 -0.07 -0.1654 -0.9259 3552088 ACon1_000131 C/C=C/C=C/C(=O)NCCc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G14 compound treatment 576313.0081 -110000.0 -0.51 547148.265 -163000.0 -0.86 -0.9689 -0.9674 3554659 ACon1_000132 COC(=O)C1(Cc2ccc(O)c(CC=C(C)C)c2)OC(=O)C(=C1c3ccc(O)cc3)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G15 compound treatment 597479.638 -88500.0 -0.41 630011.4068 -80100.0 -0.43 -0.5891 -0.9998 3559582 ACon1_000133 CC1=CC[C@H](O)[C@@]2(C)C[C@@H](O)[C@@H]3[C@@H](OC(=O)C3=C)[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G16 compound treatment 578931.0345 -107000.0 -0.49 586191.4894 -124000.0 -0.66 -0.8139 -0.99 3552120 ACon1_000134 C[C@@]1(C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12)OC(=O)/C=C/c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G17 compound treatment 656892.3077 -29100.0 -0.13 537593.6396 -173000.0 -0.92 -0.742 -0.8021 926 ACon1_000135 Oc1cccc2C(=O)c3cccc(O)c3C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G18 compound treatment 602167.3469 -83800.0 -0.39 590466.1654 -120000.0 -0.63 -0.7221 -0.9717 3559321 ACon1_000136 CC(=CCC[C@](C)(O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]3CC[C@]4(C)C3[C@H](O)CC5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)C(C)(C)C6CC[C@]54C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G19 mock treatment 548917.3228 -137000.0 -0.63 641404.4444 -68800.0 -0.36 -0.7047 -0.9659 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G20 mock treatment 624947.619 -61000.0 -0.28 544118.9591 -166000.0 -0.88 -0.8217 -0.8888 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G21 compound treatment 588468.9922 -97500.0 -0.45 592226.4957 -118000.0 -0.63 -0.7602 -0.9869 3559673 ACon1_000137 CC(=O)OCC1=C[C@@H](O)[C@@H]2C=CO[C@@H](OC3OC(CO)C(O)C(O)C3O)[C@@H]21 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G22 compound treatment 612937.8238 -73000.0 -0.34 649567.8392 -60600.0 -0.32 -0.4654 -0.9997 3557624 ACon1_000138 COc1ccc(/C=C/C(=O)O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G23 compound treatment 601486.3388 -84500.0 -0.39 559251.0823 -151000.0 -0.8 -0.8414 -0.9453 895 ACon1_000139 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc3cc(O)c4C(=O)C[C@H](Oc4c3)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 G24 compound treatment 557700.0 -128000.0 -0.59 601085.9375 -109000.0 -0.58 -0.8273 -0.9999 3551965 ACon1_000140 C/C(=C\CC[C@](C)(O)C=C)/C(=O)O[C@@H]1[C@@H]2O[C@]2(C)[C@H]3[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)OC=C[C@@]13O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H01 compound treatment 679761.4679 -6200.0 -0.03 691981.2207 -18200.0 -0.1 -0.0884 -0.879 3559838 ACon1_000141 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C6[C@@H]7CC(C)(C)CC[C@@]7(CC[C@]65C)C(=O)O[C@@H]8O[C@H](CO[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](O)[C@H](O)[C@H]8O)[C@]3(C)CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H02 compound treatment 727680.4124 41700.0 0.19 740504.902 30400.0 0.16 0.2499 0.9961 3559607 ACon1_000142 COC1=CC(=O)O[C@@H](CCc2ccccc2)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H03 mock treatment 671619.0476 -14300.0 -0.07 796773.8693 86600.0 0.46 0.2781 0.5991 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H04 mock treatment 739995.4955 54000.0 0.25 819045.2489 109000.0 0.58 0.5846 0.9294 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H05 compound treatment 889056.6038 203000.0 0.94 747592.0 37400.0 0.2 0.8027 0.8384 1322 ACon1_000143 COc1cc2ccc(=O)oc2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H06 compound treatment 687191.1111 1230.0 0.01 675072.3982 -35100.0 -0.19 -0.1276 -0.6853 3559370 ACon1_000144 COc1cc2oc(=O)ccc2cc1CC(O)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H07 compound treatment 489493.2735 -196000.0 -0.91 586558.4906 -124000.0 -0.66 -1.1042 -0.9874 3558770 ACon1_000145 Oc1cc(cc(O)c1O)C(=O)OC[C@H]2O[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](OC(=O)c4cc(O)c(O)c(O)c4)[C@@H](OC(=O)c5cc(O)c(O)c(O)c5)[C@@H]2OC(=O)c6cc(O)c(O)c(O)c6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H08 compound treatment 610833.3333 -75100.0 -0.35 710163.1944 8.55 0.0 -0.245 -0.707 3557705 ACon1_000146 O=C(/C=C/CCc1ccc2OCOc2c1)N3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H09 compound treatment 155622.6415 -530000.0 -2.45 281393.9394 -429000.0 -2.27 -3.3375 -0.9993 3553890 ACon1_000147 CC1(O)CC(=O)c2c(C1)ccc3C(=O)c4c(O)cccc4C(=O)c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H10 compound treatment 650197.0443 -35800.0 -0.16 665518.0723 -44600.0 -0.24 -0.284 -0.9844 3554182 ACon1_000148 CCC(O)CC1CCC(O1)C(C)C(=O)OC(C)CC2CCC(O2)C(C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H11 compound treatment 659713.6564 -26200.0 -0.12 626158.0882 -84000.0 -0.45 -0.4006 -0.8678 3557869 ACon1_000149 C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)cc4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H12 compound treatment 674715.4812 -11200.0 -0.05 691253.9683 -18900.0 -0.1 -0.1076 -0.953 3555354 ACon1_000150 COc1oc2cccc(C)c2c(=O)c1C(C)(C)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H13 compound treatment 561597.2222 -124000.0 -0.57 588073.0769 -122000.0 -0.65 -0.8634 -0.9982 3553324 ACon1_000151 CC(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](COC(=O)C2(O)C=CCCC2=O)O[C@H]1Oc3ccccc3COC(=O)C4(O)C=CCCC4=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H14 compound treatment 626302.6316 -59700.0 -0.28 618264.3172 -91900.0 -0.49 -0.5392 -0.9634 3557583 ACon1_000152 CC1CCC2=C(CCCC2(C)C(=O)O)C1(C)CCc3ccoc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H15 compound treatment 537039.0625 -149000.0 -0.69 728732.7586 18600.0 0.1 -0.416 -0.5995 3558739 ACon1_000153 COc1cc(OC)c2ccc(=O)oc2c1CC(O)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H16 compound treatment 539988.0952 -146000.0 -0.67 549542.7509 -161000.0 -0.85 -1.0784 -0.9932 3557708 ACon1_000154 C[C@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)C4[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)C4CC[C@]3(O)C2)C6=CC(=O)OC6)[C@@H](O)[C@@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H17 compound treatment 593369.9634 -92600.0 -0.43 680715.3025 -29400.0 -0.16 -0.4123 -0.9069 3557703 ACon1_000155 O=C(/C=C/C=C/c1ccc2OCOc2c1)N3CCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H18 compound treatment 545007.1942 -141000.0 -0.65 643834.507 -66300.0 -0.35 -0.7084 -0.9584 3557644 ACon1_000156 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2O[C@H]3[C@H](O)[C@H](O[C@@H](O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC[C@@]78OC[C@@]9(CCC(C)(C)CC98)[C@H](O)C[C@]76C)C4(C)C)[C@@H]3O[C@@H]%10O[C@H](CO)[C@@H](O[C@@H]%11OC[C@@H](O)[C@H](O)[C@H]%11O)[C@H](O)[C@H]%10O)C(=O)O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H19 mock treatment 619295.082 -66700.0 -0.31 560754.0984 -149000.0 -0.79 -0.7777 -0.915 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H20 mock treatment 584429.1667 -102000.0 -0.47 506634.4828 -204000.0 -1.08 -1.0944 -0.9301 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H21 compound treatment 478622.5166 -207000.0 -0.96 534081.2721 -176000.0 -0.93 -1.3365 -0.9999 3559541 ACon1_000157 C[C@]12C[C@H]3OC(=O)C(=C)[C@H]3C[C@H]2C(=C)[C@H](O)C[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H22 compound treatment 556345.7944 -130000.0 -0.6 514937.7289 -195000.0 -1.04 -1.1548 -0.9659 3557933 ACon1_000158 C/C=C(/C)\C(=O)OC1C(OC(=O)C)c2c(OC1(C)C)ccc3ccc(=O)oc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H23 compound treatment 528122.5296 -158000.0 -0.73 559090.5797 -151000.0 -0.8 -1.0813 -0.9989 3555130 ACon1_000159 COc1ccc(cc1)c2cc(=O)c3c(O)c(OC)c(O)c(OC)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 H24 compound treatment 514640.6926 -171000.0 -0.79 566330.7692 -144000.0 -0.76 -1.0981 -0.9998 3557750 ACon1_000160 O[C@@H]1C=C(C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I01 compound treatment 692038.835 6080.0 0.03 674580.1887 -35600.0 -0.19 -0.1136 -0.5956 3559527 ACon1_000161 CC1=CC[C@@H]2[C@H]1[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](CC2=C)OC(=O)/C(=C/CO)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I02 compound treatment 711005.3476 25000.0 0.12 715379.6296 5220.0 0.03 0.1013 0.8526 2120761 ACon1_000162 COc1cc(OC)c(C(=O)/C=C/c2ccc(OC)c(OC)c2)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I03 compound treatment 805159.2357 119000.0 0.55 777136.3636 67000.0 0.36 0.6399 0.9777 3559509 ACon1_000163 COC(=O)CCC(=O)OC[C@]1(C)CCC[C@@]2(C)C3CC[C@@]4(C)CC3(CCC12)C=C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I04 compound treatment 663882.6291 -22100.0 -0.1 919397.3214 209000.0 1.11 0.7128 0.6395 3557562 ACon1_000164 C/C(=C\COc1ccc2ccc(=O)oc2c1)/CC3OC(=O)C(=C3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I05 mock treatment 777567.5676 91600.0 0.42 966766.9173 257000.0 1.36 1.2611 0.8849 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I06 mock treatment 641991.1894 -44000.0 -0.2 713820.2247 3670.0 0.02 -0.1296 -0.6364 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I07 compound treatment 858918.3673 173000.0 0.8 707472.7273 -2680.0 -0.01 0.5539 0.6944 3552640 ACon1_000165 C[C@@H]1C[C@@H]2OC(=O)C(=C)[C@H]2C[C@@]3(C)[C@H]1CCC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I08 compound treatment 618262.5 -67700.0 -0.31 699831.0345 -10300.0 -0.05 -0.2595 -0.8186 3557649 ACon1_000166 COc1c(O)c2c(=O)cc(oc2cc1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I09 compound treatment 853813.7255 168000.0 0.77 903647.4576 193000.0 1.03 1.273 0.9903 1036721 ACon1_000167 Oc1c(oc2ccccc2c1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I10 compound treatment 564447.6987 -122000.0 -0.56 719129.1391 8970.0 0.05 -0.3626 -0.6447 3555603 ACon1_000168 O[C@@H]1[C@@H](O)[C@H](Oc2cc(O)c3c(=O)c(coc3c2)c4ccc(O)cc4)O[C@@H]([C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I11 compound treatment 692092.437 6130.0 0.03 639869.7318 -70300.0 -0.37 -0.2436 -0.6516 3553943 ACon1_000169 CC1=CCC[C@@H]2[C@@](C)(CCc3ccoc3)[C@@H](CC[C@]21C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I12 compound treatment 653740.8759 -32200.0 -0.15 593833.3333 -116000.0 -0.62 -0.5413 -0.853 3554710 ACon1_000170 COC(=O)c1cc(O)cc(OC)c1Oc2cc(C)cc(O)c2C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I13 compound treatment 587580.9524 -98400.0 -0.45 658687.2852 -51500.0 -0.27 -0.5138 -0.9704 3559593 ACon1_000171 COc1ccc(cc1)[C@@H]2CC(=O)c3c(O)cc(O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I14 compound treatment 577863.6364 -108000.0 -0.5 649991.5966 -60200.0 -0.32 -0.5781 -0.9768 3553879 ACon1_000172 CC1(C)O[C@H]2CC(=O)OC[C@]23C4CC[C@@]5(C)[C@@H](OC(=O)[C@H]6O[C@]65[C@]4(C)C(=O)C(=C13)O)c7ccoc7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I15 compound treatment 646867.9245 -39100.0 -0.18 652619.2171 -57500.0 -0.31 -0.3433 -0.9685 1032910 ACon1_000173 COc1ccc2OC(CC(=O)c2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I16 compound treatment 648437.9562 -37500.0 -0.17 764119.2308 54000.0 0.29 0.08 0.2393 1362 ACon1_000174 COc1c2occc2cc3ccc(=O)oc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I17 compound treatment 603339.2857 -82600.0 -0.38 596679.6117 -113000.0 -0.6 -0.695 -0.9757 1568908 ACon1_000175 COc1cccc2oc(cc(=O)c12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I18 compound treatment 568549.0909 -117000.0 -0.54 618435.2941 -91700.0 -0.49 -0.7269 -0.9986 1498810 ACon1_000176 CC(=CCOc1c2ccoc2cc3oc(=O)ccc13)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I19 compound treatment 699792.7928 13800.0 0.06 682438.5965 -27700.0 -0.15 -0.0588 -0.3672 1913676 ACon1_000177 COc1ccc(cc1)C(=O)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I20 compound treatment 574350.6494 -112000.0 -0.51 676918.2156 -33200.0 -0.18 -0.4886 -0.8981 3559840 ACon1_000178 COc1cc2oc(=O)ccc2c(OC)c1CC(O)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I21 mock treatment 707528.4553 21600.0 0.1 710314.3939 160.0 0.0 0.0709 0.7131 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I22 mock treatment 689353.2338 3390.0 0.02 716702.6022 6550.0 0.03 0.0356 0.9351 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I23 compound treatment 673304.5685 -12700.0 -0.06 730376.0331 20200.0 0.11 0.0346 0.2831 1539 ACon1_000179 C[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 I24 compound treatment 671849.7854 -14100.0 -0.07 570067.9245 -140000.0 -0.74 -0.5714 -0.7661 3559836 ACon1_000180 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C6[C@@H]7CC(C)(C)CC[C@@]7(CC[C@]65C)C(=O)O[C@@H]8O[C@H](CO[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](O)[C@H](O)[C@H]8O)[C@]3(C)CO)[C@H](O)[C@H](O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J01 compound treatment 674277.512 -11700.0 -0.05 851457.265 141000.0 0.75 0.4918 0.6546 3557805 ACon1_000181 CC1=CC(CC2(C)OC2COc3c4occc4cc5ccc(=O)oc35)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J02 compound treatment 741265.4028 55300.0 0.26 882120.5357 172000.0 0.91 0.8253 0.8714 3559624 ACon1_000182 COc1ccc(cc1)C2CC(=O)Oc3cc(O)cc(O)c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J03 compound treatment 714004.3103 28000.0 0.13 915297.561 205000.0 1.09 0.8608 0.7856 3559225 ACon1_000183 CC(=O)OCC(=C)[C@@H]1Cc2cc(ccc2O1)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J04 compound treatment 682708.3333 -3250.0 -0.02 904381.9095 194000.0 1.03 0.7178 0.6967 2060480 ACon1_000184 Oc1ccc(cc1)C2CC(=O)c3ccccc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J05 mock treatment 670297.7941 -15700.0 -0.07 779391.1111 69200.0 0.37 0.2086 0.5573 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J06 mock treatment 754781.746 68800.0 0.32 771939.6552 61800.0 0.33 0.4561 0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J07 compound treatment 720187.7729 34200.0 0.16 798617.9775 88500.0 0.47 0.4434 0.8957 3559346 ACon1_000185 C[C@H]1[C@H]2[C@H](CC3C4C[C@H](OC5OC(C)C(O)C(O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)C5O)C7C[C@@H](O)CC[C@]7(C)C4CC[C@]23C)OC81OCC(C)CC8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J08 compound treatment 617102.2727 -68900.0 -0.32 723408.6022 13300.0 0.07 -0.1748 -0.5376 3614341 ACon1_000186 COc1c2C(=O)OCc2c(C)c3OC4(C)CC5(O)OCC6(C)OC7(CCC(C)(C4Cc13)C65O7)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J09 compound treatment 725675.4717 39700.0 0.18 628744.4444 -81400.0 -0.43 -0.1758 -0.3749 3554184 ACon1_000187 CCC(O)CC1CCC(O1)C(C)C(=O)OC(C)CC2CCC(O2)C(C)C(=O)OC(C)CC3CCC(O3)C(C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J10 compound treatment 640390.5579 -45600.0 -0.21 683845.8498 -26300.0 -0.14 -0.2473 -0.9802 3557772 ACon1_000188 COc1cc(OC)c2ccc(=O)oc2c1CC(O)C(C)(C)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J11 compound treatment 671040.4412 -14900.0 -0.07 659172.1612 -51000.0 -0.27 -0.2399 -0.8597 3199169 ACon1_000189 C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J12 compound treatment 706756.8493 20800.0 0.1 627046.3576 -83100.0 -0.44 -0.2439 -0.5406 3557412 ACon1_000190 Oc1ccc(/C=C\NC=O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J13 compound treatment 50417.7215 -636000.0 -2.93 228263.6364 -482000.0 -2.56 -3.8798 -0.9977 3552568 ACon1_000191 C[C@@H](C1CC[C@H]2C3C[C@H]4O[C@]45[C@@H](O)C=CC(=O)[C@]5(C)C3CC[C@]12C)C6CC(=C(CO)C(=O)O6)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J14 compound treatment 638361.5635 -47600.0 -0.22 627010.6762 -83100.0 -0.44 -0.4671 -0.9481 3614342 ACon1_000192 O[C@H]1Cc2c(O)cc(O)cc2O[C@H]1c3cc(O)c(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J15 compound treatment 492684.4106 -193000.0 -0.89 522393.3333 -188000.0 -1.0 -1.3345 -0.9985 3557791 ACon1_000193 CC(=CCc1c2OC(CC(=O)c2c(O)c3C=CC(C)(C)Oc13)c4ccc(O)cc4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J16 compound treatment 640808.3624 -45200.0 -0.21 578886.4353 -131000.0 -0.7 -0.6396 -0.8801 3557677 ACon1_000194 CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O[C@@H]8OC[C@](O)(CO)[C@H]8O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J17 compound treatment 541697.5945 -144000.0 -0.67 478287.9257 -232000.0 -1.23 -1.34 -0.9584 3558159 ACon1_000195 COc1cc(ccc1O)C2CC(=O)c3c(O)cc(O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J18 compound treatment 643456.9536 -42500.0 -0.2 560055.5556 -150000.0 -0.8 -0.7016 -0.8557 3557646 ACon1_000196 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2O[C@H]3[C@H](O)[C@H](O[C@@H](O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC[C@@]78OC[C@@]9(CCC(C)(C)CC98)[C@H](O)C[C@]76C)C4(C)C)[C@@H]3O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)C(=O)O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J19 compound treatment 481828.0255 -204000.0 -0.94 551515.0502 -159000.0 -0.84 -1.2606 -0.9984 3559382 ACon1_000197 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3ccc(O)cc3)[C@H](O)[C@@H](OC(=O)c4ccc(O)cc4)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J20 compound treatment 540290.9699 -146000.0 -0.67 567684.7134 -142000.0 -0.76 -1.0094 -0.9983 3557547 ACon1_000198 CC(OC1OC(CO)C(O)C(O)C1O)/C=C/C2(O)C(C)CC(=O)CC2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J21 mock treatment 600007.0671 -86000.0 -0.4 552574.6753 -158000.0 -0.84 -0.8713 -0.9419 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J22 mock treatment 591636.3636 -94300.0 -0.43 566957.2368 -143000.0 -0.76 -0.8446 -0.965 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J23 compound treatment 590528.2258 -95400.0 -0.44 595990.1316 -114000.0 -0.61 -0.7394 -0.9877 3559530 ACon1_000199 C[C@H]1C[C@@H]2O[C@@]31CCC(=C3[C@H]4OC(=O)C(=C)[C@@H]24)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 J24 compound treatment 609163.1799 -76800.0 -0.35 528117.1875 -182000.0 -0.97 -0.9332 -0.9074 3557731 ACon1_000200 COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc3occ(c4ccc(O)cc4)c(=O)c13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K01 compound treatment 706886.1386 20900.0 0.1 673166.6667 -37000.0 -0.2 -0.0705 -0.3224 3558170 ACon1_000201 C/C/1=C\CC\C(=C\[C@H]2OC(=O)C(=C)[C@@H]2[C@H](C1)OC(=O)C(=C)C(O)CO)\CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K02 compound treatment 749914.1631 64000.0 0.29 715252.4752 5100.0 0.03 0.2277 0.7687 1449 ACon1_000202 CN1[C@@H](CCC1=O)c2cccnc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K03 compound treatment 771720.8333 85800.0 0.4 736567.5676 26400.0 0.14 0.3787 0.9026 3553119 ACon1_000203 C[C@H]1C[C@@H]2OC(=O)C(=C)[C@H]2CC3=C(C)C(=O)C[C@@H]13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K04 compound treatment 631715.4812 -54200.0 -0.25 712861.7021 2710.0 0.01 -0.1667 -0.6654 3557742 ACon1_000204 CC(=CCc1cc(O)ccc1O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K05 compound treatment 705592.9204 19600.0 0.09 823706.383 114000.0 0.6 0.4899 0.8044 3559441 ACon1_000205 COc1cc(ccc1O)c2oc3cc(O)c(OC)c(O)c3c(=O)c2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K06 compound treatment 766774.3191 80800.0 0.37 687661.0879 -22500.0 -0.12 0.1792 0.4578 3557579 ACon1_000206 OCC1OC(C(O)C(O)C1O)c2c(O)cc3oc(cc(=O)c3c2O)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K07 mock treatment 731406.6986 45400.0 0.21 671909.3851 -38200.0 -0.2 0.0048 0.0163 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K08 mock treatment 707372.7273 21400.0 0.1 655853.1746 -54300.0 -0.29 -0.1338 -0.4396 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K09 compound treatment 626395.9184 -59600.0 -0.27 629569.8113 -80600.0 -0.43 -0.4965 -0.9772 1442461 ACon1_000207 COc1ccc2c(=O)cc(oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K10 compound treatment 67558.1395 -618000.0 -2.85 62204.5454 -648000.0 -3.44 -4.4467 -0.9957 3554705 ACon1_000208 COC(=O)c1cc(O)cc(OC)c1C(=O)c2c(O)cc(C)cc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K11 compound treatment 75113.6364 -611000.0 -2.82 81046.5116 -629000.0 -3.34 -4.3514 -0.9965 3054523 ACon1_000209 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C2[C@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K12 compound treatment 716344.7099 30400.0 0.14 659658.2734 -50500.0 -0.27 -0.0903 -0.2988 3559363 ACon1_000210 C/C/1=C\CC\C(=C\CC\C(=C\C2OC(=O)C(=C)C2CC1)\C)\C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K13 compound treatment 626588.4477 -59400.0 -0.27 604425.2874 -106000.0 -0.56 -0.5902 -0.9457 1250866 ACon1_000211 COc1ccc(cc1)C2CC(=O)c3ccccc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K14 compound treatment 539274.3056 -147000.0 -0.68 606602.0761 -104000.0 -0.55 -0.8667 -0.9947 3557490 ACon1_000212 CC12CCCC(CO)(CO)C2C(=O)CC3(CC4CCC31)CC4=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K15 mock treatment 616759.7173 -69200.0 -0.32 628768.1661 -81400.0 -0.43 -0.5309 -0.989 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K16 mock treatment 573487.6033 -112000.0 -0.52 677092.4092 -33100.0 -0.18 -0.4908 -0.8963 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K17 compound treatment 456025.1799 -230000.0 -1.06 462329.3051 -248000.0 -1.31 -1.6793 -0.9943 3559604 ACon1_000213 Oc1ccc2C(=O)/C(=C/c3ccc(O)c(O)c3)/Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K18 compound treatment 644557.1956 -41400.0 -0.19 544433.5938 -166000.0 -0.88 -0.7566 -0.8411 3557612 ACon1_000214 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)[C@H](O[C@@H]3O[C@@H](C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]3OC(=O)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K19 compound treatment 707653.1365 21700.0 0.1 699764.9254 -10400.0 -0.06 0.0318 0.2781 3559756 ACon1_000215 CC(=CCC[C@](C)(O)C1CC[C@]2(C)C1CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]32C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K20 compound treatment 612538.1818 -73400.0 -0.34 642533.7838 -67600.0 -0.36 -0.493 -0.9996 3559323 ACon1_000216 CC(=CCC[C@](C)(O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]3CC[C@]4(C)C3[C@H](O)CC5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)C(C)(C)C6CC[C@]54C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K21 compound treatment 552461.9048 -134000.0 -0.62 665079.4393 -45100.0 -0.24 -0.6044 -0.9151 1026747 ACon1_000217 OC(=O)c1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K22 compound treatment 728674.5763 42700.0 0.2 556600.7326 -154000.0 -0.81 -0.4366 -0.5211 3559843 ACon1_000218 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](CO)O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)cc5)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K23 mock treatment 568213.4831 -118000.0 -0.54 598480.0 -112000.0 -0.59 -0.8028 -0.9991 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 K24 mock treatment 600415.0943 -85500.0 -0.39 677824.0343 -32300.0 -0.17 -0.4002 -0.9304 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L01 compound treatment 794744.4934 109000.0 0.5 904283.0189 194000.0 1.03 1.0828 0.9454 3526 ACon1_000219 Oc1ccc2ccc(=O)oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L02 compound treatment 676036.2694 -9930.0 -0.05 847377.2727 137000.0 0.73 0.4823 0.6613 3559553 ACon1_000220 C/C=C(\C)/C(=O)O[C@H]1C=C(CO)C(=O)[C@H](OC(=O)C)[C@H]1C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L03 compound treatment 657372.3849 -28600.0 -0.13 699995.4545 -10200.0 -0.05 -0.1313 -0.9221 3558112 ACon1_000221 COc1cc(O)cc(O)c1C(=O)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L04 compound treatment 771383.8384 85400.0 0.39 877170.6161 167000.0 0.89 0.9049 0.9334 3559775 ACon1_000222 C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5C[C@H](O)CC[C@]5(C)[C@H]4CC[C@]23C)O[C@@]61CC[C@@H](C)CO6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L05 compound treatment 719341.0853 33400.0 0.15 804007.5758 93900.0 0.5 0.4608 0.8844 2137 ACon1_000223 Oc1cc(O)c2c(=O)cc(oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L06 compound treatment 740062.2711 54100.0 0.25 742305.0847 32200.0 0.17 0.297 0.9828 3559437 ACon1_000224 CC(=CC(=O)OC(C)(C)[C@H]1Oc2ccc3ccc(=O)oc3c2[C@H]1OC(=O)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L07 mock treatment 760956.8627 75000.0 0.35 769615.942 59500.0 0.32 0.4676 0.9989 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L08 mock treatment 738360.3604 52400.0 0.24 769825.9109 59700.0 0.32 0.3947 0.9911 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L09 compound treatment 646953.7367 -39000.0 -0.18 711207.7465 1050.0 0.01 -0.1233 -0.6848 3559831 ACon1_000225 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L10 compound treatment 706391.4894 20400.0 0.09 795304.1825 85100.0 0.45 0.386 0.8366 3558043 ACon1_000226 COc1cc(CC(CO)C(CO)Cc2ccc(O)c(OC)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L11 compound treatment 707530.2013 21600.0 0.1 793333.3333 83200.0 0.44 0.3823 0.8453 3554965 ACon1_000227 COc1cc(O)c(C(=O)O)c(c1)c2cc(O)c(O)cc2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L12 compound treatment 664958.6777 -21000.0 -0.1 706601.5936 -3550.0 -0.02 -0.0818 -0.8291 3180152 ACon1_000228 CC(=C)[C@@H]1CC[C@]2(COC(=O)C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)C)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L13 compound treatment 747570.9677 61600.0 0.28 815592.3077 105000.0 0.56 0.5963 0.9507 3551952 ACon1_000229 C/C(=C\1/CCC2(COC3C2)C1CCC3(O)C(=O)O)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L14 compound treatment 567726.1538 -118000.0 -0.55 705989.1304 -4170.0 -0.02 -0.4012 -0.7352 3557691 ACon1_000230 CC(C)C1C(OC(=O)/C=C/c2ccccc2)C3OC1CC(C)(O)C(CCC3(C)O)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L15 mock treatment 621092.1053 -64900.0 -0.3 650394.4637 -59800.0 -0.32 -0.4357 -0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L16 mock treatment 681716.9811 -4250.0 -0.02 563896.6667 -146000.0 -0.78 -0.5624 -0.7247 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L17 compound treatment 668172.1854 -17800.0 -0.08 575812.1019 -134000.0 -0.71 -0.5619 -0.7833 1029504 ACon1_000231 Oc1cc(O)c2C(=O)CC(Oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L18 compound treatment 649899.0826 -36100.0 -0.17 803793.6508 93600.0 0.5 0.2336 0.446 3557784 ACon1_000232 O[C@H]1CO[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)cc4)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L19 compound treatment 561466.4537 -124000.0 -0.57 551062.3145 -159000.0 -0.84 -1.0026 -0.9824 3555882 ACon1_000233 OC[C@H]1O[C@@H](O[C@@H]2OC=C3[C@@H](CCOC3=O)[C@H]2C=C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L20 compound treatment 540968.6411 -145000.0 -0.67 571354.8387 -139000.0 -0.74 -0.9934 -0.9988 3557549 ACon1_000234 C[C@](OC(=O)/C=C/c1ccc(O)c(O)c1)([C@@H](O)CO)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L21 compound treatment 534450.9804 -152000.0 -0.7 643041.8251 -67100.0 -0.36 -0.7458 -0.951 3559569 ACon1_000235 COC(=O)/C=C(\C)/CC[C@@H]1C(=C)CC[C@@H]2C(C)(C)CCC[C@@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L22 compound treatment 514028.2686 -172000.0 -0.79 527003.2573 -183000.0 -0.97 -1.2476 -0.9949 3557634 ACon1_000236 C/C=C(/C)\C(=O)OC1C(OC(=O)/C(=C\C)/C)C(C)(C)Oc2ccc3ccc(=O)oc3c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L23 mock treatment 665004.4843 -21000.0 -0.1 636020.2703 -74100.0 -0.39 -0.3464 -0.8555 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 L24 mock treatment 614860.3774 -71100.0 -0.33 618286.8526 -91900.0 -0.49 -0.5764 -0.9814 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M01 compound treatment 523124.4635 -163000.0 -0.75 602047.4308 -108000.0 -0.57 -0.9365 -0.9911 3559074 ACon1_000237 COc1cc(O)c2C(=O)C[C@@H](Oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M02 compound treatment 612808.5938 -73200.0 -0.34 650750.0 -59400.0 -0.32 -0.4613 -0.9994 959 ACon1_000238 COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M03 compound treatment 614350.0 -71600.0 -0.33 620444.4444 -89700.0 -0.48 -0.57 -0.9841 1002015 ACon1_000239 O[C@@H]1[C@H](Oc2cc(O)cc(O)c2C1=O)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M04 compound treatment 751357.7586 65400.0 0.3 678480.5654 -31700.0 -0.17 0.0945 0.2736 3557491 ACon1_000240 CC12CC3(CC2C1CC34)CCC5C(CO)(CO)CC(=O)CC45C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M05 compound treatment 784031.3901 98100.0 0.45 843173.0769 133000.0 0.71 0.8187 0.9769 3559514 ACon1_000241 CC(CC[C@@]1(C)[C@H](C)CC[C@]2(C)C1CC(=O)C=C2C)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M06 compound treatment 727791.9708 41800.0 0.19 715597.2222 5440.0 0.03 0.1568 0.804 3558910 ACon1_000242 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@](C)(CO)C5CC[C@]43C)[C@@H]2[C@@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M07 compound treatment 681347.3684 -4620.0 -0.02 705216.6065 -4940.0 -0.03 -0.0336 -0.9947 3559317 ACon1_000243 C[C@@H]1CC[C@@H](/C=C(\C)/C(=O)O)C2=C(C)C[C@@H](OC(=O)C)[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M08 compound treatment 524881.6794 -161000.0 -0.74 554993.3993 -155000.0 -0.82 -1.1072 -0.9987 3552818 ACon1_000244 C[C@]1(CC[C@]2(C)CC[C@]3(C)C4=CC(=O)c5cc(O)c(O)cc5[C@]4(C)CC[C@@]3(C)[C@@H]2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M09 mock treatment 636883.1169 -49100.0 -0.23 731187.7395 21000.0 0.11 -0.0812 -0.3216 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M10 mock treatment 622548.5075 -63400.0 -0.29 652049.8339 -58100.0 -0.31 -0.4247 -0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M11 compound treatment 588027.451 -97900.0 -0.45 671120.7547 -39000.0 -0.21 -0.4658 -0.9374 3553135 ACon1_000245 C[C@H]1CC[C@H](OC(=O)C)[C@H]2C(=O)c3occ(C)c3[C@@H](OC(=O)C)[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M12 compound treatment 627056.1798 -58900.0 -0.27 659562.9921 -50600.0 -0.27 -0.3818 -1.0 3554653 ACon1_000246 COC(=O)C(=C)CCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M13 mock treatment 597160.8833 -88800.0 -0.41 602647.4576 -108000.0 -0.57 -0.6928 -0.9868 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M14 mock treatment 565395.6835 -121000.0 -0.56 585047.7707 -125000.0 -0.66 -0.8624 -0.9961 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M15 compound treatment 604573.0769 -81400.0 -0.38 633449.1228 -76700.0 -0.41 -0.5531 -0.9992 3551999 ACon1_000247 C/C=C(/C)\C(=O)O[C@@H]1C[C@@H](OC(=O)/C(=C\C)/C)[C@](C)(CO)C2C3[C@H](C)CC(=O)C2[C@@]31C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M16 compound treatment 693226.8371 7260.0 0.03 697424.3542 -12700.0 -0.07 -0.0241 -0.3192 3552704 ACon1_000248 C[C@@H]1CC[C@H](O)/C=C/C(=O)O[C@H](C)CC[C@H](O)/C=C/C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M17 compound treatment 594113.2075 -91800.0 -0.42 627787.0968 -82400.0 -0.44 -0.6084 -0.9999 1502018 ACon1_000249 COc1ccc2oc(cc(=O)c2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M18 compound treatment 599764.5051 -86200.0 -0.4 608512.987 -102000.0 -0.54 -0.6623 -0.9888 3557806 ACon1_000250 COC(=O)C1=CO[C@@H](OC2OC(O)C(O)C(O)C2CO)[C@H]3[C@@H]1C=CC43OC(=O)C(=C4)[C@H](C)OC(=O)/C=C/c5ccc(OC6OC(CO)C(O)C(O)C6O)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M19 compound treatment 552416.6667 -134000.0 -0.62 609473.4982 -101000.0 -0.53 -0.8131 -0.9975 1012 ACon1_000251 Cc1cc2cc3c(C)cc(=O)oc3c(C)c2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M20 compound treatment 570204.461 -116000.0 -0.53 595764.2857 -114000.0 -0.61 -0.8065 -0.998 3559846 ACon1_000252 OC[C@H]1O[C@@H](Oc2ccccc2/C=C/C(=O)O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M21 compound treatment 601080.7018 -84900.0 -0.39 632640.7407 -77500.0 -0.41 -0.5675 -0.9997 3559747 ACon1_000253 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M22 compound treatment 595307.971 -90700.0 -0.42 540517.3502 -170000.0 -0.9 -0.9318 -0.9392 3554833 ACon1_000254 COc1cc(C)c(C(=O)O[C@@H]2[C@@H](CO)O[C@H]([C@@H]2OC(=O)C)n3ccc(=O)[nH]c3=O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M23 compound treatment 504870.9677 -181000.0 -0.84 585921.5017 -124000.0 -0.66 -1.0565 -0.9931 3559655 ACon1_000255 COc1cc(/C=C/C(=O)OCC[N+](C)(C)C)cc(OC)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 M24 compound treatment 472836.0 -213000.0 -0.98 526665.1376 -183000.0 -0.97 -1.3832 -1.0 3559343 ACon1_000256 COc1ccc(/C=C/C(=O)O[C@@H]2[C@@H](CO)O[C@@H](OCCc3ccc(O)c(O)c3)[C@H](O)[C@H]2O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N01 compound treatment 705571.4286 19600.0 0.09 723161.7021 13000.0 0.07 0.1127 0.9911 3558015 ACon1_000257 COc1c(O)cc2OC(CC(=O)c2c1O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N02 compound treatment 850719.3878 165000.0 0.76 869564.8148 159000.0 0.85 1.1351 0.9986 3559555 ACon1_000258 COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CC/C(=C/C(=O)O)/C)C(=C)CC[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N03 compound treatment 733373.0159 47400.0 0.22 828149.1228 118000.0 0.63 0.5971 0.9008 3557706 ACon1_000259 O=C(CCCCCC/C=C/c1ccc2OCOc2c1)N3CCCCC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N04 compound treatment 753168.2243 67200.0 0.31 759895.3975 49700.0 0.26 0.4057 0.9968 1538 ACon1_000260 Oc1ccc(c(O)c1)c2oc3cc(O)cc(O)c3c(=O)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N05 compound treatment 824094.4206 138000.0 0.64 829133.3333 119000.0 0.63 0.8967 1.0 3557638 ACon1_000261 COC(=O)c1ccccc1O[C@@H]2O[C@H](CO[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N06 compound treatment 847478.6325 162000.0 0.74 805278.97 95100.0 0.5 0.8835 0.982 3614343 ACon1_000262 CC(C)C(NC(=O)C)C(=O)O[C@H]1CCC(C)(C)[C@@H]2CC=C3C(=O)OCC3(O)[C@@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N07 compound treatment 779639.2857 93700.0 0.43 769743.5897 59600.0 0.32 0.529 0.9882 3553729 ACon1_000263 CC(CO)CCCC(C)(O)c1ccc(cc1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N08 compound treatment 680514.0187 -5450.0 -0.03 764446.7354 54300.0 0.29 0.1859 0.643 3614345 ACon1_000264 CC1(CCOC2OC(CO)C(O)C(O)C2O)CCC3C(=CCC4C(C)(CCCC34C)C(=O)O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N09 mock treatment 769680.3653 83700.0 0.39 612917.8571 -97200.0 -0.52 -0.0917 -0.1423 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N10 mock treatment 679197.479 -6760.0 -0.03 760365.1452 50200.0 0.27 0.1663 0.62 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N11 compound treatment 733426.2295 47500.0 0.22 794036.1991 83900.0 0.44 0.4694 0.9466 3559351 ACon1_000265 CCCCC(CCC)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N12 compound treatment 666279.7428 -19700.0 -0.09 751636.0294 41500.0 0.22 0.0914 0.384 3559523 ACon1_000266 CC(=CC(=O)O[C@H]1C[C@@H]2[C@@H]([C@H]3OC(=O)C(=C)C3CCC2=C)C1=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N13 mock treatment 650867.1587 -35100.0 -0.16 704531.3653 -5620.0 -0.03 -0.1355 -0.8235 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N14 mock treatment 625200.7722 -60800.0 -0.28 671359.7122 -38800.0 -0.21 -0.3436 -0.9885 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N15 compound treatment 654704.0 -31300.0 -0.14 706500.0 -3650.0 -0.02 -0.1156 -0.795 2181 ACon1_000267 Oc1cc(O)c2c(=O)c(O)c(oc2c1)c3cc(O)c(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N16 compound treatment 682164.3836 -3800.0 -0.02 613800.6536 -96400.0 -0.51 -0.3738 -0.7309 3557681 ACon1_000268 CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N17 compound treatment 509983.3333 -176000.0 -0.81 555868.2432 -154000.0 -0.82 -1.1525 -1.0 3557477 ACon1_000269 Oc1ccc2C(=O)CC(Oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N18 compound treatment 568528.5171 -117000.0 -0.54 529407.8431 -181000.0 -0.96 -1.0608 -0.9635 270 ACon1_000270 CCCCC/C=C\C/C=C\CCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N19 compound treatment 561728.6585 -124000.0 -0.57 539234.1772 -171000.0 -0.91 -1.0462 -0.9755 3558281 ACon1_000271 CC(C)C(O)CC(C)O[C@@H]1O[C@H](CO[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N20 compound treatment 693680.7692 7720.0 0.04 637192.9134 -73000.0 -0.39 -0.2485 -0.6394 3553516 ACon1_000272 CC(C)C(=O)O[C@@H]1C[C@@]2(C)O[C@](O)(C[C@@H]2O)[C@@H](C)C[C@H]3OC(=O)C(=C)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N21 compound treatment 538215.9468 -148000.0 -0.68 527819.398 -182000.0 -0.97 -1.1656 -0.9853 3559609 ACon1_000273 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2O[C@H]3[C@H](O)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O[C@H]6CC[C@@]7(C)C(CC[C@]8(C)C7CC[C@@]9%10OC[C@@]%11(CCC(C)(C)CC%11%10)[C@H](O)C[C@]98C)C6(C)C)O[C@@H]3C(=O)O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N22 compound treatment 511993.2886 -174000.0 -0.8 552365.9942 -158000.0 -0.84 -1.1591 -0.9998 3552601 ACon1_000274 C[C@@H](CC[C@H]1C(=CC(=O)C2C(C)(C)CCC[C@]12C)C)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N23 compound treatment 598600.0 -87400.0 -0.4 509642.3358 -201000.0 -1.06 -1.0369 -0.9117 1307633 ACon1_000275 COc1cc(ccc1O)c2oc3cc(O)cc(O)c3c(=O)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 N24 compound treatment 590574.2188 -95400.0 -0.44 520653.1365 -190000.0 -1.01 -1.0218 -0.9313 3557790 ACon1_000276 CC1CCC(=O)C2(O)CC(=O)C3C(C3(C)C)C12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O01 compound treatment 575339.7129 -111000.0 -0.51 600017.094 -110000.0 -0.58 -0.7738 -0.9977 3559471 ACon1_000277 C[C@@]12CCCC(=C)[C@@H]2C[C@@](O)(CC1)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O02 compound treatment 615669.6035 -70300.0 -0.32 631646.8085 -78500.0 -0.42 -0.5237 -0.9923 3185117 ACon1_000278 CC(=O)O[C@H]1CC[C@]2(C=O)[C@H]3CC[C@]4(C)[C@H](CC[C@]4(O)[C@@H]3CC[C@]2(O)C1)C5=CC(=O)OC5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O03 compound treatment 678221.3115 -7740.0 -0.04 691777.7778 -18400.0 -0.1 -0.0942 -0.9072 2069231 ACon1_000279 CC(=CCc1cc(ccc1O)C(=O)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O04 compound treatment 883368.2171 197000.0 0.91 851073.4694 141000.0 0.75 1.1722 0.9952 2091975 ACon1_000280 C/C=C/C=C/[C@H]1Cc2cc(O)cc(O)c2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O05 compound treatment 775270.3863 89300.0 0.41 812053.9419 102000.0 0.54 0.6734 0.991 3559534 ACon1_000281 CC1C[C@@H]2OC(=O)C(=C)C2C[C@]34O[C@]4(C)CCC13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O06 compound treatment 565984.252 -120000.0 -0.55 754192.3077 44000.0 0.23 -0.2261 -0.3764 3614346 ACon1_000282 O[C@@H]1C[C@](C[C@@H](O)[C@H]1O)(OC(=O)/C=C/c2ccc(O)c(O)c2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O07 compound treatment 681805.8608 -4160.0 -0.02 688574.8299 -21600.0 -0.11 -0.0945 -0.8142 3558551 ACon1_000283 CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)OC8OC(CO)C(O)C(O)C8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O08 compound treatment 637369.0987 -48600.0 -0.22 617117.6471 -93000.0 -0.49 -0.5074 -0.9362 1000088 ACon1_000284 OC1C(Oc2cc(O)cc(O)c2C1=O)c3cc(O)c(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O09 compound treatment 671932.7731 -14000.0 -0.06 583879.0323 -126000.0 -0.67 -0.5193 -0.7718 3559591 ACon1_000285 C[C@@]1(O)C[C@@]2(CC1CC[C@H]23)CCC4C(C)(C)[C@H](CC[C@@]34C)O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O10 compound treatment 635440.613 -50500.0 -0.23 742372.4696 32200.0 0.17 -0.0439 -0.152 3554190 ACon1_000286 CCC/C=C/C=C/C1C[C@@H](O)[C@@H](O)C(=O)[C@H]1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O11 mock treatment 623462.406 -62500.0 -0.29 639605.1661 -70500.0 -0.37 -0.4684 -0.9917 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O12 mock treatment 692163.0435 6200.0 0.03 646424.2424 -63700.0 -0.34 -0.2188 -0.645 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O13 compound treatment 604465.2174 -81500.0 -0.38 624619.2308 -85500.0 -0.45 -0.5866 -0.9956 3069775 ACon1_000287 CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O14 compound treatment 655466.6667 -30500.0 -0.14 704731.1321 -5420.0 -0.03 -0.1198 -0.8345 3557505 ACon1_000288 CC(C)C(O)C(=O)O[C@H]/1C\C=C(/C)\C[C@@H](OC(=O)/C(=C/CO)/CO)[C@@H]2[C@H](OC(=O)C2=C)/C=C1/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O15 compound treatment 667954.717 -18000.0 -0.08 680515.748 -29600.0 -0.16 -0.1699 -0.9555 3559563 ACon1_000289 CC1=CC(=O)[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC[C@@](C)(O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O16 compound treatment 538725.9259 -147000.0 -0.68 587091.2409 -123000.0 -0.65 -0.9417 -0.9998 3559243 ACon1_000290 COc1cc(cc(OC)c1O)C2C(CO)C(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)Cc4cc(OC)c(O)c(OC)c24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O17 compound treatment 632631.9444 -53300.0 -0.25 604211.8056 -106000.0 -0.56 -0.5712 -0.9313 3559643 ACon1_000291 OC(CCc1ccccc1)CC(=O)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O18 compound treatment 589440.5594 -96500.0 -0.45 573086.8056 -137000.0 -0.73 -0.8288 -0.9723 3559322 ACon1_000292 CC(=CCC[C@](C)(O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]3CC[C@]4(C)C3[C@H](O)CC5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)C(C)(C)C6CC[C@]54C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O19 compound treatment 520941.9643 -165000.0 -0.76 577302.583 -133000.0 -0.7 -1.0364 -0.9993 1071301 ACon1_000293 COc1ccc2CC(=O)c3cc4OCOc4cc3CCN(C)Cc2c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O20 compound treatment 594127.49 -91800.0 -0.42 654198.5816 -56000.0 -0.3 -0.5093 -0.9849 3557261 ACon1_000294 OC(=O)CCC(=O)Cc1ccccc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O21 compound treatment 527617.1171 -158000.0 -0.73 545666.6667 -164000.0 -0.87 -1.1333 -0.9961 1010377 ACon1_000295 Oc1ccc2C3c4cc(O)c(O)cc4CC3(O)COc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O22 compound treatment 547389.3443 -139000.0 -0.64 551390.5109 -159000.0 -0.84 -1.0473 -0.9907 3557778 ACon1_000296 C/C(=C\CO)/CC[C@H]1C(=C)CCC2[C@@](C)(CO)CCC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O23 compound treatment 503548.0 -182000.0 -0.84 601851.8519 -108000.0 -0.57 -1.001 -0.9827 2080073 ACon1_000297 C[C@@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]2CC[C@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 O24 compound treatment 528992.4242 -157000.0 -0.72 584581.9672 -126000.0 -0.67 -0.9828 -0.9991 3559339 ACon1_000298 COc1c(O)c2c(=O)c(coc2cc1O[C@@H]3O[C@H](CO[C@H]4OC[C@](O)(CO)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c5ccc(O)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P01 compound treatment 556982.3009 -129000.0 -0.59 669888.412 -40300.0 -0.21 -0.5716 -0.9045 3554303 ACon1_000299 CCCCCCCCCC[C@H](C(=O)O)[C@@]1(CCC(=O)O1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P02 compound treatment 592929.2453 -93000.0 -0.43 650340.9091 -59800.0 -0.32 -0.5277 -0.989 3553173 ACon1_000300 CC(=C)[C@@H]1CC[C@](C)(O)[C@H](C1)OC(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P03 compound treatment 620152.0 -65800.0 -0.3 717466.3677 7310.0 0.04 -0.1872 -0.6118 3557492 ACon1_000301 CC12CC3(CC2C1CC34)CCC5C(CO)(CO)CC(O)CC45C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P04 compound treatment 558101.2146 -128000.0 -0.59 652322.1757 -57800.0 -0.31 -0.6338 -0.9536 3554488 ACon1_000302 CN1CC(C=C2[C@H]1Cc3c[nH]c4cccc2c34)C(=O)N[C@]5(C)O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@H](Cc8ccccc8)N6C5=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P05 compound treatment 626232.5581 -59700.0 -0.28 626067.2269 -84100.0 -0.45 -0.5101 -0.9732 3558904 ACon1_000303 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(CO)(CO)C5CC[C@]43C)C2[C@@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P06 compound treatment 651354.9784 -34600.0 -0.16 681550.0 -28600.0 -0.15 -0.2201 -0.9997 3614348 ACon1_000304 COc1cc(O)c2C(=O)OC(O)(CO)C(C)c2c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P07 compound treatment 567004.1322 -119000.0 -0.55 529367.7686 -181000.0 -0.96 -1.066 -0.9649 3557880 ACon1_000305 COc1cc(OC)cc(/C=C/c2ccc(O)cc2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P08 compound treatment 574423.0769 -112000.0 -0.51 604620.4082 -106000.0 -0.56 -0.7595 -0.9991 3614349 ACon1_000306 CC(=CCC/C(=C/CC/C(=C/Cc1c(O)cc2C(=O)N(Cc2c1O)C(CCC(=O)O)C(=O)O)/C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P09 compound treatment 543432.3308 -143000.0 -0.66 546516.129 -164000.0 -0.87 -1.0785 -0.9906 3559304 ACon1_000307 C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](OC(=O)C)[C@H]4O)c(oc3c2)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P10 compound treatment 654686.0987 -31300.0 -0.14 612858.4475 -97300.0 -0.52 -0.4669 -0.8713 3559823 ACon1_000308 C[C@@H]1CC[C@@]2(CC[C@]3(C(=O)O)C(=CCC4[C@@]5(C)CC[C@H](OC6OC[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)C2[C@H]1C)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P11 mock treatment 548412.6984 -138000.0 -0.63 586181.07 -124000.0 -0.66 -0.9135 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P12 mock treatment 519912.0879 -166000.0 -0.77 594567.2269 -116000.0 -0.61 -0.975 -0.9939 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P13 compound treatment 406892.9889 -279000.0 -1.29 559760.0 -150000.0 -0.8 -1.4741 -0.9735 3559341 ACon1_000309 O[C@H]1[C@H](O)[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](Oc3ccc(/C=C/c4cc(O)cc(O)c4)cc3)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P14 compound treatment 528932.7731 -157000.0 -0.72 590595.7447 -120000.0 -0.63 -0.9605 -0.9978 3557710 ACon1_000310 CO[C@@H]1[C@H](O)[C@@H](O[C@H]2C[C@@H](O)[C@@]3(C)[C@H](CC[C@@H]4C3CC[C@]5(C)[C@H](CC[C@]45O)C6=CC(=O)OC6)C2)O[C@H](C)[C@@H]1O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P15 compound treatment 510704.1199 -175000.0 -0.81 591977.0992 -118000.0 -0.63 -1.0147 -0.9921 3559388 ACon1_000311 COc1cc2occ(c3ccc(O[C@@H]4O[C@H](CO[C@@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3)c(=O)c2c(O)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P16 compound treatment 463201.9231 -223000.0 -1.03 474665.0246 -235000.0 -1.25 -1.6096 -0.9953 3557667 ACon1_000312 C[C@H]1[C@H]2[C@H](CC3[C@@H]4CC=C5C[C@@H](C[C@@H](O)[C@]5(C)C4CC[C@]23C)O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)O[C@@]81CCC(=C)CO8 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P17 compound treatment 472452.9915 -214000.0 -0.98 422137.1841 -288000.0 -1.53 -1.7764 -0.9774 3614351 ACon1_000313 O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1OC(=O)/C=C/c3ccc(O)c(O)c3)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P18 compound treatment 450515.4639 -235000.0 -1.09 391352.3316 -319000.0 -1.69 -1.9634 -0.9771 3552822 ACon1_000314 C[C@]1(CCC[C@]2(C)[C@@H]1CC[C@]3(C[C@@H]4CC=C32)CC4=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P19 compound treatment 468453.2374 -218000.0 -1.0 490666.6667 -219000.0 -1.16 -1.5325 -0.9972 3557267 ACon1_000315 NC(=O)Cc1ccc(O)c(Cl)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P20 compound treatment 455608.4142 -230000.0 -1.06 475669.145 -234000.0 -1.24 -1.6306 -0.9969 3557599 ACon1_000316 C[C@H]1CCC(CC=C1CCC(=O)C)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P21 compound treatment 423093.8511 -263000.0 -1.21 411738.5621 -298000.0 -1.58 -1.9764 -0.9913 3614352 ACon1_000317 COc1ccc(cc1)C(=O)O[C@H]2CC(=CCC3(C)CC[C@@](O)(C(C)C)[C@H]23)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P22 compound treatment 408852.6316 -277000.0 -1.28 419646.6431 -291000.0 -1.54 -1.9932 -0.9957 3557663 ACon1_000318 C[C@@H](CC[C@H]1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P23 compound treatment 466257.4627 -220000.0 -1.01 469598.7261 -241000.0 -1.28 -1.6186 -0.9935 1113986 ACon1_000319 O=c1cccc2C3CNCC(C3)Cn21 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2290 P24 compound treatment 572095.4545 -114000.0 -0.53 514586.6667 -196000.0 -1.04 -1.1048 -0.9502 3557792 ACon1_000320 C/C=C(\C)/C(=O)O[C@H]1C[C@@H]2O[C@]2(C)[C@@H]3[C@H]4OC(=O)C(=C)[C@@H]4C[C@@H](O)[C@@]13C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A01 compound treatment 562362.2449 -104000.0 -0.48 763173.3333 102000.0 0.54 0.044 0.061 3557665 ACon1_000321 COc1cc(O)c2c(=O)c(OC)c(oc2c1)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A02 compound treatment 741342.9752 75300.0 0.35 734720.339 73400.0 0.39 0.5209 0.9984 3558065 ACon1_000322 OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A03 compound treatment 663929.5775 -2070.0 -0.01 731184.2105 69900.0 0.37 0.2552 0.6886 3557987 ACon1_000323 COc1ccc(cc1)c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)c3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A04 compound treatment 924292.4528 258000.0 1.19 734839.3574 73500.0 0.39 1.118 0.892 3558147 ACon1_000324 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)C5CC[C@]43C)C2C1)C(=O)O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A05 compound treatment 558315.7895 -108000.0 -0.5 823543.2692 162000.0 0.86 0.2572 0.2589 3558051 ACon1_000325 COc1cc2ccc(=O)oc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A06 compound treatment 720714.9321 54700.0 0.25 675245.4545 13900.0 0.07 0.2306 0.8772 3558231 ACon1_000326 COc1cc(O)c2c(=O)c(OC)c(oc2c1)c3cc(O)c(OC)c(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A07 compound treatment 743323.5294 77300.0 0.36 835450.7042 174000.0 0.92 0.9052 0.9143 3558131 ACon1_000327 OCC1OC(Oc2cc(O)cc(/C=C/c3ccccc3)c2)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A08 compound treatment 665702.2222 -300.0 0.0 699625.5708 38300.0 0.2 0.1426 0.7023 3553198 ACon1_000328 CC(=CCc1cc(cc(CC=C(C)C)c1O)[C@@H]2CC(=O)c3c(O)cc(O)cc3O2)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A09 compound treatment 645672.8111 -20300.0 -0.09 734240.8377 72900.0 0.39 0.2072 0.5206 3558232 ACon1_000329 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@H](CC[C@@H]31)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A10 compound treatment 787665.1376 122000.0 0.56 796972.2222 136000.0 0.72 0.9055 0.9924 3553751 ACon1_000330 CC(O)C(O)/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@]2(O)[C@@]3(C)CCCC(C)(C)C13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A11 compound treatment 673259.2593 7260.0 0.03 655037.037 -6290.0 -0.03 1.0E-4 0.0013 3614354 ACon1_000331 CCCCCCCC(=O)CCCCCC/C=C/[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@](O)(CC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A12 compound treatment 871682.243 206000.0 0.95 842183.4862 181000.0 0.96 1.349 1.0 3614356 ACon1_000332 COc1c(O)cc2C(O)C(C)OC(=O)c3c(O)c(OC)c(O)c(O)c3C(O)C(C)OC(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A13 mock treatment 669210.5263 3210.0 0.01 757082.9268 95800.0 0.51 0.3696 0.7274 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A14 mock treatment 729149.4845 63100.0 0.29 740319.6347 79000.0 0.42 0.5022 0.9842 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A15 compound treatment 849240.3433 183000.0 0.85 760404.3478 99100.0 0.53 0.9691 0.9739 3553760 ACon1_000333 CC(O)CCCCC(C(=O)O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A16 compound treatment 774297.2973 108000.0 0.5 623095.2381 -38200.0 -0.2 0.2097 0.3891 3559671 ACon1_000334 CC(CCOC(=O)C)CC[C@H]1C(=C)CCC2[C@](C)(CCC[C@]12C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A17 compound treatment 710008.0 44000.0 0.2 697904.1096 36600.0 0.19 0.2807 0.9997 3559515 ACon1_000335 COC(=O)/C=C(\C)/CCC1(C)C(C)CCC2(C)C1CC(=O)C=C2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A18 compound treatment 656977.0642 -9030.0 -0.04 601948.9796 -59400.0 -0.31 -0.2521 -0.7937 2082296 ACon1_000336 O[C@H]([C@H]1C[C@@H]2CCN1C[C@@H]2C=C)c3ccnc4ccccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A19 compound treatment 587951.7544 -78100.0 -0.36 602328.5714 -59000.0 -0.31 -0.4758 -0.9976 3553961 ACon1_000337 CC1CC(=O)C2=C(C1)C(Cl)C(O)C3(O)C(O)c4c(O)cccc4C(=O)C23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A20 compound treatment 686456.7901 20500.0 0.09 599686.0465 -61600.0 -0.33 -0.1645 -0.4834 3557551 ACon1_000338 COc1c(OC2OC(CO)C(O)C(O)C2O)cc(O)c3C(=O)CC(Oc13)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A21 compound treatment 602799.1803 -63200.0 -0.29 652876.4045 -8450.0 -0.04 -0.2378 -0.8064 3557759 ACon1_000339 C[C@@H]1CC[C@]2(C)CC[C@]3(CO)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C2[C@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A22 compound treatment 571497.4359 -94500.0 -0.44 641842.9752 -19500.0 -0.1 -0.3813 -0.8512 3557801 ACon1_000340 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](O[C@@H]3[C@@H](O)[C@H](C)O[C@@H](OC/C(=C/CC/C(=C/CC/C(=C/CCC(C)(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C=C)/C)/C)/C)[C@@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A23 compound treatment 764383.6207 98400.0 0.45 546149.0909 -115000.0 -0.61 -0.1112 -0.1461 3557890 ACon1_000341 COc1cc(cc(OC)c1OC)C(=O)OC2OC(CO)C(O)C(O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 A24 compound treatment 563269.8413 -103000.0 -0.47 526594.1176 -135000.0 -0.71 -0.8403 -0.9801 3558223 ACon1_000342 COc1cc(O)cc(OC)c1O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B01 compound treatment 684494.9495 18500.0 0.09 720704.0359 59400.0 0.31 0.283 0.8674 3559333 ACon1_000343 COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)/C(=C\C)/C1CC(=O)OCC3C(C)C(CC3C(CO)CO)OC(=O)CC4\C(=C\C)\C(OC5OC(CO)C(O)C(O)C5O)OC=C4C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B02 compound treatment 770180.1802 104000.0 0.48 638076.1905 -23300.0 -0.12 0.2525 0.5091 3559681 ACon1_000344 CC(=O)OC[C@]12CCC[C@]3(C)[C@@H]2[C@@H](OC1=O)[C@H](OC(=O)C)[C@]4(C[C@H]5CC[C@H]43)CC5=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B03 compound treatment 942404.0816 276000.0 1.27 887003.9841 226000.0 1.2 1.7477 0.9995 3557417 ACon1_000345 C[C@H]1[C@H](O)CCC2=CC(=O)C(=C[C@]12C)C(C)(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B04 compound treatment 806766.8161 141000.0 0.65 818726.4151 157000.0 0.83 1.0493 0.9923 3559419 ACon1_000346 COC(=O)/C=C/c1ccc(OC)c(/C=C/C(C)(C)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B05 compound treatment 740181.07 74200.0 0.34 738147.7833 76800.0 0.41 0.53 0.9962 3559255 ACon1_000347 COc1c(O)c2c(=O)cc(oc2cc1O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B06 compound treatment 522470.5882 -144000.0 -0.66 675414.3426 14100.0 0.07 -0.4152 -0.6233 3555950 ACon1_000348 Oc1cccc(C(=O)NCC[C@@H](CNC(=O)c2cccc(O)c2O)NC(=O)c3cccc(O)c3O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B07 compound treatment 763055.3191 97100.0 0.45 637314.8936 -24000.0 -0.13 0.2264 0.4865 3555286 ACon1_000349 COc1ccc2[C@H](C)[C@H]3N(CCc4cc(OC)c(OC)cc34)Cc2c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B08 compound treatment 822740.9326 157000.0 0.72 828741.0714 167000.0 0.89 1.139 0.9948 715 ACon1_000350 COc1c2ccoc2c(OC)c3oc(C)cc(=O)c13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B09 compound treatment 695640.0 29600.0 0.14 737050.2092 75700.0 0.4 0.3806 0.8972 3559310 ACon1_000351 COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(oc2c1)c5ccc(O)c(O)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B10 compound treatment 812150.4425 146000.0 0.67 714382.0225 53100.0 0.28 0.6755 0.9249 3555614 ACon1_000352 O[C@@H]1CO[C@@H](OC[C@H]2O[C@@H](Oc3cccc4cc5COC(=O)c5c(O)c34)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B11 compound treatment 765718.0617 99700.0 0.46 797583.7104 136000.0 0.72 0.8362 0.9762 1352 ACon1_000353 COc1cc2CC[C@H](NC(=O)C)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B12 compound treatment 815269.2308 149000.0 0.69 832804.7619 171000.0 0.91 1.1299 0.9906 3552679 ACon1_000354 C[C@@H]1CC(=O)[C@]2(COC(=O)C)[C@H](CC[C@H](OC(=O)C)[C@@]32CO3)[C@]41C[C@H](OC4=O)c5ccoc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B13 mock treatment 807362.4454 141000.0 0.65 698760.9756 37400.0 0.2 0.6013 0.8824 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B14 mock treatment 776943.3962 111000.0 0.51 725578.0591 64200.0 0.34 0.6027 0.9805 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B15 compound treatment 712348.0392 46300.0 0.21 863937.799 203000.0 1.07 0.911 0.8315 3559749 ACon1_000355 CC(C)CC(=O)O[C@@H]1C/C(=C\CC\C(=C\[C@H]2OC(=O)C(=C)C21)\C)/C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B16 compound treatment 710157.8947 44200.0 0.2 658301.3699 -3030.0 -0.02 0.1326 0.6493 3554812 ACon1_000356 COc1cc(/C=C/C(=O)O[C@H]2C[C@H]3[C@@H]([C@H]2C)[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)OC=C3C(=O)O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B17 compound treatment 504344.0 -162000.0 -0.75 494156.0 -167000.0 -0.89 -1.1541 -0.9963 3559769 ACon1_000357 COc1cc(/C=C/2\Oc3cc(O)cc(O)c3C2=O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B18 compound treatment 759068.0851 93100.0 0.43 784875.0 124000.0 0.66 0.7668 0.979 3557998 ACon1_000358 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1OC(=O)/C=C/c6ccccc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B19 compound treatment 651679.8246 -14300.0 -0.07 748588.8889 87300.0 0.46 0.2806 0.6001 3559817 ACon1_000359 COc1c(CC=C(C)C)cc(cc1CC=C(C)C)C2CC(=O)c3c(O)cc(O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B20 compound treatment 652567.2269 -13400.0 -0.06 680745.9016 19400.0 0.1 0.029 0.2414 3554713 ACon1_000360 COC(=O)c1cc(OC)cc(OC)c1C(=O)c2coc(/C=C/C)c(OC)c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B21 compound treatment 689474.5098 23500.0 0.11 595034.0909 -66300.0 -0.35 -0.1721 -0.4678 3553590 ACon1_000361 CC(C)C1CCC2(C)CCC(O)C(C)(O)C2C1OC(=O)/C=C/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B22 compound treatment 624803.5714 -41200.0 -0.19 649253.3333 -12100.0 -0.06 -0.1796 -0.896 3558127 ACon1_000362 OCC1OC(OC2OC=CC3(O)C(OC(=O)c4ccc(O)cc4)C=C(CO)C23)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B23 compound treatment 655333.3333 -10700.0 -0.05 601850.1629 -59500.0 -0.32 -0.2579 -0.8076 3553394 ACon1_000363 CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 B24 compound treatment 675665.3061 9660.0 0.04 620345.8647 -41000.0 -0.22 -0.1222 -0.5507 3553902 ACon1_000364 CC1=C(C)C(=O)O[C@@H](C1)[C@](C)(O)C2(O)CC[C@@]3(O)[C@@H]4CC=C5CC=CC(=O)[C@]5(C)C4CC[C@]23C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C01 compound treatment 637321.7391 -28700.0 -0.13 558747.8261 -103000.0 -0.54 -0.4783 -0.8541 3557813 ACon1_000365 OC1COC(Oc2cc(O)c3C[C@H](O)[C@H](Oc3c2)c4ccc(O)c(O)c4)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C02 compound treatment 785607.3059 120000.0 0.55 736078.9474 74700.0 0.4 0.6704 0.9869 3558044 ACon1_000366 OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C03 compound treatment 729962.4413 64000.0 0.29 757434.0426 96100.0 0.51 0.569 0.9662 3557757 ACon1_000367 COc1cc(O)cc2occ(c3ccc(O)cc3)c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C04 compound treatment 880736.8421 215000.0 0.99 677163.2653 15800.0 0.08 0.7596 0.7643 3552816 ACon1_000368 C[C@]1(C[C@H](O)[C@@H]2[C@H](OC(=O)C2=C)[C@H]1C(=C)CO)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C05 compound treatment 679574.8792 13600.0 0.06 702174.8879 40800.0 0.22 0.1974 0.8756 3558075 ACon1_000369 OC[C@H]1O[C@@H](OCCc2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1OC(=O)/C=C/c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C06 compound treatment 685431.1927 19400.0 0.09 678132.7434 16800.0 0.09 0.1264 1.0 3554832 ACon1_000370 COc1cc(c(OC)cc1O)c2coc3cc(O)cc(O)c3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C07 compound treatment 648348.4163 -17700.0 -0.08 647375.0 -14000.0 -0.07 -0.1099 -0.9989 3558135 ACon1_000371 COc1cc2OC(CC(=O)c2c(OC)c1C)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C08 compound treatment 697158.1633 31200.0 0.14 696116.0714 34800.0 0.18 0.2321 0.9924 3559269 ACon1_000372 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(=O)O)[C@@](C)(CO)C5CC[C@]43C)C2C1)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C09 compound treatment 743046.0829 77000.0 0.36 743203.8835 81900.0 0.43 0.5583 0.995 703 ACon1_000373 OC[C@H]1O[C@@H](Oc2ccccc2CO)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C10 compound treatment 796073.3945 130000.0 0.6 771487.6847 110000.0 0.58 0.8373 0.9999 3553121 ACon1_000374 C[C@H]1CC(=O)C2=C(C1)C(O)C(O)[C@]3(O)[C@@H](O)c4c(O)cccc4C(=O)[C@@H]23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C11 mock treatment 780397.1963 114000.0 0.53 729839.6226 68500.0 0.36 0.63 0.9834 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C12 mock treatment 768728.1106 103000.0 0.47 760210.5263 98900.0 0.52 0.7058 0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C13 compound treatment 710825.4717 44800.0 0.21 791363.6364 130000.0 0.69 0.6339 0.8803 3558186 ACon1_000375 CC1=C2[C@@H]([C@H]3OC(=O)C(=C)[C@@H]3[C@H](C1)OC(=O)Cc4ccc(O)cc4)C(=CC2=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C14 compound treatment 824620.6897 159000.0 0.73 709320.7547 48000.0 0.25 0.6972 0.9002 3557399 ACon1_000376 OC1C=CC(O)C23OC13C(O)C=CC42Oc5cccc6cccc(O4)c56 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C15 mock treatment 831642.8571 166000.0 0.76 722366.9725 61000.0 0.32 0.7691 0.927 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C16 mock treatment 692105.5276 26100.0 0.12 796700.0 135000.0 0.72 0.5928 0.8143 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C17 compound treatment 808527.6596 143000.0 0.66 735030.5677 73700.0 0.39 0.7412 0.9692 3553202 ACon1_000377 CC(=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C(O)CC(OC(=O)C)/C(=C/COCC(O)C(O)C(O)C(O)CO)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C18 compound treatment 812872.0379 147000.0 0.68 748104.4776 86800.0 0.46 0.8044 0.9823 3557463 ACon1_000378 COc1cc(oc(=O)c1)C2C3(O)CC4OC(=O)C3(O)C(C(=O)c5ccccc5)C2(O)C4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C19 compound treatment 845015.0 179000.0 0.83 794065.2174 133000.0 0.7 1.0816 0.9969 3558937 ACon1_000379 O[C@@H]1[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](OC(=O)c4cc(O)c(O)c(O)c4)[C@H]1OC(=O)c5cc(O)c(O)c(O)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C20 compound treatment 116456.5217 -550000.0 -2.53 65772.7273 -596000.0 -3.16 -4.0257 -0.994 3552950 ACon1_000380 C[C@H]1[C@@H]2[C@H](OC(=O)C)C(=O)[C@@]3(C)[C@@H](CC[C@H]4/C(=C(\CCC=C(C)C)/C(=O)O)/[C@H](C[C@@]43C)OC(=O)C)[C@@]2(C)C=CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C21 compound treatment 774395.122 108000.0 0.5 719415.6379 58100.0 0.31 0.5713 0.973 3557766 ACon1_000381 CC1=C2C/C=C(\C)/C(C/C=C(\C)/CC2OC1=O)OC3OC(CO)C(O)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C22 compound treatment 668933.6493 2930.0 0.01 573631.7992 -87700.0 -0.47 -0.3194 -0.6863 3559361 ACon1_000382 C[C@@H]([C@H]1CCC2C3CC=C4C[C@H](C[C@H](O)[C@]4(C)C3CC[C@]12C)O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C6CC(=C(CO)C(=O)O6)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C23 compound treatment 656144.0678 -9860.0 -0.05 522542.2222 -139000.0 -0.74 -0.5527 -0.7494 3553616 ACon1_000383 CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)C)[C@H]3C[C@H](O)[C@](O)(COC(=O)C)[C@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 C24 compound treatment 601036.8852 -65000.0 -0.3 658740.5858 -2590.0 -0.01 -0.2216 -0.7387 3558764 ACon1_000384 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)[C@H](C[C@@]31O)OC(=O)/C=C/c4ccc(OC)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D01 compound treatment 592861.7512 -73100.0 -0.34 716831.6832 55500.0 0.29 -0.0303 -0.0678 3559335 ACon1_000385 COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)/C(=C\C)/C1CC(=O)OCC(CO)C3CC(OC(=O)CC4\C(=C\C)\C(OC5OC(CO)C(O)C(O)C5O)OC=C4C(=O)OC)C(C)C3COC(=O)CC6\C(=C\C)\C(OC7OC(CO)C(O)C(O)C7O)OC=C6C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D02 compound treatment 804189.3204 138000.0 0.64 802442.8571 141000.0 0.75 0.9799 0.9968 3552117 ACon1_000386 C/C=C\C(=O)O[C@@H]1C[C@H]2O[C@@H]3C=C(C)C(=O)C[C@]3(C)[C@]1(C)[C@@]42CO4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D03 compound treatment 908616.5414 243000.0 1.12 962789.6825 301000.0 1.6 1.9218 0.9848 3554011 ACon1_000387 CC1CCC(=C(CC/C(=C\COC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)/C)C1(C)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D04 compound treatment 754270.4082 88300.0 0.41 677311.9266 16000.0 0.08 0.3478 0.8364 3559732 ACon1_000388 CC1=C[C@H]2OC(=O)C(=C)[C@H]2C[C@@H]3[C@H]1CC[C@@]3(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D05 compound treatment 759760.0 93800.0 0.43 687433.6283 26100.0 0.14 0.4036 0.8891 3558877 ACon1_000389 C/C/1=C\CC\C(=C\[C@H]2OC(=O)C(=C)[C@@H]2[C@H](C1)OC(=O)C(=C)CO)\CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D06 compound treatment 740112.4498 74100.0 0.34 814167.3469 153000.0 0.81 0.8149 0.9263 1607 ACon1_000390 CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D07 compound treatment 838892.562 173000.0 0.8 840330.2326 179000.0 0.95 1.2351 0.9962 3557737 ACon1_000391 CCCCCC(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D08 compound treatment 644542.0168 -21500.0 -0.1 642278.8462 -19100.0 -0.1 -0.1414 -0.9999 3614357 ACon1_000392 O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D09 compound treatment 728004.6083 62000.0 0.29 636646.2264 -24700.0 -0.13 0.1096 0.3485 3559940 ACon1_000393 COc1cc(ccc1O)C2C(CO)C(CO)Cc3cc(OC)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D10 compound treatment 764203.4632 98200.0 0.45 759153.8462 97800.0 0.52 0.6871 0.9977 3557859 ACon1_000394 CC1(C)Oc2ccc3ccc(=O)oc3c2[C@@H](O)[C@H]1O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D11 mock treatment 743339.7129 77300.0 0.36 671000.0 9670.0 0.05 0.2885 0.8006 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D12 mock treatment 623418.6047 -42600.0 -0.2 642033.0189 -19300.0 -0.1 -0.2112 -0.9539 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D13 compound treatment 626021.3675 -40000.0 -0.18 710071.4286 48700.0 0.26 0.0524 0.1651 3557863 ACon1_000395 CCC(C)C(=O)O[C@@H]1[C@H](OC(=O)C)c2c(OC1(C)C)ccc3ccc(=O)oc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D14 compound treatment 650400.0 -15600.0 -0.07 642642.8571 -18700.0 -0.1 -0.121 -0.9876 3558515 ACon1_000396 C[C@H]1Oc2c(C(CC(=O)O)c3ccccc3)c4OC(C)(C)C=Cc4c(O)c2C(=O)[C@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D15 mock treatment 669124.3781 3120.0 0.01 747712.5506 86400.0 0.46 0.3342 0.729 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D16 mock treatment 783805.5556 118000.0 0.54 694251.1848 32900.0 0.17 0.5076 0.8896 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D17 compound treatment 618773.8095 -47200.0 -0.22 670011.4504 8680.0 0.05 -0.1214 -0.5456 3559665 ACon1_000397 CCC(C[C@@H](O)[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)[C@H]4[C@H](C)[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)c5ccccc5)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D18 compound treatment 621852.1401 -44200.0 -0.2 586905.5118 -74400.0 -0.39 -0.4231 -0.9526 3559379 ACon1_000398 O[C@@H]1CO[C@@H](OC[C@H]2O[C@@H](OC/C=C/c3ccccc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D19 compound treatment 640416.6667 -25600.0 -0.12 611037.6569 -50300.0 -0.27 -0.2721 -0.9327 3559700 ACon1_000399 CO[C@@H]1C[C@@]2(CC=C)[C@H](C)[C@H](OC2=C(OC)C1=O)c3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D20 compound treatment 637701.7544 -28300.0 -0.13 730000.0 68700.0 0.36 0.1653 0.4271 3552828 ACon1_000400 C[C@]12CC[C@H](C[C@H]2[C@H](CCC3(O)[C@@H]4C[C@@H](CC[C@@]4(C)C=CC3=O)C(=C)C(=O)O)C(=O)C=C1)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D21 compound treatment 670430.9623 4430.0 0.02 732662.8352 71300.0 0.38 0.282 0.7442 3559727 ACon1_000401 COC(=O)CC(C)CC[C@H]1C(=CC[C@H]2C(C)(C)[C@H](O)CC[C@]12C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D22 compound treatment 599929.078 -66100.0 -0.3 534774.9077 -127000.0 -0.67 -0.6901 -0.9362 3558274 ACon1_000402 C[C@@H]1C[C@@H](OC(=O)C)C2C(C)(C)CCC[C@]2(C)[C@@]1(O)CCC3=CC(=O)OC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D23 compound treatment 599253.4247 -66700.0 -0.31 632003.937 -29300.0 -0.16 -0.3277 -0.95 3553349 ACon1_000403 CC(=O)O[C@H]1CC(=C2[C@@H]3OC(=O)C(=C)[C@@H]3CC[C@@]2(C)C1)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 D24 compound treatment 459560.7477 -206000.0 -0.95 474004.7847 -187000.0 -0.99 -1.3758 -0.9998 3554883 ACon1_000404 COc1cc(ccc1O)c2cc(=O)c3c(O)c(OC)c(O)c(OC)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E01 mock treatment 667382.3529 1380.0 0.01 647025.1256 -14300.0 -0.08 -0.0492 -0.6455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E02 mock treatment 697076.9231 31100.0 0.14 714261.3065 52900.0 0.28 0.2998 0.9513 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E03 compound treatment 692443.299 26400.0 0.12 769943.662 109000.0 0.58 0.4936 0.8382 3557985 ACon1_000405 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](C)O[C@@H](OCC3OC(Oc4c(oc5cc(O)cc(O)c5c4=O)c6ccc(O)c(O)c6)C(O)C(O)C3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E04 compound treatment 779960.0 114000.0 0.53 824740.1961 163000.0 0.87 0.9845 0.9713 3557740 ACon1_000406 COc1ccc(/C=C/C(=O)O[C@@H]2[C@@H](O)[C@H](C)O[C@@H](O[C@@H]3[C@@H]4O[C@]4(CO)[C@@H]5[C@H]3C=CO[C@H]5O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6O)[C@@H]2OC(=O)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E05 compound treatment 736536.2319 70500.0 0.33 765636.3636 104000.0 0.55 0.6212 0.9679 3558077 ACon1_000407 O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/c2ccc(O)c(O)c2)O[C@@H](OCCc3ccc(O)c(O)c3)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E06 compound treatment 913636.3636 248000.0 1.14 862966.9811 202000.0 1.07 1.5638 0.9995 3558242 ACon1_000408 COc1cc2c(=O)c(coc2cc1O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E07 compound treatment 750348.6239 84300.0 0.39 625175.6757 -36200.0 -0.19 0.1394 0.3216 1524104 ACon1_000409 Oc1cc(O)c2C(=O)CC(Oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E08 compound treatment 733767.4419 67800.0 0.31 672099.0566 10800.0 0.06 0.2614 0.8227 2060441 ACon1_000410 OC(=O)c1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E09 mock treatment 728502.5641 62500.0 0.29 714888.3721 53600.0 0.28 0.4047 1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E10 mock treatment 742917.3913 76900.0 0.35 652053.1401 -9280.0 -0.05 0.216 0.6032 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E11 compound treatment 769933.3333 104000.0 0.48 776078.1893 115000.0 0.61 0.7693 0.993 3614358 ACon1_000411 C[C@H]1CCC[C@@H](O)CC(=O)c2c(O)cc(O)cc2CC(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E12 compound treatment 712878.2609 46900.0 0.22 789298.5075 128000.0 0.68 0.6328 0.8883 3553963 ACon1_000412 CC1CC(=O)C2=C(C1)C3OC3C4(O)C(O)c5c(O)cccc5C(=O)C24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E13 compound treatment 840071.4286 174000.0 0.8 808221.1538 147000.0 0.78 1.1185 0.9999 2565 ACon1_000413 COC1=CC(=O)OC1(O)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E14 compound treatment 770270.4918 104000.0 0.48 853012.8755 192000.0 1.02 1.0589 0.9415 3554186 ACon1_000414 CCC(O)CC1CCC(O1)C(C)C(=O)OC(C)CC2CCC(O2)C(C)C(=O)OC(C)CC3CCC(O3)C(C)C(=O)OC(C)CC4CCC(O4)C(C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E15 compound treatment 786261.8026 120000.0 0.55 824549.8008 163000.0 0.87 1.0043 0.9768 3614360 ACon1_000415 COC1CC(=O)C2(C3C(CC(C)C)NC2=O)C(C=C(C)C3C)/C=C(\C)/CCC(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E16 compound treatment 796750.0 131000.0 0.6 773472.4771 112000.0 0.59 0.8469 1.0 3559688 ACon1_000416 COc1ccc(C[C@H]2COC(=O)[C@@H]2Cc3ccc(O)c(OC)c3)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E17 mock treatment 755642.5121 89600.0 0.41 716713.5922 55400.0 0.29 0.5 0.986 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E18 mock treatment 736832.5581 70800.0 0.33 701490.7407 40200.0 0.21 0.3816 0.9785 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E19 compound treatment 651185.0394 -14800.0 -0.07 841561.5764 180000.0 0.96 0.6276 0.6549 3557588 ACon1_000417 CC(=CCc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(CC=C(C)C)c1C(O)C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E20 compound treatment 728051.6432 62000.0 0.29 768090.4523 107000.0 0.57 0.6027 0.95 3557280 ACon1_000418 C[C@H]1CC/C=C(\C)/[C@@H](O)/C=C/[C@@](C)(O)\C=C\C(=O)O[C@@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E21 compound treatment 771357.8431 105000.0 0.49 774920.1521 114000.0 0.6 0.7696 0.9943 3557796 ACon1_000419 C/C(=C\CC[C@](C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C=C)/CC[C@H](O)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E22 compound treatment 596770.5628 -69200.0 -0.32 557038.6266 -104000.0 -0.55 -0.6169 -0.9659 3554684 ACon1_000420 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](C=C)[C@@H]1C[C@H]3N(CCc4cc(O)c(O)cc34)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E23 compound treatment 706672.3404 40700.0 0.19 599095.8904 -62200.0 -0.33 -0.1008 -0.2655 3557854 ACon1_000421 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@]43C)C2[C@]1(C)O)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 E24 compound treatment 628608.8889 -37400.0 -0.17 641407.4074 -19900.0 -0.11 -0.1967 -0.9724 3559947 ACon1_000422 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)[C@H](C[C@@]31O)OC(=O)/C=C\c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F01 mock treatment 844212.5604 178000.0 0.82 826555.5556 165000.0 0.88 1.2008 0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F02 mock treatment 669227.4882 3220.0 0.01 700069.869 38700.0 0.21 0.1558 0.7563 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F03 compound treatment 860129.3532 194000.0 0.9 724784.9462 63500.0 0.34 0.871 0.9107 3558066 ACon1_000423 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](OC(=O)/C=C/c6ccccc6)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F04 compound treatment 846320.5742 180000.0 0.83 752333.3333 91000.0 0.48 0.9293 0.9665 3559407 ACon1_000424 CC1=C2CC([C@@H](O)CC2(C)CCC1)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F05 compound treatment 790216.8142 124000.0 0.57 697333.3333 36000.0 0.19 0.5401 0.8944 3559280 ACon1_000425 COc1cc(cc(OC)c1O)c2cc(=O)c3c(O)c(OC)c(OC)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F06 compound treatment 815918.7817 150000.0 0.69 878702.439 217000.0 1.15 1.3041 0.9701 3555180 ACon1_000426 COc1ccc(CCc2cc(OC)cc(=O)o2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F07 compound treatment 657260.6635 -8740.0 -0.04 800610.0917 139000.0 0.74 0.4939 0.6675 3559863 ACon1_000427 CCC1CN2CCc3cc(OC)c(OC)cc3C2CC1CC4=NCCc5cc(OC)c(OC)cc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F08 compound treatment 696855.8559 30900.0 0.14 561593.75 -99700.0 -0.53 -0.2734 -0.4992 3553794 ACon1_000428 CC[C@H](C)/C=C(\C)/C=C/C(=O)Cc1cc(O)c(C)c(O)c1C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F09 mock treatment 800195.4545 134000.0 0.62 722750.0 61400.0 0.33 0.6679 0.9551 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F10 mock treatment 635456.621 -30500.0 -0.14 730491.8699 69200.0 0.37 0.1598 0.4066 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F11 compound treatment 702850.4274 36800.0 0.17 685016.3934 23700.0 0.13 0.209 0.989 3554484 ACon1_000429 CN1C(=O)c2ccccc2NC(=O)[C@@]31O[C@@H]3c4cccc(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F12 compound treatment 743075.8929 77100.0 0.36 665436.5672 4110.0 0.02 0.2667 0.749 3557861 ACon1_000430 CC(=CC(=O)O[C@@H]1[C@H](OC(=O)C)c2c(OC1(C)C)ccc3ccc(=O)oc23)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F13 compound treatment 724549.0196 58500.0 0.27 630250.0 -31100.0 -0.16 0.0744 0.235 2060491 ACon1_000431 CC(C)CC(=O)O[C@@H]1[C@H](OC(=O)C)c2c(OC1(C)C)ccc3ccc(=O)oc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F14 compound treatment 645410.8911 -20600.0 -0.09 657141.9753 -4190.0 -0.02 -0.0829 -0.8496 3552813 ACon1_000432 C[C@@H]1Oc2c(C(CC(=O)O)c3ccccc3)c4OC(C)(C)C=Cc4c(O)c2C(=O)[C@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F15 compound treatment 651305.6769 -14700.0 -0.07 675047.3934 13700.0 0.07 0.0035 0.0354 3553624 ACon1_000433 CC(C)CC(=O)O[C@H]1C(CC2O[C@]2(C)C1=O)C(=C)C(=O)/C=C/C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F16 compound treatment 707742.0635 41700.0 0.19 703703.5398 42400.0 0.22 0.295 0.997 3557942 ACon1_000434 CC1CCC2(C)C(CC(=O)C=C2C)C1(C)CC/C(=C\C(=O)O)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F17 mock treatment 641935.4839 -24100.0 -0.11 695694.7791 34400.0 0.18 0.0504 0.2362 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F18 mock treatment 600539.6226 -65500.0 -0.3 658592.4528 -2740.0 -0.01 -0.2237 -0.7403 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F19 compound treatment 653269.8962 -12700.0 -0.06 706799.1266 45500.0 0.24 0.129 0.5198 3559629 ACon1_000435 C/C=C(/C)\C(=O)O[C@H]1C[C@@](C)(O)C(=O)[C@@H](OC(=O)/C(=C\C)/C)[C@@]2(C)CC[C@@](O)(C(C)C)[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F20 compound treatment 593462.1849 -72500.0 -0.33 585670.4981 -75700.0 -0.4 -0.5203 -0.9959 3554672 ACon1_000436 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C)/[C@@H]1CC(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F21 compound treatment 647468.75 -18500.0 -0.09 573381.6254 -87900.0 -0.47 -0.3903 -0.823 3559533 ACon1_000437 C[C@H]1C[C@H]2OC(=O)C(=C)[C@H]2CC3=C(C)C(=O)C[C@@H]13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F22 compound treatment 646917.603 -19100.0 -0.09 488137.931 -173000.0 -0.92 -0.7118 -0.7713 3558196 ACon1_000438 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)/C=C/c6ccc(O)c(O)c6)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F23 compound treatment 540818.1818 -125000.0 -0.58 504089.1089 -157000.0 -0.83 -0.9979 -0.9839 3559742 ACon1_000439 C/C=C(/C)\C(=O)O[C@H]1C=C(CO)C(=O)[C@H](OC(=O)\C(=C\CO)\C)[C@H]1C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 F24 compound treatment 648414.2259 -17600.0 -0.08 547777.7778 -114000.0 -0.6 -0.4832 -0.7952 1003829 ACon1_000440 CCCCCCC(O)CC=CCCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G01 compound treatment 641531.1005 -24500.0 -0.11 618322.87 -43000.0 -0.23 -0.2411 -0.9473 3557821 ACon1_000441 OC[C@@]1(O)CO[C@H](OC[C@H]2O[C@@H](OC(CCCCc3ccc(O)cc3)CCc4ccc(O)cc4)[C@H](O[C@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@@H]2O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G02 compound treatment 584870.5357 -81100.0 -0.37 620052.356 -41300.0 -0.22 -0.4194 -0.9674 1119359 ACon1_000442 COc1cc2ccc(=O)oc2c(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G03 mock treatment 612431.4721 -53600.0 -0.25 608675.5556 -52700.0 -0.28 -0.3722 -0.9981 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G04 mock treatment 623425.641 -42600.0 -0.2 633407.767 -27900.0 -0.15 -0.2436 -0.9903 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G05 compound treatment 562427.3504 -104000.0 -0.48 602600.0 -58700.0 -0.31 -0.558 -0.9785 3557908 ACon1_000443 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C)/[C@@H]1CC(=O)OCCc3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G06 compound treatment 805964.1434 140000.0 0.65 639257.5107 -22100.0 -0.12 0.3736 0.5696 3552802 ACon1_000444 C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(coc3c2)c4ccc(O)cc4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G07 compound treatment 550152.9851 -116000.0 -0.53 651089.4309 -10200.0 -0.05 -0.4162 -0.775 3558163 ACon1_000445 CC1(C)O[C@@]2(C)CC[C@@H]1CC2OC3OC(CO)C(O)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G08 compound treatment 539173.1449 -127000.0 -0.58 582494.5055 -78800.0 -0.42 -0.7093 -0.9865 3614356 ACon1_000446 COc1c(O)cc2C(O)C(C)OC(=O)c3c(O)c(OC)c(O)c(O)c3C(O)C(C)OC(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G09 compound treatment 616133.8583 -49900.0 -0.23 555782.7715 -106000.0 -0.56 -0.5585 -0.9228 1658516 ACon1_000447 CC(C)(O)C(O)COc1c2ccoc2cc3oc(=O)ccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G10 compound treatment 650026.5152 -16000.0 -0.07 628991.6318 -32300.0 -0.17 -0.1734 -0.9288 3614362 ACon1_000448 CC(=CCC/C(=C/CCC1(C)Oc2c3CN(C(CCC(=O)O)C(=O)O)C(=O)c3cc(O)c2CC1O)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G11 compound treatment 541400.7353 -125000.0 -0.57 584586.9565 -76700.0 -0.41 -0.6941 -0.9857 3553707 ACon1_000449 CC(CCC1C(C)(O)C(=O)C=C2C(C)(C)CCCC12C)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G12 compound treatment 540936.6516 -125000.0 -0.58 475250.8475 -186000.0 -0.99 -1.1057 -0.9673 3554773 ACon1_000450 COc1c(O)ccc2oc3c(OC)c4OC5(C)CCCC(O5)c4c(O)c3c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G13 compound treatment 548263.5659 -118000.0 -0.54 510215.0538 -151000.0 -0.8 -0.9507 -0.982 3553974 ACon1_000451 CC1CC(=O)OC(C)C(O)/C=C/C(=O)OC(C)C(O)/C=C/C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G14 compound treatment 559950.3311 -106000.0 -0.49 582621.2121 -78700.0 -0.42 -0.641 -0.9969 3555129 ACon1_000452 COc1ccc(cc1)C2(O)C(O)C(=O)Nc3ccccc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G15 compound treatment 551059.8291 -115000.0 -0.53 557228.4644 -104000.0 -0.55 -0.7653 -0.9998 3557302 ACon1_000453 CC(=O)NCCc1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G16 compound treatment 582756.654 -83200.0 -0.38 536306.338 -125000.0 -0.66 -0.7404 -0.9662 3559689 ACon1_000454 CO[C@H]1C[C@@H]2N3CC(O)[C@@]2(C=C1)c4cc5OCOc5cc4C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G17 compound treatment 508551.9481 -157000.0 -0.73 501038.2166 -160000.0 -0.85 -1.1146 -0.9969 3557386 ACon1_000455 CC1CCCC2OC2C(=O)c3c(O)cc(O)cc3CC(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G18 compound treatment 254872.549 -411000.0 -1.9 336762.5 -325000.0 -1.72 -2.5579 -0.9988 3553155 ACon1_000456 C[C@H]1O[C@H](C[C@@H](O)[C@@H]1O)O[C@@H]2[C@@H](C)O[C@H](C[C@H]2O)c3ccc4C(=O)C5=C(C=C[C@]6(O)C[C@@](C)(O)CC(=O)[C@]56O)C(=O)c4c3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G19 mock treatment 565102.0408 -101000.0 -0.47 600670.8333 -60700.0 -0.32 -0.5565 -0.9838 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G20 mock treatment 550556.6038 -115000.0 -0.53 573437.0079 -87900.0 -0.47 -0.7061 -0.9978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G21 compound treatment 584638.2114 -81400.0 -0.38 519363.9456 -142000.0 -0.75 -0.7978 -0.9483 3554304 ACon1_000457 CCCCCCCCCCC1C(=O)OC(C(=O)O)C1(O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G22 compound treatment 518590.7473 -147000.0 -0.68 575424.6575 -85900.0 -0.46 -0.8029 -0.9811 1059159 ACon1_000458 COC(=O)C1=COC(C)C2CN3CCC4(C3CC21)C(=O)Nc5ccccc54 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G23 compound treatment 535160.6426 -131000.0 -0.6 478641.5094 -183000.0 -0.97 -1.1118 -0.974 3557966 ACon1_000459 CC(=CCc1c(O)ccc2c(=O)c(coc12)c3ccc(O)cc3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 G24 compound treatment 580452.2822 -85600.0 -0.39 553911.7647 -107000.0 -0.57 -0.6818 -0.9839 3554685 ACon1_000460 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@H](O)C[C@]3(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H01 compound treatment 779012.987 113000.0 0.52 722457.7778 61100.0 0.32 0.5978 0.9739 3559300 ACon1_000461 C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC[C@@H]6C7[C@@](C)(O)[C@@H](CC=C(C)C)O[C@@]7(O)[C@H](O)[C@]65C)C3(C)C)O[C@H](CO)[C@H](O)[C@@H]2O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H02 compound treatment 730340.0 64300.0 0.3 774333.3333 113000.0 0.6 0.6336 0.9474 3559819 ACon1_000462 C/C=C(\C)/C(=O)O[C@@H]1C[C@@](C)(O)C(=O)C[C@@H](O)\C(=C\[C@H]2OC(=O)C(=C)[C@@H]21)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H03 mock treatment 643606.2176 -22400.0 -0.1 672850.9615 11500.0 0.06 -0.0298 -0.2485 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H04 mock treatment 661452.2613 -4550.0 -0.02 707726.8293 46400.0 0.25 0.1592 0.6445 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H05 compound treatment 588453.0612 -77500.0 -0.36 652789.9543 -8540.0 -0.05 -0.2849 -0.7904 3557937 ACon1_000463 COc1ccc(cc1)c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H06 compound treatment 367270.0 -299000.0 -1.38 323811.3208 -338000.0 -1.79 -2.24 -0.9916 3559369 ACon1_000464 CC(=C)C1CCC2(CCC3(C)C(CCC4C5(C)C(C=O)C(O)C(C)(C)C5CCC43C)C12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H07 compound treatment 763469.1358 97500.0 0.45 682285.1563 21000.0 0.11 0.3964 0.8562 3059949 ACon1_000465 CC(=O)NCCc1c[nH]c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H08 compound treatment 645278.8845 -20700.0 -0.1 540500.0 -121000.0 -0.64 -0.5207 -0.8037 3553802 ACon1_000466 CC[C@H](C)/C=C(\C)/C=C/C1=CC2=CC(=O)[C@]3(C)OC(=O)[C@H]([C@@H]3C2=CO1)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H09 compound treatment 321468.4685 -345000.0 -1.59 344779.5276 -317000.0 -1.68 -2.3107 -0.9996 3553991 ACon1_000467 Cc1cc(O)c(Oc2cc(C)cc(O)c2O)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H10 compound treatment 610290.9836 -55700.0 -0.26 591875.502 -69500.0 -0.37 -0.4422 -0.9845 3557512 ACon1_000468 COc1cc(cc(OC)c1O)C(=O)OCC2(O)COC(OCC3OC(Oc4c(OC)cc(CO)cc4OC)C(O)C(O)C3O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H11 compound treatment 562230.7692 -104000.0 -0.48 583689.0756 -77600.0 -0.41 -0.6296 -0.9972 3557927 ACon1_000469 CCC/C=C/1\OC(=O)C2=C1CCC(O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H12 compound treatment 670678.2609 4680.0 0.02 698261.7188 36900.0 0.2 0.1538 0.7802 3558562 ACon1_000470 COc1cc2ccc(=O)oc2cc1OCC=C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H13 compound treatment 577235.2941 -88800.0 -0.41 584929.8893 -76400.0 -0.41 -0.576 -1.0 3554565 ACon1_000471 COC(=O)[C@]12C(=O)C(C)C(=O)[C@]2(C)C(=C[C@H]3[C@]4(C)CC[C@H](OC(=O)C)C(C)(C)[C@H]4CC[C@@]31C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H14 compound treatment 505404.7619 -161000.0 -0.74 548251.7007 -113000.0 -0.6 -0.9478 -0.9945 3558607 ACon1_000472 COc1c2CC(Oc2cc3oc(CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(=O)c13)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H15 compound treatment 534631.2292 -131000.0 -0.61 512576.5472 -149000.0 -0.79 -0.9863 -0.9915 3555928 ACon1_000473 Oc1cc2O/C(=C\c3cc(O)c(O)c(O)c3)/C(=O)c2c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H16 compound treatment 475434.0278 -191000.0 -0.88 503702.7027 -158000.0 -0.84 -1.2126 -0.9997 3554273 ACon1_000474 CCCCCC[C@H](O)[C@@H]1C[C@@H](O)C2=C(O1)[C@@H](O)CCC2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H17 compound treatment 543439.2857 -123000.0 -0.57 537295.8333 -124000.0 -0.66 -0.8649 -0.9971 3554214 ACon1_000475 CCCC#CC#CCCCCCCCCCCC(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H18 compound treatment 473877.9661 -192000.0 -0.89 552267.7966 -109000.0 -0.58 -1.0355 -0.9787 3554824 ACon1_000476 COc1cc(=O)oc(c1C)[C@@]2(C)O[C@H]2/C(=C\C(=C\[C@@]3(C)O[C@@H](C)[C@]4(C)OC43)\C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H19 mock treatment 504667.7966 -161000.0 -0.74 495003.5842 -166000.0 -0.88 -1.1499 -0.9964 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H20 mock treatment 472380.137 -194000.0 -0.89 492832.7526 -168000.0 -0.89 -1.2633 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H21 compound treatment 593437.2624 -72600.0 -0.33 473116.8831 -188000.0 -1.0 -0.9425 -0.8952 3559440 ACon1_000477 COc1c(OC)c2c(C)cccc2oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H22 compound treatment 501980.198 -164000.0 -0.76 478829.5455 -183000.0 -0.97 -1.2193 -0.9926 3553645 ACon1_000478 CC(C)CC1NC(=O)C23C1C(C)C(=CC3/C=C(\C)/CCC(O)C(O)/C=C/C2=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H23 compound treatment 532072.7969 -134000.0 -0.62 563135.2459 -98200.0 -0.52 -0.805 -0.9964 3553179 ACon1_000479 CC(=C)C(=O)O[C@H]1CC(=C)C2C[C@H](O)[C@](O)(CO)C2[C@H]3OC(=O)C(=C)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 H24 compound treatment 519138.3929 -147000.0 -0.68 583662.037 -77700.0 -0.41 -0.7702 -0.9716 3558419 ACon1_000480 CC(=O)O[C@H]1C(=C)C2C[C@]31CCC4[C@@](C)(CCC[C@@]4(C)C3CC2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I01 compound treatment 666262.8866 260.0 0.0 838008.6957 177000.0 0.94 0.6635 0.708 3557823 ACon1_000481 OC[C@H]1O[C@@H](OC(CCCCc2ccc(O)cc2)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I02 compound treatment 626539.823 -39500.0 -0.18 692509.3458 31200.0 0.17 -0.0117 -0.0478 3558086 ACon1_000482 CC1(C)OC2(C)CCC1CC2OC3OC(COC(=O)c4cc(O)c(O)c(O)c4)C(O)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I03 compound treatment 708848.2143 42800.0 0.2 730371.179 69000.0 0.37 0.3987 0.9581 3557594 ACon1_000483 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](C)O[C@@H](OC[C@H]3O[C@@H](Oc4c(oc5cc(O)cc(O)c5c4=O)c6ccc(O)cc6)[C@H](O)[C@@H](O)[C@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I04 compound treatment 786650.4854 121000.0 0.56 698631.3364 37300.0 0.2 0.5333 0.9031 3554871 ACon1_000484 COc1cc(cc2OCOc21)[C@H](OC(=O)/C(=C\C)/C)[C@@H](C)OC(=O)[C@](C)(O)[C@H](C)OC(=O)/C(=C\C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I05 mock treatment 696596.7742 30600.0 0.14 771651.3761 110000.0 0.59 0.5135 0.8532 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I06 mock treatment 703377.2727 37400.0 0.17 706786.0082 45500.0 0.24 0.2924 0.9865 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I07 compound treatment 724635.6275 58600.0 0.27 676180.0766 14900.0 0.08 0.2469 0.8766 3554216 ACon1_000485 CCCC(=O)O[C@@H]1C[C@@](C)(OC(=O)C)C2C[C@H](OC(=O)/C(=C/C)/C)C(=C2[C@H]3OC(=O)[C@](C)(O)[C@@]31O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I08 compound treatment 747666.6667 81700.0 0.38 566007.0423 -95300.0 -0.51 -0.0912 -0.1447 3558194 ACon1_000486 CC(=O)O[C@@]1(C)C[C@@H](O)[C@]2(O)C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I09 compound treatment 619052.6316 -47000.0 -0.22 678044.9438 16700.0 0.09 -0.0904 -0.3864 3553540 ACon1_000487 CC(C)C(NC=O)C(=O)OCC(O)C(O)C(O)C(O)COC(=O)C(NC=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I10 compound treatment 633970.4797 -32000.0 -0.15 639873.2394 -21500.0 -0.11 -0.1849 -0.9917 3552799 ACon1_000488 C[C@@H]1O[C@@H](OC(=O)Cc2ccccc2)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I11 compound treatment 653693.4673 -12300.0 -0.06 611474.4526 -49900.0 -0.26 -0.2271 -0.8398 3553147 ACon1_000489 C[C@H]1CCC[C@H]2C[C@@]3(O)OC(=O)C(=C3C[C@]12C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I12 compound treatment 631696.9697 -34300.0 -0.16 627490.566 -33800.0 -0.18 -0.2388 -0.998 3554781 ACon1_000490 COc1c2C(=O)OCc2c(C)c3OC4(C)CC(O)C(C(C)(C)O)C(C)(CCC(=O)O)C4Cc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I13 compound treatment 695884.6154 29900.0 0.14 549194.6309 -112000.0 -0.59 -0.3231 -0.5293 3559698 ACon1_000491 C[C@H]1C[C@@]2(O)[C@H]([C@H]1O)[C@@H](O)C(=C)[C@H](O)C[C@H]3[C@@H](/C=C(\C)/C2=O)C3(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I14 compound treatment 612132.716 -53900.0 -0.25 568503.1056 -92800.0 -0.49 -0.5238 -0.9498 3614364 ACon1_000492 CC1OC(=O)C23C(=C)C4(C)OC(=O)C31OC4C5=C(CO)C6(CCC52C)C(O)CC(=O)OC6(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I15 compound treatment 619325.2595 -46700.0 -0.22 633904.2904 -27400.0 -0.15 -0.2551 -0.9818 3553199 ACon1_000493 CC(=CCc1ccc(Oc2c(O)cc(C)cc2CO)c(C(=O)O)c1O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I16 compound treatment 612910.0719 -53100.0 -0.24 565404.4944 -95900.0 -0.51 -0.5329 -0.9438 3185114 ACon1_000494 CC[C@]1(C=CCN2CC[C@]3([C@H]4N(C)c5cc(OC)ccc53)[C@@H]21)[C@@H](OC(=O)C)[C@]4(O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I17 compound treatment 647298.2456 -18700.0 -0.09 627709.8039 -33600.0 -0.18 -0.1871 -0.9445 3559677 ACon1_000495 C/C(=C\C(=O)O)/CC[C@H]1C(=C)CCC2[C@](C)(CCC[C@]12C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I18 compound treatment 581768.1661 -84200.0 -0.39 662480.2632 1150.0 0.01 -0.2704 -0.6959 804 ACon1_000496 COc1c(C)c2COC(=O)c2c(O)c1C/C=C(\C)/CCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I19 compound treatment 596909.4203 -69100.0 -0.32 738770.9924 77400.0 0.41 0.0651 0.1253 3557626 ACon1_000497 COc1ccc(CCC(=O)O)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I20 compound treatment 59979.1667 -606000.0 -2.79 63326.087 -598000.0 -3.17 -4.219 -0.998 3557415 ACon1_000498 COC(=O)C[C@@H]1C[C@@H](C)C2C([C@@H]1O)C(=O)c3c(O)c4C5CC(O)C(O)(C(C)O5)c4c(O)c3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I21 mock treatment 673790.2439 7790.0 0.04 593667.8832 -67700.0 -0.36 -0.2284 -0.6332 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I22 mock treatment 668827.907 2830.0 0.01 694260.4651 32900.0 0.17 0.1327 0.7577 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I23 compound treatment 603738.3966 -62300.0 -0.29 631684.2105 -29600.0 -0.16 -0.3142 -0.9598 3557848 ACon1_000499 O[C@@H]1[C@@H](O)[C@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)cc4)O[C@@H]([C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 I24 compound treatment 692533.8983 26500.0 0.12 602784.4828 -58500.0 -0.31 -0.1331 -0.3987 3557958 ACon1_000500 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C3C1CCC3(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J01 compound treatment 894431.4721 228000.0 1.05 818785.3403 157000.0 0.84 1.3354 0.9934 3554282 ACon1_000501 CCCCCCC(O)CCCCCC/C=C/[C@H](OC(=O)C)[C@@H](O)[C@H](O)[C@H](N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J02 compound treatment 830665.0246 165000.0 0.76 729893.617 68600.0 0.36 0.7941 0.9432 831700 ACon1_000502 CC(O)(CC(=O)O)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J03 compound treatment 812497.6077 146000.0 0.68 705981.982 44700.0 0.24 0.6452 0.9012 3559146 ACon1_000503 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)/C=C/c6ccccc6)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J04 compound treatment 825212.8713 159000.0 0.73 712778.8462 51400.0 0.27 0.7121 0.9092 3559332 ACon1_000504 CC1C2CCC3(C)C(O)CC=C(C)C3C2OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J05 mock treatment 692067.9612 26100.0 0.12 783995.5157 123000.0 0.65 0.5451 0.8238 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J06 mock treatment 687970.5882 22000.0 0.1 696738.7755 35400.0 0.19 0.2044 0.958 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J07 compound treatment 655681.4516 -10300.0 -0.05 645339.3665 -16000.0 -0.08 -0.0936 -0.9627 3559937 ACon1_000505 C[C@H]1O[C@@H](OC[C@H]2O[C@@H](O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CCC6=C5CC[C@]7(CCC(C)(C)C[C@@H]67)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)C3(C)C)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J08 compound treatment 553971.4286 -112000.0 -0.52 687781.4815 26500.0 0.14 -0.2661 -0.4971 3558531 ACon1_000506 O[C@H]1[C@@H](C[C@](C[C@H]1OC(=O)/C=C/c2ccc(O)c(O)c2)(OC(=O)/C=C/c3ccc(O)c(O)c3)C(=O)O)OC(=O)/C=C/c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J09 compound treatment 681607.6555 15600.0 0.07 605992.4242 -55300.0 -0.29 -0.1567 -0.5184 2060122 ACon1_000507 CC1(C)Oc2cc3oc(=O)ccc3cc2C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J10 compound treatment 579292.6829 -86700.0 -0.4 681713.2353 20400.0 0.11 -0.2063 -0.498 3558561 ACon1_000508 COc1cc2ccc(=O)oc2cc1OCC3OC3(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J11 compound treatment 535704.1667 -130000.0 -0.6 555617.1004 -106000.0 -0.56 -0.8214 -0.9994 3552721 ACon1_000509 C[C@@H]1CCC2C(C)(C)[C@H](O)CC[C@]2(C)[C@]31Cc4c(O3)c5CNC(=O)c5cc4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J12 compound treatment 530765.5172 -135000.0 -0.62 623143.3962 -38200.0 -0.2 -0.5842 -0.8909 3555910 ACon1_000510 OC[C@H]1O[C@@H](Oc2cccc3cc4COC(=O)c4c(O)c23)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J13 compound treatment 664204.4728 -1800.0 -0.01 717933.7748 56600.0 0.3 0.2064 0.6873 154 ACon1_000511 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@H]3C[C@@H]4C[C@@]32CC[C@]4(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J14 compound treatment 582160.9589 -83800.0 -0.39 555935.1852 -105000.0 -0.56 -0.6687 -0.9838 3554559 ACon1_000512 COC(=O)[C@]1(C)OC(=O)[C@@H]2[C@](C)(C(=C)C[C@]3(O)[C@@]4(C)CCC(=O)C(C)(C)C4=C(O)C(=O)[C@@]23C)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J15 compound treatment 601858.3691 -64100.0 -0.3 537193.5484 -124000.0 -0.66 -0.6747 -0.9348 1038770 ACon1_000513 COc1cc(O)c2c(=O)c(OC)c(oc2c1)c3ccc(OC)c(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J16 compound treatment 649211.8056 -16800.0 -0.08 641121.4575 -20200.0 -0.11 -0.1305 -0.9873 3558004 ACon1_000514 OC[C@H]1O[C@@H](O[C@@H]2OC=C([C@H]3CC=C(COC(=O)/C=C/c4ccccc4)[C@H]32)C(=O)O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J17 compound treatment 788680.2721 123000.0 0.57 927629.3706 266000.0 1.41 1.3988 0.9193 3552617 ACon1_000515 C[C@@H]1[C@@H](C[C@]23COC(=O)C3=CCC[C@@H]2[C@@]1(C)CC(OC(=O)C)c4ccoc4)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J18 compound treatment 464255.3846 -202000.0 -0.93 503258.9286 -158000.0 -0.84 -1.2507 -0.9987 1062454 ACon1_000516 COc1c(O)cc2oc(cc(=O)c2c1O)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J19 compound treatment 614720.9302 -51300.0 -0.24 547682.3899 -114000.0 -0.6 -0.5935 -0.9165 3559776 ACon1_000517 CCOC(=O)C1C(=O)C(=O)Nc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J20 compound treatment 488820.9607 -177000.0 -0.82 544969.9248 -116000.0 -0.62 -1.0142 -0.9904 3554280 ACon1_000518 CCCCCCC(C)C/C(=C\C(CO)\C=C(/C)\C=C\C(O)C(C)(C)c1cc(O)c([C@H]2O[C@@H](CO)C[C@@H](O)[C@@H]2O)c(=O)o1)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J21 mock treatment 567328.125 -98700.0 -0.46 562355.0296 -99000.0 -0.52 -0.693 -0.9975 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J22 mock treatment 629308.9431 -36700.0 -0.17 527020.0 -134000.0 -0.71 -0.6234 -0.8514 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J23 compound treatment 514833.3333 -151000.0 -0.7 542077.2201 -119000.0 -0.63 -0.9402 -0.9988 3554751 ACon1_000519 COC1=CC(=O)O[C@@H](CCc2ccccc2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 J24 compound treatment 573669.0647 -92300.0 -0.43 579020.1613 -82300.0 -0.44 -0.6098 -0.9999 3558337 ACon1_000520 O[C@@H]1C=C(C[C@@H](O[C@@H]2O[C@H](COC(=O)/C=C/c3ccccc3)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K01 compound treatment 624506.5502 -41500.0 -0.19 566566.6667 -94800.0 -0.5 -0.4907 -0.9124 3557834 ACon1_000521 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OCCc3ccc(O)c(O)c3)O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@H]2OC(=O)/C=C/c5ccc(O)c(O)c5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K02 compound treatment 649813.4921 -16200.0 -0.07 807310.3448 146000.0 0.77 0.4947 0.636 3558087 ACon1_000522 OCC1OC(Oc2cc(O)c(C(=O)O)c(/C=C/c3ccccc3)c2)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K03 compound treatment 633995.4338 -32000.0 -0.15 647540.2844 -13800.0 -0.07 -0.1561 -0.9475 3558017 ACon1_000523 COc1cc(O)c2c(=O)c(OC3OC(CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@H]4O)C(O)C(O)C3O)c(oc2c1)c6ccc(O)cc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K04 compound treatment 366356.5891 -300000.0 -1.38 391391.3043 -270000.0 -1.43 -1.9895 -0.9998 3554289 ACon1_000524 CCCCCCCC(=O)O[C@H]1[C@H](OC(=O)/C(=C/C)/C)C(=C2[C@H]3OC(=O)[C@](C)(O)[C@]3(O)[C@@H](C[C@@](C)(OC(=O)C)[C@H]12)OC(=O)C(C)CC)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K05 compound treatment 731341.5842 65300.0 0.3 696783.5498 35500.0 0.19 0.346 0.9742 3558061 ACon1_000525 CC1CC(O)C2C(OC(=O)C2=C)C3=C(C)C(=O)CC13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K06 compound treatment 690420.0743 24400.0 0.11 646811.4754 -14500.0 -0.08 0.0252 0.1845 3555625 ACon1_000526 O[C@H]1[C@H](O)[C@@H](COC(=O)c2ccccc2)O[C@@H](Oc3ccc(O)cc3COC(=O)C4(O)C=CCCC4=O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K07 mock treatment 655907.5342 -10100.0 -0.05 643434.4569 -17900.0 -0.09 -0.1 -0.9462 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K08 mock treatment 719881.6794 53900.0 0.25 624786.4769 -36500.0 -0.19 0.0386 0.1226 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K09 compound treatment 621688.5965 -44300.0 -0.2 597109.4891 -64200.0 -0.34 -0.3854 -0.9701 3559841 ACon1_000527 COc1ccc(cc1)c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]5O[C@H](COC(=O)C)[C@@H](O)[C@@H](O)[C@H]5O)c(O)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K10 compound treatment 671359.2593 5360.0 0.02 778180.3279 117000.0 0.62 0.4557 0.7347 3554769 ACon1_000528 COc1c(O)cc2C(O)C(C)OC(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K11 compound treatment 677496.5753 11500.0 0.05 606874.1007 -54500.0 -0.29 -0.1668 -0.5679 3557888 ACon1_000529 OC[C@H]1O[C@@H](OC(C#N)c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K12 compound treatment 708993.4426 43000.0 0.2 653986.532 -7340.0 -0.04 0.1126 0.5575 3614365 ACon1_000530 CC1(CO)CCCC2(C)C1C(=O)CC3=C2COC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K13 compound treatment 501240.6015 -165000.0 -0.76 651693.2773 -9640.0 -0.05 -0.5734 -0.753 3559595 ACon1_000531 C/C/1=C\CC[C@@]2(C)O[C@@H]2C[C@H]3[C@H](C1)OC(=O)C3=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K14 compound treatment 665975.7576 -26.9 0.0 667728.1553 6400.0 0.03 0.0239 0.7045 3557305 ACon1_000532 COc1cc(O)cc(C(=O)O)c1Oc2cc(C)cc(O)c2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K15 mock treatment 578954.955 -87000.0 -0.4 587851.7241 -73500.0 -0.39 -0.5594 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K16 mock treatment 567875.4448 -98100.0 -0.45 563618.2432 -97700.0 -0.52 -0.6865 -0.9977 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K17 compound treatment 710961.165 45000.0 0.21 621775.974 -39600.0 -0.21 -0.0017 -0.0059 3614366 ACon1_000533 CC(C)CC1NC(=O)C(C)NC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K18 compound treatment 587163.3466 -78800.0 -0.36 576669.9029 -84700.0 -0.45 -0.5746 -0.9945 3559135 ACon1_000534 O[C@@H]1[C@H](Oc2cc(O)cc(O)c2C1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K19 compound treatment 490081.5603 -176000.0 -0.81 527977.8598 -133000.0 -0.71 -1.0738 -0.9977 3557598 ACon1_000535 COc1c(O)cc2oc(c(OC)c(=O)c2c1O)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K20 compound treatment 640379.4326 -25600.0 -0.12 629626.087 -31700.0 -0.17 -0.2025 -0.9851 3558949 ACon1_000536 C[C@@H]1O[C@@H](O[C@@H]2CO[C@@H](O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C6[C@@H]7CC(C)(C)CC[C@@]7(CC[C@]65C)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@]3(C)CO)[C@H](O)[C@H]2O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K21 compound treatment 712522.3881 46500.0 0.21 598650.9434 -62700.0 -0.33 -0.0834 -0.2107 3552947 ACon1_000537 C[C@H]1[C@@H](O)C[C@H]2[C@@H]1[C@H](OC3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K22 compound treatment 594228.1879 -71800.0 -0.33 579770.318 -81600.0 -0.43 -0.5399 -0.9913 1092498 ACon1_000538 OCC(O)c1nc(CO)cc2c3ccccc3[nH]c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K23 mock treatment 713392.5234 47400.0 0.22 648174.0741 -13200.0 -0.07 0.1052 0.4585 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 K24 mock treatment 563527.1318 -102000.0 -0.47 613059.2885 -48300.0 -0.26 -0.5152 -0.9586 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L01 compound treatment 742426.5403 76400.0 0.35 891082.9694 230000.0 1.22 1.1109 0.8757 3554760 ACon1_000539 COc1c(CO)c(O)cc2C(O)CCC(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L02 compound treatment 855954.918 190000.0 0.88 729241.7062 67900.0 0.36 0.8741 0.9229 3559718 ACon1_000540 C[C@H]1C[C@H](O)C[C@H]2[C@H](OC(=O)C=C(C)C)[C@H](O)[C@H](C[C@]12C)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L03 compound treatment 775743.8424 110000.0 0.51 719038.0952 57700.0 0.31 0.5743 0.971 3558002 ACon1_000541 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)/C=C/c6ccccc6)[C@H](OC(=O)/C=C/c7ccccc7)[C@H]1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L04 compound treatment 877665.2174 212000.0 0.98 904760.5042 243000.0 1.29 1.6032 0.9905 3559482 ACon1_000542 C/C=C(\C)/C(=O)O[C@@H]1C\C(=C\CC\C(=C\[C@H]2OC(=O)C(=C)C21)\C)\C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L05 compound treatment 695515.1515 29500.0 0.14 770275.7009 109000.0 0.58 0.5048 0.8504 592 ACon1_000543 Oc1ccc(cc1)c2coc3cc(O)ccc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L06 compound treatment 713679.8246 47700.0 0.22 705331.7308 44000.0 0.23 0.3205 0.9996 3614367 ACon1_000544 C[C@H]1[C@H](O)CCC2=CC(=O)[C@H](C[C@]12C)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L07 mock treatment 777691.7293 112000.0 0.52 649484.0 -11800.0 -0.06 0.3198 0.6163 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L08 mock treatment 763613.7339 97600.0 0.45 702181.8182 40900.0 0.22 0.4715 0.9438 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L09 compound treatment 811012.1951 145000.0 0.67 676218.107 14900.0 0.08 0.5287 0.7851 1024930 ACon1_000545 COc1c2C=CC(C)(C)Oc2cc3oc(=O)ccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L10 compound treatment 710350.7463 44300.0 0.2 686809.5238 25500.0 0.14 0.2402 0.9798 3558539 ACon1_000546 OC[C@H]1O[C@@H](O[C@@H]2OC=C3C(=O)OCC[C@@]3(O)[C@H]2C=C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L11 compound treatment 805700.0 140000.0 0.64 826100.0 165000.0 0.87 1.0735 0.9887 3557749 ACon1_000547 CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L12 compound treatment 655272.7273 -10700.0 -0.05 605992.3664 -55300.0 -0.29 -0.2425 -0.8148 3555408 ACon1_000548 CSC(=O)OCC1=C[C@@H]2OC(=O)C3=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]1[C@H]23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L13 compound treatment 602723.4848 -63300.0 -0.29 736822.6415 75500.0 0.4 0.0768 0.155 1010501 ACon1_000549 Cn1c(=O)n(C)c2c(=O)n(C)c(=O)n(C)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L14 compound treatment 674949.6855 8950.0 0.04 728052.9801 66700.0 0.35 0.2794 0.7842 3558008 ACon1_000550 COc1cc(/C=C/C(=O)O[C@@H]2C[C@](O)(C[C@@H](O)[C@@H]2O)C(=O)O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L15 mock treatment 681669.1176 15700.0 0.07 614395.9732 -46900.0 -0.25 -0.1249 -0.482 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L16 mock treatment 617410.2564 -48600.0 -0.22 522228.2958 -139000.0 -0.74 -0.6802 -0.8821 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L17 compound treatment 636147.8873 -29900.0 -0.14 619365.0794 -42000.0 -0.22 -0.2547 -0.9733 2060138 ACon1_000551 C[C@]1([C@H]2[C@H](C(=O)O)[C@]3(CC(=C)[C@@]4(O)C3)[C@@H](CC4)[C@]52OC1=O)[C@@H](O)C=C5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L18 compound treatment 576293.4783 -89700.0 -0.41 634198.7179 -27100.0 -0.14 -0.3943 -0.9002 3558019 ACon1_000552 CC1C2CC3C(CCC(=O)C)C3(C)CC2OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L19 compound treatment 657741.8301 -8260.0 -0.04 586017.0648 -75300.0 -0.4 -0.3094 -0.771 3559721 ACon1_000553 C/C(=C\CO)/C(=O)O[C@@H]1C\C(=C\CC[C@@]2(C)OC2[C@H]3OC(=O)C(=C)C31)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L20 compound treatment 701564.6259 35600.0 0.16 659771.1268 -1560.0 -0.01 0.1101 0.6706 3558114 ACon1_000554 OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](O)[C@@H]4O[C@]4(COC(=O)/C=C/c5ccccc5)[C@H]32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L21 compound treatment 611025.0 -55000.0 -0.25 602028.3688 -59300.0 -0.31 -0.4017 -0.9943 3553337 ACon1_000555 CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@]2(C)[C@@H](CC3[C@H](OC(=O)C3=C)[C@H]2C1=C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L22 compound treatment 558902.439 -107000.0 -0.49 562591.9003 -98700.0 -0.52 -0.7196 -0.9996 3558119 ACon1_000556 COc1ccc(/C=C/C(=O)OC2CC(C)(O)C3C(OC4OC(CO)C(O)C(O)C4O)OC=CC23O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L23 mock treatment 595057.047 -70900.0 -0.33 568214.0351 -93100.0 -0.49 -0.5806 -0.98 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 L24 mock treatment 567776.0 -98200.0 -0.45 673443.1818 12100.0 0.06 -0.2749 -0.6008 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M01 compound treatment 683282.0513 17300.0 0.08 673121.3235 11800.0 0.06 0.1006 0.9928 3557875 ACon1_000557 CC(CCc1ccc(O)cc1)O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M02 compound treatment 612427.3128 -53600.0 -0.25 621747.8992 -39600.0 -0.21 -0.3232 -0.9967 3558144 ACon1_000558 Cc1c(O)cc(O)c2C(=O)CC(Oc12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M03 compound treatment 627700.3891 -38300.0 -0.18 585628.0 -75700.0 -0.4 -0.4088 -0.932 3557783 ACon1_000559 O[C@H]1CO[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M04 compound treatment 643490.7063 -22500.0 -0.1 672863.2813 11500.0 0.06 -0.0302 -0.2502 353 ACon1_000560 Oc1cc(O)c2c(=O)c(O)c(oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M05 compound treatment 817659.3886 152000.0 0.7 694317.8295 33000.0 0.17 0.6183 0.8576 3555963 ACon1_000561 OCC1OC(OC(=O)c2c(O)cc(O)cc2/C=C/c3ccccc3)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M06 compound treatment 1263356.589 597000.0 2.75 970874.1259 310000.0 1.64 3.1089 0.9694 3557538 ACon1_000562 CC1CC2OC(=O)C(=C)C2CC3OC31/C=C/C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M07 compound treatment 754477.6632 88500.0 0.41 506226.9231 -155000.0 -0.82 -0.2932 -0.3193 3558167 ACon1_000563 CCCCCC(=O)OC1C(OC(=O)/C(=C/C)/C)C(=C2C3OC(=O)C(C)(O)C3(O)C(CC(C)(OC(=O)C)C12)OC(=O)CCC)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M08 compound treatment 691919.4631 25900.0 0.12 658026.7559 -3300.0 -0.02 0.0721 0.5971 3558079 ACon1_000564 CC(=O)O[C@@]1(C)C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M09 mock treatment 614535.9712 -51500.0 -0.24 606673.7288 -54700.0 -0.29 -0.3728 -0.9951 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M10 mock treatment 682007.722 16000.0 0.07 653090.2527 -8240.0 -0.04 0.0213 0.2482 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M11 compound treatment 600098.9011 -65900.0 -0.3 614441.6667 -46900.0 -0.25 -0.3908 -0.995 3558160 ACon1_000565 COc1cc(O)c2C(=O)[C@H](O)[C@H](Oc2c1)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M12 compound treatment 562741.6107 -103000.0 -0.48 563764.0845 -97600.0 -0.52 -0.7026 -0.9991 3614369 ACon1_000566 COc1ccc(C(=O)Oc2ccc(C)c3CC(C)OC(=O)c23)c4CC(C)OC(=O)c14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M13 mock treatment 543890.9091 -122000.0 -0.56 600842.2939 -60500.0 -0.32 -0.6251 -0.9644 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M14 mock treatment 601163.2653 -64800.0 -0.3 575466.1654 -85900.0 -0.46 -0.5335 -0.9792 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M15 compound treatment 643977.0492 -22000.0 -0.1 583090.0 -78200.0 -0.41 -0.3653 -0.8549 3554270 ACon1_000567 CCCCCC(O)CC(O)CC(=O)OC(CCCCC)CC(O)CC(=O)OCC(O)C(O)C(O)C(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M16 compound treatment 503130.0813 -163000.0 -0.75 481272.2772 -180000.0 -0.96 -1.2064 -0.9929 3559697 ACon1_000568 CC1(C)[C@H](O)CC[C@@]2(C)[C@H](COc3ccc4ccc(=O)oc4c3)C(=C)CC[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M17 compound treatment 578916.4087 -87100.0 -0.4 602915.0327 -58400.0 -0.31 -0.5031 -0.9918 3614370 ACon1_000569 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2O[C@@H]3[C@@H](O)[C@H](O)[C@H](O[C@H]3O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC=C7[C@@H]8CC(C)(C)C[C@@H](O)[C@]8(C)CC[C@]76C)[C@@]4(C)CO)C(=O)O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M18 compound treatment 687266.6667 21300.0 0.1 504875.0 -156000.0 -0.83 -0.5174 -0.6192 3554688 ACon1_000570 COC(=O)C1=CO[C@@H](OC2OC(CO)C(O)C(O)C2O)[C@H](C=C)[C@@H]1CCOC(=O)c3cc(O)c(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M19 compound treatment 640875.0 -25100.0 -0.12 674566.6667 13200.0 0.07 -0.0323 -0.2384 3553705 ACon1_000571 CC(CCC1(O)OC(=O)C=C1C)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M20 compound treatment 570007.5188 -96000.0 -0.44 685178.0303 23800.0 0.13 -0.2236 -0.4856 3559384 ACon1_000572 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H](C)[C@H](C[C@@H]31)OC(=O)C4=CO[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H]6[C@@H](C)[C@@H](O)C[C@@H]64 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M21 compound treatment 547950.5703 -118000.0 -0.54 524696.9697 -137000.0 -0.72 -0.8974 -0.9901 3557814 ACon1_000573 COc1cc(cc(OC)c1O)C2C(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(CO)Cc4cc(OC)c(O)c(OC)c24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M22 compound treatment 533204.947 -133000.0 -0.61 428509.8039 -233000.0 -1.23 -1.3062 -0.9476 1023017 ACon1_000574 COc1cc2oc(=O)ccc2cc1CC=C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M23 compound treatment 618122.807 -47900.0 -0.22 531373.494 -130000.0 -0.69 -0.6435 -0.8891 3558029 ACon1_000575 COc1ccc(CCO[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@@H](OC(=O)/C=C/c4ccc(O)c(OC)c4)[C@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@H]2O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 M24 compound treatment 503052.8455 -163000.0 -0.75 456453.2872 -205000.0 -1.09 -1.2998 -0.9838 3559875 ACon1_000576 COc1ccc(cc1)c2oc3cc(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc(O)c3c(=O)c2O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N01 compound treatment 796067.8733 130000.0 0.6 896129.7071 235000.0 1.25 1.3047 0.9439 3558056 ACon1_000577 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C)/[C@@H]1CC(=O)OCCc3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N02 compound treatment 764370.1923 98400.0 0.45 858470.5882 197000.0 1.05 1.0601 0.9301 2118288 ACon1_000578 CCCC#C/C=C/1\OC(=O)C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N03 compound treatment 699171.4286 33200.0 0.15 656564.6552 -4770.0 -0.03 0.0903 0.5824 3558083 ACon1_000579 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N04 compound treatment 644415.3846 -21600.0 -0.1 616191.6667 -45100.0 -0.24 -0.2397 -0.9244 3553187 ACon1_000580 CC(=CCC/C(=C/COc1cc(=O)oc2cccc(C)c12)/COC(=O)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N05 compound treatment 761559.322 95600.0 0.44 607420.8333 -53900.0 -0.29 0.1094 0.2083 3173763 ACon1_000581 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N06 compound treatment 770188.5246 104000.0 0.48 641968.1818 -19400.0 -0.1 0.2671 0.5437 1733214 ACon1_000582 Oc1ccc(cc1)C2CC(=O)c3c(O)cc(O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N07 compound treatment 851375.5869 185000.0 0.85 664670.6827 3340.0 0.02 0.617 0.7216 1043213 ACon1_000583 COC(=O)C1C(O)CCC2CN3CCc4c([nH]c5ccccc45)C3CC12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N08 compound treatment 710299.2424 44300.0 0.2 617314.3939 -44000.0 -0.23 -0.0206 -0.0665 3558609 ACon1_000584 COc1cc(ccc1O)[C@H]2OC[C@](O)(Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)[C@@H]2CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N09 mock treatment 661362.2047 -4640.0 -0.02 666940.1709 5610.0 0.03 0.0059 0.1612 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N10 mock treatment 811940.367 146000.0 0.67 745606.0606 84300.0 0.45 0.792 0.9802 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N11 compound treatment 614458.3333 -51500.0 -0.24 635233.9623 -26100.0 -0.14 -0.266 -0.9669 3553255 ACon1_000585 CC(=O)CCCC1Cc2cccc(O)c2C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N12 compound treatment 648354.8387 -17600.0 -0.08 727800.6873 66500.0 0.35 0.1917 0.5299 3553375 ACon1_000586 CC(=O)OC[C@@]12CCC(=CC2O[C@@H]3[C@H](O)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@]1(C)C53CO5)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N13 mock treatment 643913.4948 -22100.0 -0.1 751382.8125 90100.0 0.48 0.2657 0.5441 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N14 mock treatment 581257.9365 -84700.0 -0.39 609439.3305 -51900.0 -0.28 -0.471 -0.9853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N15 compound treatment 577026.4317 -89000.0 -0.41 646752.809 -14600.0 -0.08 -0.3448 -0.8258 1303116 ACon1_000587 Oc1cc(O)c(C(=O)CCc2ccccc2)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N16 compound treatment 599593.9597 -66400.0 -0.31 656565.5172 -4760.0 -0.03 -0.2344 -0.7629 3557944 ACon1_000588 C/C(=C\C(=O)O)/CCC1=C(C)CCC2C(C)(C)CCC[C@@]21C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N17 compound treatment 616114.1732 -49900.0 -0.23 554586.9565 -107000.0 -0.57 -0.563 -0.9213 3559690 ACon1_000589 COC(=O)C1[C@@H]2Cc3c([nH]c4ccccc34)C(=O)C[C@@H]1/C(=C\C)/CN2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N18 compound treatment 685241.3793 19200.0 0.09 549950.9804 -111000.0 -0.59 -0.355 -0.5942 3558020 ACon1_000590 OC[C@H]1OC([C@H](O)[C@@H](O)[C@H]1O)c2c(O)cc(O)c3c(=O)cc(oc23)c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N19 compound treatment 538722.7414 -127000.0 -0.59 696996.139 35700.0 0.19 -0.2813 -0.4561 3559729 ACon1_000591 CC1=CC2(CC1CC=C23)CCC4[C@](C)(CO)[C@H](O)CC[C@]43C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N20 compound treatment 604962.0253 -61000.0 -0.28 572316.726 -89000.0 -0.47 -0.5329 -0.9695 3558252 ACon1_000592 COc1cc2occc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1CCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N21 compound treatment 605425.5319 -60600.0 -0.28 492158.0645 -169000.0 -0.9 -0.832 -0.8853 3553911 ACon1_000593 CC1=C2[C@@H]3OC(=O)C(=C)[C@@H]3CC(=O)[C@@]2(C)CCC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N22 compound treatment 601685.1211 -64300.0 -0.3 573881.2261 -87400.0 -0.46 -0.5377 -0.9767 3558104 ACon1_000594 CC1CC(=O)[C@@]2(O)[C@@H]1[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(=O)OCCc4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N23 compound treatment 570168.8742 -95800.0 -0.44 618144.3299 -43200.0 -0.23 -0.4745 -0.9532 3554077 ACon1_000595 Cc1cccc2oc(=O)c3c(O[C@@]4(C[C@]3(C)C=C)OC[C@@]5(C)O[C@H]54)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 N24 compound treatment 110674.4186 -555000.0 -2.56 83250.0 -578000.0 -3.07 -3.979 -0.996 3558467 ACon1_000596 Oc1cc(O)cc(CCCCCCC/C=C\C/C=C\CC=C)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O01 compound treatment 599967.6113 -66000.0 -0.3 659840.0 -1490.0 -0.01 -0.2209 -0.7252 3557850 ACon1_000597 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)C2[C@]1(C)O)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O02 compound treatment 681748.8372 15700.0 0.07 685288.4615 24000.0 0.13 0.1412 0.9648 3558145 ACon1_000598 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@@H]2OC(=O)[C@@]34CCC(C)(C)CC4C5=CCC6[C@@]7(C)C[C@H](O)[C@H](O[C@@H]8O[C@@H]([C@@H](O)[C@H](O)[C@H]8O)C(=O)O)[C@](C)(C7CC[C@@]6(C)[C@]5(C)CC3)C(=O)O)[C@H](O)[C@H](O)[C@H]1O[C@@H]9OC[C@@H](O)[C@H](O)[C@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O03 compound treatment 733480.4688 67500.0 0.31 670300.7519 8970.0 0.05 0.2537 0.8059 3554994 ACon1_000599 COc1cc(O)cc(c2cc(O)c(O)cc2C)c1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O04 compound treatment 701712.3894 35700.0 0.16 644129.3103 -17200.0 -0.09 0.0519 0.2759 3558210 ACon1_000600 Oc1ccc(/C=C/C(=O)NCCCCN(CCCN(CCCNC(=O)\C=C\c2ccc(O)cc2)C(=O)\C=C\c3ccc(O)cc3)C(=O)\C=C\c4ccc(O)cc4)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O05 compound treatment 679784.3137 13800.0 0.06 645184.466 -16100.0 -0.09 -0.0156 -0.1464 3558099 ACon1_000601 COc1ccc(cc1OC)[C@H]2OC[C@@H]3[C@H](OC[C@H]23)c4ccc(O[C@@H]5O[C@H](CO)C(O)[C@H](O)[C@H]5O)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O06 compound treatment 620552.1739 -45500.0 -0.21 605511.1111 -55800.0 -0.3 -0.3576 -0.9857 3557819 ACon1_000602 COC(=O)/C=C(\C)/CC[C@H]1C(=C)CCC2[C@](C)(CCC[C@]12C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O07 compound treatment 585217.7778 -80800.0 -0.37 641455.5556 -19900.0 -0.11 -0.338 -0.8729 3558175 ACon1_000603 CC1CC2OC(=O)C(=C)C2CC=C1CCC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O08 compound treatment 580449.2188 -85600.0 -0.39 522723.2143 -139000.0 -0.74 -0.7988 -0.9574 3557525 ACon1_000604 CC1OC(OC2C(O)C(OCCc3ccc(O)c(O)c3)OC(CO)C2OC(=O)/C=C/c4ccc(O)c(O)c4)C(OC5OCC(O)C(O)C5O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O09 compound treatment 704735.9307 38700.0 0.18 604353.7736 -57000.0 -0.3 -0.0874 -0.2489 3614377 ACon1_000605 C[C@H]1[C@H](O)CCC2=CC(=O)[C@@]3(O[C@@H]3[C@]12C)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O10 compound treatment 631589.2116 -34400.0 -0.16 683488.9868 22200.0 0.12 -0.0291 -0.1474 3558377 ACon1_000606 CC(=CCc1c(O)cc2occ(c3ccc(O)cc3O)c(=O)c2c1O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O11 mock treatment 675678.8618 9680.0 0.04 664836.0 3510.0 0.02 0.0447 0.9247 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O12 mock treatment 622678.8618 -43300.0 -0.2 637289.7196 -24000.0 -0.13 -0.2314 -0.9765 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O13 compound treatment 654987.013 -11000.0 -0.05 646789.6996 -14500.0 -0.08 -0.0905 -0.9795 3558336 ACon1_000607 COc1cc(cc(OC)c1OC)[C@H]2OC[C@@H]3[C@H](OC[C@H]23)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O14 compound treatment 596694.1176 -69300.0 -0.32 587619.403 -73700.0 -0.39 -0.5025 -0.995 3559606 ACon1_000608 COc1cc(CCc2ccc3OCOc3c2)oc(=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O15 compound treatment 655438.4615 -10600.0 -0.05 676930.8943 15600.0 0.08 0.0241 0.2506 3553200 ACon1_000609 CC(=CCCC(C)(O)C(O)CC(OC(=O)C)/C(=C/COCC(O)C(O)C(O)C(O)CO)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O16 compound treatment 568159.8513 -97800.0 -0.45 684035.8566 22700.0 0.12 -0.2339 -0.5008 3074726 ACon1_000610 C[C@H]1O[C@H](C[C@H](O)[C@@H]1O)O[C@@H]2[C@@H](C)O[C@H](C[C@@H]2O)O[C@@H]3[C@@H](C)O[C@H](C[C@@H]3O)O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]7(C)[C@H](CC[C@]67O)C8=CC(=O)OC8)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O17 compound treatment 625134.9206 -40900.0 -0.19 576922.0779 -84400.0 -0.45 -0.4498 -0.9261 3557679 ACon1_000611 CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O18 compound treatment 562685.7143 -103000.0 -0.48 507051.0949 -154000.0 -0.82 -0.9155 -0.9669 3559274 ACon1_000612 COc1cc(OC)c(O[C@@H]2O[C@H](COC(=O)c3cc(O)c(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O19 compound treatment 510744.8276 -155000.0 -0.72 547607.1429 -114000.0 -0.6 -0.9328 -0.9964 3557735 ACon1_000613 COC1CC(O[C@H]2CC[C@@]3(C)C(CCC4C3CC[C@]5(C)C(CCC45O)C6=CC(=O)OC6)C2)OC(C)C1OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O20 compound treatment 536774.3056 -129000.0 -0.6 547238.2979 -114000.0 -0.61 -0.8493 -1.0 3558277 ACon1_000614 C[C@@H]1O[C@@H](O[C@H]2[C@H](C)O[C@@H](Oc3c(oc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)c6ccc(O)cc6)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O21 compound treatment 557517.1233 -108000.0 -0.5 730647.0588 69300.0 0.37 -0.0938 -0.1511 3557827 ACon1_000615 OC(CCCCc1ccc(O)cc1)CCc2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O22 compound treatment 508174.2739 -158000.0 -0.73 543896.4143 -117000.0 -0.62 -0.9551 -0.997 3557897 ACon1_000616 C[C@@H]1O[C@@H](O[C@@H]2[C@H](Oc3cc(O)cc(O)c3C2=O)c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O23 compound treatment 582768.9076 -83200.0 -0.38 548865.6126 -112000.0 -0.6 -0.6932 -0.9773 3555034 ACon1_000617 COc1ccc(/C=C/C(=O)O[C@H]2[C@H](O[C@@H]3[C@@H]4O[C@]4(CO)[C@@H]5[C@H]3C=CO[C@H]5O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O[C@@H](C)[C@H](O)[C@H]2OC(=O)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 O24 compound treatment 512394.1606 -154000.0 -0.71 580609.9291 -80700.0 -0.43 -0.8036 -0.9709 3559877 ACon1_000618 OC[C@H]1O[C@@H](Oc2cc(O)c(C(=O)CCc3ccc(O)cc3)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P01 compound treatment 519863.4146 -146000.0 -0.67 572824.3243 -88500.0 -0.47 -0.8085 -0.9844 3559267 ACon1_000619 CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CCC4[C@@]5(C)[C@H]([C@H](O)[C@](C)(CO)C5CC[C@]43C)C(=O)O)C12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P02 compound treatment 395653.0612 -270000.0 -1.25 369530.0 -292000.0 -1.55 -1.976 -0.9943 3559411 ACon1_000620 CC(C)[C@@H]1CC[C@@]2(C)CCC[C@@](C)(O)[C@@H]2[C@H]1OC(=O)/C=C/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P03 compound treatment 643938.7755 -22100.0 -0.1 578463.4146 -82900.0 -0.44 -0.3827 -0.8484 3557780 ACon1_000621 C/C(=C\CO)/CC[C@H]1C(=C)CCC2[C@](C)(CCC[C@]12C)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P04 compound treatment 680268.0 14300.0 0.07 613785.7143 -47500.0 -0.25 -0.1318 -0.5057 1506 ACon1_000622 OCc1cc(=O)c(O)co1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P05 compound treatment 608557.3123 -57400.0 -0.26 486077.8689 -175000.0 -0.93 -0.8446 -0.8738 3557935 ACon1_000623 OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](O)[C@@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P06 compound treatment 530008.5106 -136000.0 -0.63 561594.2623 -99700.0 -0.53 -0.8175 -0.9964 3554108 ACon1_000624 CCC(C)/C=C(\C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(=O)C)C(=O)C2=CO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P07 compound treatment 613470.1195 -52500.0 -0.24 566800.7968 -94500.0 -0.5 -0.5258 -0.9443 1043213 ACon1_000625 COC(=O)C1C(O)CCC2CN3CCc4c([nH]c5ccccc45)C3CC12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P08 compound treatment 534074.0741 -132000.0 -0.61 587709.9567 -73600.0 -0.39 -0.7063 -0.977 3557255 ACon1_000626 OC(=O)C(=C)Oc1cccc(c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P09 compound treatment 598125.0 -67900.0 -0.31 553801.8433 -108000.0 -0.57 -0.6246 -0.9601 3559264 ACon1_000627 COc1cc2oc(cc(=O)c2c(O)c1OC)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P10 compound treatment 507015.5039 -159000.0 -0.73 574307.3593 -87000.0 -0.46 -0.8448 -0.9751 3553970 ACon1_000628 Cc1cc(=O)c2c(O)c3CC(Oc3cc2o1)C(C)(C)OC4OC(CO)C(O)C(O)C4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P11 mock treatment 517906.6667 -148000.0 -0.68 579589.1089 -81700.0 -0.43 -0.7895 -0.9759 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P12 mock treatment 517039.0625 -149000.0 -0.69 535567.0996 -126000.0 -0.67 -0.9574 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P13 compound treatment 539549.5495 -126000.0 -0.58 525514.1509 -136000.0 -0.72 -0.9217 -0.9945 3553930 ACon1_000629 CC1=CC(=O)C[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3CC12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P14 compound treatment 570796.4602 -95200.0 -0.44 566778.626 -94600.0 -0.5 -0.6651 -0.9978 3557957 ACon1_000630 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C3C(C)C(O)CC31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P15 compound treatment 529466.6667 -137000.0 -0.63 482830.1158 -178000.0 -0.95 -1.1147 -0.9804 3559851 ACon1_000631 COc1cc(O)c(C(=O)/C=C/c2ccc(OC)c(OC)c2)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P16 compound treatment 510698.7952 -155000.0 -0.72 513060.0707 -148000.0 -0.79 -1.0625 -0.9989 3554298 ACon1_000632 CCCCCCCCCC(O)CC(O)CC(O)CC1CC=CC(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P17 compound treatment 504996.1089 -161000.0 -0.74 477940.3974 -183000.0 -0.97 -1.2128 -0.9911 3559696 ACon1_000633 COc1cc2c(=O)c(coc2c3C=CC(C)(C)Oc13)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P18 compound treatment 465676.9231 -200000.0 -0.92 418198.5294 -243000.0 -1.29 -1.5651 -0.9866 3558198 ACon1_000634 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](OC(=O)/C=C/c6ccc(O)c(O)c6)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P19 compound treatment 543471.7742 -123000.0 -0.57 518522.0884 -143000.0 -0.76 -0.9352 -0.9896 3559409 ACon1_000635 CC(C)[C@@H]1CC[C@@]2(C)[C@H](O)CC[C@@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P20 compound treatment 550550.0 -115000.0 -0.53 560772.4359 -101000.0 -0.53 -0.7536 -1.0 3558052 ACon1_000636 COc1cc2ccc(=O)oc2c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P21 compound treatment 568749.2625 -97300.0 -0.45 479000.0 -182000.0 -0.97 -1.001 -0.939 1001932 ACon1_000637 CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P22 compound treatment 450250.0 -216000.0 -0.99 408063.1229 -253000.0 -1.34 -1.6534 -0.9891 3559888 ACon1_000638 Oc1ccc(c(O)c1)c2coc3cc(O)cc(O)c3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P23 compound treatment 507094.9367 -159000.0 -0.73 443043.0464 -218000.0 -1.16 -1.3369 -0.9757 3559630 ACon1_000639 CC(C)C(=O)OCC(=C)C1Oc2cc(ccc2C1OC(=O)C(C)C)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2291 P24 compound treatment 472852.5346 -193000.0 -0.89 488683.6364 -173000.0 -0.92 -1.2774 -0.9999 3558347 ACon1_000640 C[C@]1(CCC[C@]2(C)C1CC[C@]3(CC4CC[C@]32O)CC4=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A01 compound treatment 677860.5769 47700.0 0.22 548184.7826 -43400.0 -0.23 -0.0073 -0.0229 3558339 ACon1_000641 COC(=O)C1=C[C@@H](O)[C@@H](O)[C@@H](C1)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)/C=C/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A02 compound treatment 678477.3663 48300.0 0.22 493555.9441 -98000.0 -0.52 -0.2102 -0.3716 3558365 ACon1_000642 CC(=CCC/C(=C/C(C/C(=C/C(CC(C)(O)C=C)OC(=O)C)/C)OC(=O)C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A03 compound treatment 733648.6486 103000.0 0.48 545363.2959 -46200.0 -0.25 0.1641 0.3059 3558431 ACon1_000643 CC(=CCC(O)/C(=C/CCC(C)(OC1OC(CO)C(O)C(O)C1O)C=C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A04 compound treatment 669372.9508 39200.0 0.18 556171.9298 -35400.0 -0.19 -0.005 -0.0192 3559889 ACon1_000644 CCC(=O)OCC1=CCCC2C(C)(CCC(C)CC(=O)O)C(C)CCC21C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A05 compound treatment 644892.8571 14700.0 0.07 567487.4552 -24100.0 -0.13 -0.0424 -0.2932 3558559 ACon1_000645 COc1cc2ccc(=O)oc2cc1OCC(O)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A06 compound treatment 806181.8182 176000.0 0.81 604357.6159 12800.0 0.07 0.6218 0.7635 3558221 ACon1_000646 C[C@@H]1CC[C@]2(C)[C@H](CC[C@@H](O)[C@]2(C)O)[C@@]1(C)CC(=O)c3ccoc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A07 compound treatment 683671.8147 53500.0 0.25 478137.8205 -113000.0 -0.6 -0.251 -0.3861 3614399 ACon1_000647 COc1cc(O)cc2cc3C[C@](C)(O)CC(=O)c3c(O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A08 compound treatment 613883.5341 -16300.0 -0.08 504536.6667 -87000.0 -0.46 -0.3796 -0.8116 3559065 ACon1_000648 COc1cc2OC(C)(C)C=Cc2c3oc(cc(=O)c13)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A09 compound treatment 700024.1379 69800.0 0.32 529955.3265 -61600.0 -0.33 -0.0034 -0.0074 3557259 ACon1_000649 COc1c(C)c(oc(=O)c1C)[C@@]2(C)O[C@H]2/C(=C\C(=C\[C@@]3(C)O[C@@H](C)[C@]4(C)OC43)\C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A10 compound treatment 620742.8571 -9450.0 -0.04 495475.2066 -96100.0 -0.51 -0.3912 -0.7648 3559150 ACon1_000650 COc1ccc(cc1O)c2coc3cc(O)ccc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A11 compound treatment 754262.0968 124000.0 0.57 574158.7838 -17400.0 -0.09 0.3393 0.5854 3553959 ACon1_000651 CC1C2C(CC(C)(O)C3CC4OC4(C)C3(O)C2=O)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A12 compound treatment 716264.7059 86100.0 0.4 559619.863 -32000.0 -0.17 0.1608 0.3727 3614402 ACon1_000652 COc1ccc(cc1)C2Oc3cc(OC)ccc3CC2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A13 mock treatment 655223.2558 25000.0 0.12 522559.1398 -69000.0 -0.37 -0.1772 -0.4617 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A14 mock treatment 684985.4369 54800.0 0.25 488300.3802 -103000.0 -0.55 -0.2086 -0.3459 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A15 compound treatment 681707.113 51500.0 0.24 591099.6169 -471.0 0.0 0.1662 0.6996 3557496 ACon1_000653 CC(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)/C=C/[C@@]2(O)C(=CC(=O)CC2(C)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A16 compound treatment 781710.4072 152000.0 0.7 557705.5016 -33900.0 -0.18 0.3671 0.5088 3554158 ACon1_000654 CCC(C)C1NC(=O)c2c1n(C)c3ccccc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A17 compound treatment 733021.7391 103000.0 0.47 585535.2113 -6040.0 -0.03 0.3127 0.6579 3558190 ACon1_000655 C[C@H]1[C@@]2(O)[C@H](CC3C4CC=C5C[C@H](CC[C@]5(C)C4CC[C@@]32C)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)O[C@@]71CCC(C)CO7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A18 compound treatment 828047.0085 198000.0 0.91 586626.8116 -4940.0 -0.03 0.6266 0.6865 3554284 ACon1_000656 CCCCCCC1OC(=O)CCCC(O)/C=C\C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A19 compound treatment 819987.1795 190000.0 0.88 574723.127 -16800.0 -0.09 0.5557 0.6316 3551961 ACon1_000657 C/C(=C\C(=O)OC1C(=CC=C(C=O)C1(C)C)C)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A20 compound treatment 651588.2353 21400.0 0.1 497364.2612 -94200.0 -0.5 -0.2836 -0.5567 3558454 ACon1_000658 CC1CCC23CCC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C13C(=CC2(C)C)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A21 compound treatment 568267.7966 -61900.0 -0.29 541991.5966 -49600.0 -0.26 -0.3879 -0.9992 3558413 ACon1_000659 C[C@]1(O)CC[C@H]2[C@@H]1[C@H](O[C@@H]3O[C@H](COC(=O)/C=C/c4ccc(O)c(O)c4)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A22 compound treatment 554709.3596 -75500.0 -0.35 378039.3258 -214000.0 -1.13 -1.047 -0.8836 3553177 ACon1_000660 CC(=C)C(=O)O[C@H]1C[C@@]2(C)OC(=CC2=O)/C(=C\[C@H]3OC(=O)C(=C)C31)/COC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A23 compound treatment 575364.7059 -54800.0 -0.25 610183.0986 18600.0 0.1 -0.109 -0.4015 3558349 ACon1_000661 CCC(C)C(=O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1OC(=O)CC(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 A24 compound treatment 600408.9219 -29800.0 -0.14 640203.3333 48600.0 0.26 0.0853 0.2918 3559855 ACon1_000662 CC/C=C\C=C\C(O)C/C=C\CCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B01 compound treatment 695480.6202 65300.0 0.3 502096.99 -89500.0 -0.47 -0.1227 -0.2183 3558522 ACon1_000663 CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3C[C@H](O)[C@@](C)(O)[C@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B02 compound treatment 724543.5897 94300.0 0.44 598908.7452 7340.0 0.04 0.3352 0.7673 3558331 ACon1_000664 CC1OC(OC2C(O)C(O)COC2OC3CCC4(C)C(CCC5(C)C4CC=C6C7CC(C)(C)CCC7(CCC65C)C(=O)O)C3(C)CO)C(O)C(OC8OCC(OC(=O)C)C(OC(=O)C)C8O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B03 compound treatment 653566.1157 23400.0 0.11 615771.5356 24200.0 0.13 0.167 0.9962 3558658 ACon1_000665 C[C@@H]1C[C@H]2OC(=O)C(=C)[C@@H]2[C@H](OC(=O)C(=C)C)[C@@H](OC(=O)C(=C)C)[C@@](C)(O)C(=O)[C@H]3O[C@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B04 compound treatment 754507.9365 124000.0 0.57 646193.662 54600.0 0.29 0.6102 0.95 3557543 ACon1_000666 CC(OC1OC(CO)C(O)C(O)C1O)/C=C/C2(O)C(C)CC(O)CC2(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B05 compound treatment 719954.1667 89800.0 0.41 646659.7938 55100.0 0.29 0.4993 0.9855 3558677 ACon1_000667 C[C@@]1(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CCC[C@@]3(C)[C@H](CCC4=CCOC4=O)C(=C)CC[C@H]13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B06 compound treatment 656797.5207 26600.0 0.12 613745.9016 22200.0 0.12 0.1699 0.9998 3559891 ACon1_000668 CC(CO[C@@H]1O[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](O)[C@H](O)[C@H]1O)C3(O)COC(=O)C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B07 compound treatment 682769.2308 52600.0 0.24 575566.8016 -16000.0 -0.08 0.1114 0.4337 3558735 ACon1_000669 CC1CCC2(C)C(CCC=C2C(=O)O)C1(C)CCC3=CC(=O)OC3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B08 compound treatment 735245.7627 105000.0 0.48 529275.2613 -62300.0 -0.33 0.1089 0.1858 3557836 ACon1_000670 COc1cc(/C=C/C(=O)O[C@@H]2[C@@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)O[C@@H](OCCc4ccc(O)c(O)c4)[C@H](O)[C@H]2O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B09 compound treatment 767874.4939 138000.0 0.63 587131.6872 -4440.0 -0.02 0.4323 0.6804 3558686 ACon1_000671 COc1cc(/C=C/C(=O)O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2OC(=O)\C=C\c4cc(OC)c(O)c(OC)c4)cc(OC)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B10 compound treatment 847311.3208 217000.0 1.0 603860.5442 12300.0 0.07 0.7541 0.7516 1417265 ACon1_000672 OC1CCn2c1nc3ccccc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B11 compound treatment 55490.566 -575000.0 -2.65 58693.8775 -533000.0 -2.83 -3.8726 -0.9995 3557345 ACon1_000673 CC(=O)c1c(O)cc(O)c(C(=O)C)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B12 compound treatment 716096.0699 85900.0 0.4 669685.7143 78100.0 0.41 0.5731 0.9997 3558110 ACon1_000674 COc1cc(/C=C/c2ccccc2)cc(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B13 mock treatment 753497.6303 123000.0 0.57 569384.2975 -22200.0 -0.12 0.3189 0.5491 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B14 mock treatment 837817.3077 208000.0 0.96 635771.4286 44200.0 0.23 0.8428 0.855 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B15 compound treatment 707916.6667 77700.0 0.36 563474.8201 -28100.0 -0.15 0.1481 0.3815 3559744 ACon1_000675 CC(CCO)CC[C@@H]1C(=C)CC[C@@H]2[C@@](C)(CCC[C@@]12C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B16 compound treatment 761283.0189 131000.0 0.6 555506.6225 -36100.0 -0.19 0.2922 0.4609 3553396 ACon1_000676 CC(=O)OCC1(C)CC2[C@]3(CO[C@]42CCC5[C@@]6(C)CC[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@@](C)(CO)C6CC[C@@]5(C)[C@]4(C)C[C@H]3O)[C@@H](O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B17 compound treatment 718750.0 88600.0 0.41 520813.1868 -70800.0 -0.38 0.0234 0.0422 3489715 ACon1_000677 CC1CCC2(CCC3(C(=O)O)C(=CCC4C5(C)CCC(OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1C)C(=O)OC7OC(CO)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B18 compound treatment 664617.0213 34400.0 0.16 680675.7679 89100.0 0.47 0.4464 0.8954 3557359 ACon1_000678 CC(C)[C@@H]1NC(=O)[C@@H](Cc2c[nH]c3ccccc23)n4c1nc5ccccc5c4=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B19 compound treatment 988173.5537 358000.0 1.65 1016787.879 425000.0 2.26 2.7621 0.9882 3558569 ACon1_000679 CC1=C(CCC2=CC(O)OC2=O)[C@@]3(C)CCC[C@@]4(C)[C@@H]3C(OC4=O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B20 compound treatment 630331.9672 137.0 0.0 553145.3287 -38400.0 -0.2 -0.1437 -0.7049 3557575 ACon1_000680 OCCc1ccc(O)c(OC2OC(CO)C(O)C(O)C2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B21 compound treatment 580285.7143 -49900.0 -0.23 577801.7241 -13800.0 -0.07 -0.2144 -0.8878 3557374 ACon1_000681 C/C=C/C=C/C1C=CC2CC(C)CCC2C1(C)\C(=C/3\C(=O)NC(C(C)O)C3=O)\O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B22 compound treatment 534472.2222 -95700.0 -0.44 532902.6846 -58700.0 -0.31 -0.5322 -0.9853 3558646 ACon1_000682 CC(C)(O)CCC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(CC(O)C(OC5OC(CO)C(O)C(O)C5O)C4(C)C)C3(C)C(=O)CC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B23 compound treatment 584686.0068 -45500.0 -0.21 476445.2055 -115000.0 -0.61 -0.5802 -0.8985 3558270 ACon1_000683 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCCc3ccc(O)c(O)c3)[C@H](O)[C@@H](O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H]2OC(=O)/C=C/c5ccc(O)c(O)c5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 B24 compound treatment 548155.303 -82000.0 -0.38 513233.6449 -78300.0 -0.42 -0.5613 -0.9989 3558889 ACon1_000684 C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C5[C@@H]6CC(C)(C)CC[C@@]6(CC[C@]54C(=O)O)C(=O)OC7OC(CO)C(O)C(O)C7O)C2(C)C)[C@H](O)[C@@H](O)[C@@H]1OC8OC(CO)C(O)C(O)C8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C01 compound treatment 626913.4615 -3280.0 -0.02 532157.8947 -59400.0 -0.32 -0.2335 -0.7402 3558360 ACon1_000685 COC(=O)[C@]1(C)CC[C@H](OC(=O)C)[C@@]2(C)C1C[C@@H](OC(=O)C)C3=C2CC[C@](C)(C=C)[C@@H]3OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C02 compound treatment 782181.1024 152000.0 0.7 555413.5593 -36200.0 -0.19 0.36 0.4954 3558319 ACon1_000686 C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)C4CC[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CCC3=C2)c6ccc(=O)oc6)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C03 compound treatment 678091.6667 47900.0 0.22 510777.027 -80800.0 -0.43 -0.1468 -0.3046 3558457 ACon1_000687 CC(CC[C@@]1(C)[C@H](C)CC[C@]2(C)C1CCC=C2CO)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C04 compound treatment 840082.7068 210000.0 0.97 712638.8889 121000.0 0.64 1.1385 0.9801 3553465 ACon1_000688 CC(C)(O)[C@@H]1CC[C@]2(CO)[C@@H](O)CC[C@](C)(O)[C@H]2[C@@H]1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C05 compound treatment 772377.193 142000.0 0.66 671830.5785 80300.0 0.43 0.7647 0.9781 3558579 ACon1_000689 COc1cc2OC(CC(=O)c2c(O)c1OC)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C06 compound treatment 701328.2443 71100.0 0.33 608813.9535 17200.0 0.09 0.2966 0.871 3554662 ACon1_000690 COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(=C1c3ccc(O)cc3)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C07 compound treatment 665663.1579 35500.0 0.16 654532.4232 63000.0 0.33 0.3518 0.9461 3558617 ACon1_000691 COC(=O)C1=COC(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C)/C1CC(=O)OCCc4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C08 compound treatment 706558.8235 76400.0 0.35 555491.4089 -36100.0 -0.19 0.1137 0.2837 3559200 ACon1_000692 COc1cc2occ(c3ccc4OCOc4c3)c(=O)c2c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C09 compound treatment 723515.873 93300.0 0.43 605553.8462 14000.0 0.07 0.3568 0.8169 3554819 ACon1_000693 COc1cc(=O)oc(/C(=C/C(=C/C(=C/C2(C)OC(C)C3(C)OC32)/C)/C)/C)c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C10 compound treatment 319962.0253 -310000.0 -1.43 122581.3953 -469000.0 -2.49 -2.7706 -0.9655 3558246 ACon1_000694 CC(C)C(=O)c1c(O)cc2OC(C)(C)C(CC=C(C)C)Cc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C11 mock treatment 679596.7078 49400.0 0.23 626081.7121 34500.0 0.18 0.2905 0.9941 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C12 mock treatment 719213.3333 89000.0 0.41 596076.0456 4510.0 0.02 0.3072 0.747 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C13 compound treatment 728636.7713 98400.0 0.45 548894.3396 -42700.0 -0.23 0.161 0.3173 3558047 ACon1_000695 COc1cc(CCO)ccc1O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C14 compound treatment 763937.2549 134000.0 0.62 637838.7097 46300.0 0.25 0.6097 0.9184 3614417 ACon1_000696 COC1CC(OC(O)C(O)C(O)C(O)C(O)CO)c2c(O)c3c(=O)oc(C)cc3cc2OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C15 mock treatment 728724.0 98500.0 0.45 545057.7617 -46500.0 -0.25 0.1469 0.284 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C16 mock treatment 675995.614 45800.0 0.21 698890.625 107000.0 0.57 0.5519 0.9089 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C17 compound treatment 695622.7106 65400.0 0.3 626722.6277 35200.0 0.19 0.3452 0.9732 3558236 ACon1_000697 CC(C)C1(CC12)C(=O)CC2(C)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C18 compound treatment 388030.0 -242000.0 -1.12 125460.0 -466000.0 -2.47 -2.5378 -0.9355 3557265 ACon1_000698 CC(=CCC/C(=C/CC/C(=C/Cc1c(C)cc(O)cc1O)/C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C19 compound treatment 523142.8571 -107000.0 -0.49 528105.042 -63500.0 -0.34 -0.5871 -0.9826 3558297 ACon1_000699 CC(C)c1cc2CCC3C(C)(C)CCC[C@]3(C(=O)O)c2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C20 compound treatment 590023.2558 -40200.0 -0.19 540456.3107 -51100.0 -0.27 -0.3227 -0.9828 3558260 ACon1_000700 CC(C)C(O)(C(C)O)C(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C21 compound treatment 218301.3699 -412000.0 -1.9 74785.7143 -517000.0 -2.74 -3.2813 -0.984 3558324 ACon1_000701 CC(C)c1cc2CC[C@H]3C(C)(C)CCC[C@]3(C)c2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C22 compound treatment 672193.133 42000.0 0.19 593166.065 1600.0 0.01 0.1429 0.7373 3558258 ACon1_000702 C[C@H](O)C1=CC2(CC[C@H]3[C@@H]2[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)OC=C3C(=O)O)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C23 compound treatment 561331.8777 -68900.0 -0.32 464819.6721 -127000.0 -0.67 -0.6999 -0.9414 3555893 ACon1_000703 OC[C@H]1O[C@@H](Oc2cc(C(=O)O)c(O)c3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 C24 compound treatment 647227.758 17000.0 0.08 536943.038 -54600.0 -0.29 -0.1493 -0.4975 3557293 ACon1_000704 COC(=O)c1cccc2oc3cc(CO)cc(O)c3c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D01 compound treatment 597126.7606 -33100.0 -0.15 693656.3707 102000.0 0.54 0.275 0.4889 3557722 ACon1_000705 COc1ccc2ccc(=O)oc2c1CC(O)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D02 compound treatment 785292.0792 155000.0 0.72 690703.8462 99100.0 0.53 0.8776 0.9885 3553508 ACon1_000706 CC(C)C(=O)O[C@@H]1[C@@H](OC(=O)C)[C@@H](OC(=O)C)C(C)(C)/C=C/[C@@](C)(O)C(=O)[C@@]2(O)[C@H](OC(=O)C)[C@@](C)(OC(=O)C)[C@H](OC(=O)C)[C@@H]2[C@H]3OC(=O)CC[C@]31OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D03 compound treatment 570846.8468 -59300.0 -0.27 554903.8462 -36700.0 -0.19 -0.331 -0.986 3558643 ACon1_000707 COc1cc(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)c4c(cc(=O)oc4c1)c5ccc(O)c(O)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D04 compound treatment 837609.7561 207000.0 0.96 672126.0504 80600.0 0.43 0.9785 0.934 1279467 ACon1_000708 COC(=O)C(Cc1ccccc1)NC(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D05 compound treatment 812926.9406 183000.0 0.84 571501.7544 -20100.0 -0.11 0.5206 0.6129 3614423 ACon1_000709 COC(=O)C1=CC=CC(CC(O)C(=O)O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D06 compound treatment 675180.0766 45000.0 0.21 592588.9328 1020.0 0.01 0.1505 0.7253 3558535 ACon1_000710 C[C@@H]1O[C@@H](O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C5C6CC(C)(C)CC[C@@]6(CC[C@]54C(=O)O)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)C2(C)C)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D07 compound treatment 751420.4082 121000.0 0.56 758844.358 167000.0 0.89 1.0227 0.9752 3614426 ACon1_000711 CC1CC(=O)C2=C(O1)OC3(C)CCC4(O)C(C)(C)C5OC5C(=O)C4(C)C3C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D08 compound treatment 777768.7861 148000.0 0.68 582244.186 -9330.0 -0.05 0.4462 0.654 3554252 ACon1_000712 CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)COP(=O)(O)OCC[N+](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D09 compound treatment 813175.8242 183000.0 0.84 565697.5945 -25900.0 -0.14 0.4997 0.5844 3558720 ACon1_000713 COc1cc(/C=C/c2cc(O)cc(O)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D10 compound treatment 723991.8699 93800.0 0.43 547749.1039 -43800.0 -0.23 0.1415 0.2882 3554771 ACon1_000714 COc1c(O)ccc2C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c4cc(C)cc(O)c4C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D11 mock treatment 643236.2869 13000.0 0.06 657733.5907 66200.0 0.35 0.2907 0.8164 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D12 mock treatment 639420.0743 9230.0 0.04 630775.4237 39200.0 0.21 0.1771 0.8345 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D13 compound treatment 576967.2131 -53200.0 -0.25 579844.5946 -11700.0 -0.06 -0.2175 -0.8591 3614428 ACon1_000715 COC(=O)c1c(C)cc2CC3(Oc2c(C)c1=O)C(C)CCC(C(C)(C)O)C3(C)CCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D14 compound treatment 618698.1132 -11500.0 -0.05 671238.255 79700.0 0.42 0.2613 0.6136 3553648 ACon1_000716 CC(C)CC1NC(=O)C2CCCN2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D15 mock treatment 668343.75 38100.0 0.18 645316.5468 53700.0 0.29 0.326 0.9731 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D16 mock treatment 610610.6557 -19600.0 -0.09 681887.5 90300.0 0.48 0.2749 0.5639 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D17 compound treatment 661375.9124 31200.0 0.14 712123.5955 121000.0 0.64 0.5538 0.845 3558202 ACon1_000717 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)/C=C/c6ccccc6)[C@H](OC(=O)C)[C@H]1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D18 compound treatment 582362.8692 -47800.0 -0.22 609575.0 18000.0 0.1 -0.0885 -0.368 3558526 ACon1_000718 COc1ccc2ccc(=O)oc2c1CC(O)C(C)(C)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D19 compound treatment 606377.709 -23800.0 -0.11 661455.7377 69900.0 0.37 0.1844 0.4771 3614429 ACon1_000719 COc1cccc2oc3OC=C(CO)C=C(C(=O)O)c3c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D20 compound treatment 523310.9541 -107000.0 -0.49 508157.3427 -83400.0 -0.44 -0.6614 -0.9985 3558603 ACon1_000720 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@]43C)C2C1)C(=O)O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D21 compound treatment 522474.026 -108000.0 -0.5 650379.4326 58800.0 0.31 -0.1307 -0.2228 3614430 ACon1_000721 C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@](C)(C23)[C@@]1(O)CCC4=CC(=O)OC4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D22 compound treatment 619496.3768 -10700.0 -0.05 619885.2459 28300.0 0.15 0.0713 0.4511 3558751 ACon1_000722 COc1ccc(cc1OC)[C@@H]2O[C@H]([C@@H](C)[C@@H]2C)c3ccc(OC)c(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D23 compound treatment 546049.6689 -84100.0 -0.39 501152.1036 -90400.0 -0.48 -0.6135 -0.9945 3554692 ACon1_000723 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C)/C1CC(=O)OC[C@H]3O[C@@H](OCCc4ccc(O)cc4)[C@H](OC(=O)CC5\C(=C\C)\C(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)OC=C5C(=O)OC)[C@@H](O)[C@@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 D24 compound treatment 573091.2548 -57100.0 -0.26 460188.3117 -131000.0 -0.7 -0.679 -0.9114 3554061 ACon1_000724 CC1CCC/C=C/C(=O)c2c(O)cc(O)cc2CC(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E01 mock treatment 588960.0 -41200.0 -0.19 555693.617 -35900.0 -0.19 -0.269 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E02 mock treatment 740541.8719 110000.0 0.51 520491.0394 -71100.0 -0.38 0.0933 0.1472 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E03 compound treatment 537347.2222 -92800.0 -0.43 527981.4126 -63600.0 -0.34 -0.5413 -0.993 3558404 ACon1_000725 CC(C)c1ccc2c(CCC3[C@@](C)(CCC[C@@]32C)C(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E04 compound treatment 671901.3453 41700.0 0.19 559911.1111 -31700.0 -0.17 0.0173 0.0676 3558499 ACon1_000726 OCC1OC(Oc2ccc(/C=C/C(=O)OC3COC(OCC4OC(OC(C#N)c5ccccc5)C(O)C(O)C4O)C(O)C3O)cc2)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E05 compound treatment 777909.4828 148000.0 0.68 665537.3665 74000.0 0.39 0.7591 0.9656 3558134 ACon1_000727 Cc1c(O)cc2OC(CC(=O)c2c1O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E06 compound treatment 695101.2146 64900.0 0.3 731298.0392 140000.0 0.74 0.7357 0.9205 2082654 ACon1_000728 COc1ccc(cc1OC)c2oc3c(OC)c(OC)c(OC)c(O)c3c(=O)c2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E07 compound treatment 550302.4194 -79900.0 -0.37 586193.6759 -5380.0 -0.03 -0.2807 -0.7596 3557964 ACon1_000729 CC(=O)OC1C(O)C(O)C(CO)OC1Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E08 compound treatment 557054.3478 -73100.0 -0.34 556915.2542 -34700.0 -0.18 -0.3685 -0.9593 3614436 ACon1_000730 COc1ccc(cc1)c2coc3c(CC=C(C)C)c(O)c(OC)cc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E09 mock treatment 743758.8933 114000.0 0.52 634742.616 43200.0 0.23 0.5322 0.9312 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E10 mock treatment 785832.5991 156000.0 0.72 574055.0847 -17500.0 -0.09 0.4418 0.6105 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E11 compound treatment 573012.987 -57200.0 -0.26 465236.7347 -126000.0 -0.67 -0.6603 -0.9169 1102884 ACon1_000731 Cc1cc(O)c(O)c(Oc2cc(C)cc(O)c2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E12 compound treatment 551257.5107 -78900.0 -0.36 583417.2932 -8150.0 -0.04 -0.288 -0.7856 3614439 ACon1_000732 Cc1cc(O)c(C)c2OC(=O)c3c(C)cc(O)c(C)c3Oc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E13 compound treatment 729504.2017 99300.0 0.46 528686.5672 -62900.0 -0.33 0.088 0.1553 3558045 ACon1_000733 O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)/C=C/c2ccccc2)[C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E14 compound treatment 688144.4867 57900.0 0.27 680630.597 89100.0 0.47 0.523 0.9636 3557896 ACon1_000734 CC1OC(OCC2OC(Oc3cc(O)c4c(=O)c(coc4c3)c5ccc(O)cc5)C(O)C(O)C2O)C(O)C(O)C1OC6OC(CO)C(O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E15 compound treatment 721471.4829 91300.0 0.42 590057.1429 -1510.0 -0.01 0.292 0.6935 3555889 ACon1_000735 OC[C@H]1O[C@@H](OC/C/2=C\[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](O)C/C(=C\CC2)/C=O)[C@H](OC(=O)Cc4ccc(O)cc4)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E16 compound treatment 802573.913 172000.0 0.79 674410.1695 82800.0 0.44 0.8728 0.9609 3557786 ACon1_000736 CC1(C)[C@@H](O)C(=O)C[C@@]2(C)C1CC[C@@]3(C)O[C@](C)(CCC32)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E17 mock treatment 673310.5023 43100.0 0.2 579801.444 -11800.0 -0.06 0.0965 0.4628 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E18 mock treatment 761767.9325 132000.0 0.61 651290.566 59700.0 0.32 0.653 0.9541 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E19 compound treatment 774871.9008 145000.0 0.67 618431.3725 26900.0 0.14 0.5725 0.8392 3558389 ACon1_000737 CC(C)C1CC=C(C)C(O)CCC(=C)CC1OC2OC(COC(=O)C)C(O)C(O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E20 compound treatment 655447.8764 25300.0 0.12 623016.0643 31400.0 0.17 0.2003 0.9846 3558256 ACon1_000738 OC[C@H]1O[C@@H](Oc2ccc(/C=C/C(=O)O)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E21 compound treatment 636685.8238 6490.0 0.03 623242.7536 31700.0 0.17 0.14 0.8202 3558369 ACon1_000739 C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@](C)(C23)[C@@]1(O)CCc4ccoc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E22 compound treatment 482944.0299 -147000.0 -0.68 582131.5789 -9440.0 -0.05 -0.5156 -0.7572 3558332 ACon1_000740 Oc1ccc(cc1O)C2OC[C@@H]3[C@H](OC[C@H]23)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E23 compound treatment 642107.2961 11900.0 0.05 693192.5926 102000.0 0.54 0.42 0.7752 3558345 ACon1_000741 COc1ccc(/C=C/C(=O)O[C@H]2[C@H](C)O[C@@H](O[C@@H]3[C@@H]4O[C@]4(CO)[C@@H]5[C@H]3C=CO[C@H]5O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](OC(=O)C)[C@@H]2OC(=O)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 E24 compound treatment 492272.3577 -138000.0 -0.64 508578.7546 -83000.0 -0.44 -0.761 -0.9838 3557578 ACon1_000742 OCC1OC(C(O)C(O)C1O)c2c(O)cc3oc(cc(=O)c3c2O)c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F01 mock treatment 797500.0 167000.0 0.77 567022.0588 -24500.0 -0.13 0.4535 0.5796 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F02 mock treatment 706492.7536 76300.0 0.35 623477.1784 31900.0 0.17 0.3685 0.9437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F03 compound treatment 694111.6071 63900.0 0.29 578769.5652 -12800.0 -0.07 0.1604 0.5303 3558651 ACon1_000743 C[C@@H]1C[C@@H](O)C2[C@@](C)(CO)CCC[C@]2(C)[C@@]1(O)CCc3ccoc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F04 compound treatment 815123.9669 185000.0 0.85 734757.1429 143000.0 0.76 1.1401 0.9983 3614448 ACon1_000744 COC(CC(OC)c1c(O)cc2cc(C)oc(=O)c2c1O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F05 compound treatment 633429.4118 3230.0 0.01 688560.0 97000.0 0.51 0.3743 0.7273 3552924 ACon1_000745 C[C@H](CCC(=C)[C@@H](C)C(=O)O)[C@H]1CCC2(C)C3=C(C[C@H](O)[C@]12C)[C@@]4(C)CC[C@@H](OC(=O)CC(=O)O)C(C)(C)C4CC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F06 compound treatment 724429.1667 94200.0 0.43 738956.5217 147000.0 0.78 0.8601 0.9616 3554676 ACon1_000746 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C)/[C@@H]1CC(=O)OCCc3ccc(OC(=O)C[C@H]4\C(=C/C)\[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)OC=C4C(=O)OC)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F07 compound treatment 630652.9412 458.0 0.0 536641.5929 -54900.0 -0.29 -0.2045 -0.702 3554523 ACon1_000747 COC(=O)/C/1=C/CC[C@@]2(C)O[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](OC(=O)\C(=C/C)\C)C1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F08 compound treatment 706198.6532 76000.0 0.35 597648.2759 6080.0 0.03 0.2706 0.7689 3558636 ACon1_000748 CC(O)CCC1=CC[C@H]2OC(=O)C(=C)[C@@H]2CC1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F09 mock treatment 680543.4783 50300.0 0.23 723670.6349 132000.0 0.7 0.6596 0.8936 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F10 mock treatment 624836.9099 -5360.0 -0.02 628758.7413 37200.0 0.2 0.122 0.6137 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F11 compound treatment 688762.5899 58600.0 0.27 744171.9298 153000.0 0.81 0.7633 0.8946 3558527 ACon1_000749 COc1ccc2ccc(=O)oc2c1C(OC(=O)C)C(=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F12 compound treatment 663325.1029 33100.0 0.15 614617.3285 23000.0 0.12 0.1945 0.9939 3558182 ACon1_000750 C/C=C(\C)/C(=O)O[C@H]1[C@H](OC(=O)C)[C@]2(CO)[C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H]6O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)C(=O)O)C(C)(C)C5CC[C@]43C)C2CC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F13 compound treatment 780955.6452 151000.0 0.7 727537.1025 136000.0 0.72 1.0016 0.9998 3559736 ACon1_000751 CC(C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@H]3[C@@H](OC(=O)C=C(C)C)[C@H](O)C[C@H](C)[C@@]13C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F14 compound treatment 663370.9677 33200.0 0.15 651000.0 59400.0 0.32 0.3311 0.9449 3553501 ACon1_000752 CC(C)[C@]1(O)CC2=CC[C@H](OC1=O)/C(=C\[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](C2)OC(=O)/C(=C/CO)/CO)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F15 compound treatment 649698.5816 19500.0 0.09 595900.6849 4330.0 0.02 0.0798 0.8601 3559723 ACon1_000753 C/C(=C\CO)/C(=O)O[C@@H]1C\C(=C\CC[C@@]2(CO)OC2[C@H]3OC(=O)C(=C)C31)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F16 compound treatment 728780.0 98600.0 0.45 645118.1818 53500.0 0.28 0.5223 0.9743 3558093 ACon1_000754 COC1CC(O[C@H]2CC[C@]3(C)C4[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@]5(C)[C@H](CC[C@]5(O)C4CC=C3C2)C(=O)C)OC(C)C1OC6CC(OC)C(OC7CC(OC)C(OC8OC(C)C(OC9OC(CO)C(O)C(O)C9O)C(OC)C8O)C(C)O7)C(C)O6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F17 mock treatment 522976.834 -107000.0 -0.49 613189.5161 21600.0 0.11 -0.2685 -0.5291 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F18 mock treatment 698606.8702 68400.0 0.32 710366.2551 119000.0 0.63 0.6686 0.9489 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F19 compound treatment 715687.9433 85500.0 0.39 641500.0 49900.0 0.26 0.466 0.9813 3554275 ACon1_000755 CCCCCC1=C(O)/C(=C/C(=O)O)/OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F20 compound treatment 617782.7869 -12400.0 -0.06 678709.9237 87100.0 0.46 0.2863 0.6148 3558634 ACon1_000756 CCC(C)(O)CC(=O)O[C@H]/1C[C@@H]2[C@H](OC(=O)C2=C)[C@@H]3O[C@]3(C)CC\C=C1/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F21 compound treatment 542061.6438 -88100.0 -0.41 630667.8201 39100.0 0.21 -0.1408 -0.3085 3614460 ACon1_000757 CCC(C)/C=C(\C)/C=C/C1=CC2=C(Cl)C(=O)C(C)(OC(=O)C)C(=O)C2=CN1CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F22 compound treatment 582396.3636 -47800.0 -0.22 599987.8049 8420.0 0.04 -0.1243 -0.5527 3555003 ACon1_000758 COc1cc(oc(=O)c1)c2c(C)cc(O)cc2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F23 compound treatment 548803.7383 -81400.0 -0.38 582554.8173 -9020.0 -0.05 -0.2992 -0.7908 3557852 ACon1_000759 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@](C)(C5CC[C@]43C)C(=O)O)C2[C@]1(C)O)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 F24 compound treatment 538612.9032 -91600.0 -0.42 480508.5911 -111000.0 -0.59 -0.7152 -0.9867 3558059 ACon1_000760 COc1ccc(cc1)C2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO)[C@@H](OC5OCC(O)(CO)C5O)[C@H](O)[C@H]4O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G01 compound treatment 584112.5541 -46100.0 -0.21 478764.4928 -113000.0 -0.6 -0.5733 -0.903 3558424 ACon1_000761 COc1ccc(cc1)c2coc3c(OC)c(OC)cc(OC4OC(CO)C(O)C(O)C4OC5OCC(O)C(O)C5O)c3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G02 compound treatment 626171.9457 -4020.0 -0.02 548164.0625 -43400.0 -0.23 -0.1759 -0.7616 3558440 ACon1_000762 C[C@H]1[C@H]2[C@H](OC1=O)[C@@H](C(=C)CO)[C@@](C)(C[C@@H]2O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G03 mock treatment 651495.7265 21300.0 0.1 494119.0476 -97500.0 -0.52 -0.296 -0.5627 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G04 mock treatment 650184.5018 20000.0 0.09 528116.1049 -63500.0 -0.34 -0.1728 -0.4952 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G05 compound treatment 567383.9662 -62800.0 -0.29 512050.3597 -79500.0 -0.42 -0.5031 -0.9832 3552674 ACon1_000763 C[C@@H]1CC(=O)[C@]2(COC(=O)C)[C@H](CC[C@H](O)[C@@]32CO3)[C@]41C[C@H](OC4=O)c5ccoc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G06 compound treatment 630492.6471 298.0 0.0 555887.6404 -35700.0 -0.19 -0.1329 -0.702 3557361 ACon1_000764 COc1cc(OC)c2c(=O)oc(CC(O)CC(=O)C)cc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G07 compound treatment 664779.0698 34600.0 0.16 526580.5369 -65000.0 -0.34 -0.131 -0.3448 1080935 ACon1_000765 Cc1c(O)cc2OC(CC(=O)c2c1O)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G08 compound treatment 507912.0879 -122000.0 -0.56 457289.2857 -134000.0 -0.71 -0.9024 -0.9933 3614466 ACon1_000766 COc1cc(O)c-2c(CCc3cc(OC)c(OC)cc32)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G09 compound treatment 555274.1313 -74900.0 -0.35 480953.6424 -111000.0 -0.59 -0.6592 -0.9681 3557989 ACon1_000767 CC(C)(O)C1Oc2cc3occ(c4ccc(O)cc4)c(=O)c3c(O)c2C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G10 compound treatment 548992.4812 -81200.0 -0.37 510531.0345 -81000.0 -0.43 -0.5687 -0.9976 3559169 ACon1_000768 COc1ccc(cc1)C(O)CNC(=O)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G11 compound treatment 506449.1228 -124000.0 -0.57 559503.3113 -32100.0 -0.17 -0.5238 -0.8796 3558069 ACon1_000769 CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)C)[C@H]3CCC(CO)[C@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G12 compound treatment 612357.9336 -17800.0 -0.08 578558.8235 -13000.0 -0.07 -0.107 -0.9962 3555309 ACon1_000770 COc1cccc2C(=O)OC(c21)c3ccc4C(O)C(C)CC(=O)c4c3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G13 compound treatment 555650.3759 -74500.0 -0.34 557000.0 -34600.0 -0.18 -0.3727 -0.9567 3558151 ACon1_000771 OC[C@H]1O[C@@H](OC/C/2=C\[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](O)C/C(=C\CC2)/C=O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G14 compound treatment 514986.6667 -115000.0 -0.53 520805.7554 -70800.0 -0.38 -0.6411 -0.9855 3557929 ACon1_000772 C[C@@]12C[C@@H](O)[C@@H]3C[C@@]2(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@]3(COC(=O)c5ccccc5)C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G15 compound treatment 537728.1879 -92500.0 -0.43 533801.3245 -57800.0 -0.31 -0.5182 -0.9869 3558123 ACon1_000773 COc1ccc(/C=C/C(=O)O[C@]2(C)CCC3[C@@H]2[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)OC=C3C(=O)O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G16 compound treatment 544802.974 -85400.0 -0.39 554579.5455 -37000.0 -0.2 -0.4172 -0.9482 3557915 ACon1_000774 COc1c(OC2OC(CO)C(O)C(O)C2O)ccc(O)c1C(=O)OCc3ccccc3O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G17 compound treatment 502719.6653 -127000.0 -0.59 580734.2657 -10800.0 -0.06 -0.4563 -0.7726 3614471 ACon1_000775 COc1cc(/C=C/C(=O)NCC(O)c2ccc(O)cc2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G18 compound treatment 498953.9474 -131000.0 -0.61 485639.4052 -106000.0 -0.56 -0.8253 -0.9993 3558265 ACon1_000776 COc1ccc(cc1)[C@H]2Oc3cc(O)cc(O)c3C(=O)[C@@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G19 mock treatment 545382.0225 -84800.0 -0.39 535757.9365 -55800.0 -0.3 -0.4859 -0.9906 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G20 mock treatment 496475.2066 -134000.0 -0.62 465209.3023 -126000.0 -0.67 -0.91 -0.9991 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G21 compound treatment 477456.1404 -153000.0 -0.7 486408.1633 -105000.0 -0.56 -0.8925 -0.9933 3558300 ACon1_000777 CC(CO)C(=O)O[C@H]1C[C@@]2(C)[C@H](O)CCC(=O)[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G22 compound treatment 555297.1014 -74900.0 -0.35 498712.2807 -92900.0 -0.49 -0.5925 -0.9849 1047948 ACon1_000778 COc1cc(cc(OC)c1OC)C2OCC3C(OCC23)c4cc(OC)c(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G23 compound treatment 575802.6316 -54400.0 -0.25 442670.2509 -149000.0 -0.79 -0.7358 -0.888 3558322 ACon1_000779 CC(C)c1cc2C(O)C[C@H]3C(C)(C)CCC[C@]3(C)c2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 G24 compound treatment 521951.6129 -108000.0 -0.5 499585.2843 -92000.0 -0.49 -0.698 -0.9999 3558519 ACon1_000780 OCC1C(O)CC2C1C(=O)OCC2=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H01 compound treatment 663965.0 33800.0 0.16 682654.1353 91100.0 0.48 0.4517 0.89 3614474 ACon1_000781 COc1c2C(=O)OCc2c(C)c3OC4(C)CC(O)C5(O)C(C)(CCC(=O)OC5(C)C)C4Cc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H02 compound treatment 834913.5135 205000.0 0.94 653764.4444 62200.0 0.33 0.9008 0.9008 3558708 ACon1_000782 C[C@@H]/1C[C@H]2OC(=O)C(=C)[C@@H]2[C@H](OC(=O)C(=C)C)[C@@H](OC(=O)C(=C)C)[C@@](C)(O)C(=O)/C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H03 mock treatment 602175.0 -28000.0 -0.13 582982.6087 -8590.0 -0.05 -0.1236 -0.902 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H04 mock treatment 671850.4673 41700.0 0.19 662066.4063 70500.0 0.37 0.4002 0.9521 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H05 compound treatment 637490.1186 7300.0 0.03 636713.1783 45100.0 0.24 0.1931 0.7986 3552202 ACon1_000783 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H](CC(O)C3=CCOC3=O)C(=C)CC[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H06 compound treatment 666314.2857 36100.0 0.17 595012.4481 3440.0 0.02 0.1307 0.7799 3558285 ACon1_000784 C[C@H]1[C@H]2[C@H](CC3C4C[C@@H](O)[C@H]5C[C@@H](O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H]6O)[C@H](O)C[C@]5(C)C4CC[C@]23C)O[C@@]%101CCC(C)CO%10 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H07 compound treatment 580661.71 -49500.0 -0.23 539417.6245 -52200.0 -0.28 -0.3571 -0.9955 3558479 ACon1_000785 C[C@@]1(CCC2=C(C1)C(=O)CC3[C@@](C)(CCC[C@@]32C)C(=O)O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H08 compound treatment 573975.5102 -56200.0 -0.26 583588.6792 -7980.0 -0.04 -0.2133 -0.8118 3553528 ACon1_000786 CC(C)C(=O)OC/C(=C/CCC(=C)C1CC=C(CO)C(C1)OC(=O)C(C)C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H09 compound treatment 589530.4054 -40700.0 -0.19 589929.8893 -1640.0 -0.01 -0.1388 -0.7391 3558737 ACon1_000787 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4C(=O)CC(Oc4c3)c5ccc(O)cc5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H10 compound treatment 633665.3226 3470.0 0.02 678250.0 86700.0 0.46 0.3364 0.7313 3559235 ACon1_000788 CC1OC(O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C5C6CC(C)(C)CC[C@@]6(CC[C@]54C)C(=O)OC7OC(CO)C(OC8OC(CO)C(O)C(O)C8O)C(O)C7O)C2(C)C)C(O)C(O)C1OC9OCC(O)(COC%10OCC(O)C(OC%11OCC(OC%12OCC(O)(CO)C%12O)C(O)C%11O)C%10O)C9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H11 compound treatment 564008.4746 -66200.0 -0.31 630007.0671 38400.0 0.2 -0.0717 -0.1953 3557942 ACon1_000789 CC1CCC2(C)C(CC(=O)C=C2C)C1(C)CC/C(=C\C(=O)O)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H12 compound treatment 579469.1781 -50700.0 -0.23 586087.2727 -5480.0 -0.03 -0.186 -0.7889 3552656 ACon1_000790 C[C@@H]1C[C@H](OC(=O)C)[C@H](OC(=O)C)[C@@]2(COC(=O)C)[C@H](OC(=O)C)[C@H](OC(=O)c3ccccc3)[C@@H]4[C@@H](OC(=O)C)[C@]12OC4(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H13 compound treatment 518143.4109 -112000.0 -0.52 526417.3913 -65200.0 -0.35 -0.6097 -0.9809 1712662 ACon1_000791 COc1ccc2CC(=O)c3cc4OCOc4cc3CCN(C)Cc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H14 compound treatment 546707.3171 -83500.0 -0.39 647718.3099 56100.0 0.3 -0.0617 -0.1267 3557252 ACon1_000792 CC1CCC2C(C)(C)[C@@H](O)CC[C@]2(C)C31Cc4c(O3)c5CN(C(CCC(=O)O)C(=O)O)C(=O)c5cc4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H15 compound treatment 497445.1827 -133000.0 -0.61 590103.5714 -1470.0 -0.01 -0.4384 -0.716 3559760 ACon1_000793 COc1cc(OC)c2c(=O)c(OC)c(oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H16 compound treatment 517528.4281 -113000.0 -0.52 588543.8596 -3030.0 -0.02 -0.3787 -0.7286 3558095 ACon1_000794 COC1CC(O[C@H]2CC[C@]3(C)C4[C@H](OC(=O)C)[C@@H](OC(=O)/C(=C/C)/C)[C@]5(C)[C@H](CC[C@]5(O)[C@]4(O)CC=C3C2)C(=O)C)OC(C)C1OC6CC(OC)C(OC7CC(OC)C(OC8OC(C)C(OC9OC(CO)C(O)C(O)C9O)C(OC)C8O)C(C)O7)C(C)O6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H17 compound treatment 565944.9838 -64300.0 -0.3 507480.1444 -84100.0 -0.45 -0.5249 -0.9803 3557608 ACon1_000795 COC(=O)C1=CCC[C@@H]2[C@@]3(CC(OC3=O)c4ccoc4)[C@H](C)CC[C@]21C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H18 compound treatment 530066.2461 -100000.0 -0.46 545251.6556 -46300.0 -0.25 -0.5002 -0.9564 3558016 ACon1_000796 COc1c(oc2c(OC)c(O)cc(O)c2c1=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H19 mock treatment 520363.6364 -110000.0 -0.51 508989.011 -82600.0 -0.44 -0.6679 -0.9974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H20 mock treatment 459345.7627 -171000.0 -0.79 527238.9078 -64300.0 -0.34 -0.7984 -0.9299 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H21 compound treatment 586680.1347 -43500.0 -0.2 525831.6498 -65700.0 -0.35 -0.3885 -0.9656 3558356 ACon1_000797 CCC1C2O[C@H]3OC=C([C@H]4C=C[C@]2(OC1=O)[C@@H]34)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H22 compound treatment 519519.6078 -111000.0 -0.51 744035.461 152000.0 0.81 0.2109 0.2206 3558238 ACon1_000798 CC(O)(C=C)C(O)CC1C(=C)CCC2C(C)(CCCC12C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H23 compound treatment 479432.1429 -151000.0 -0.7 476442.953 -115000.0 -0.61 -0.9234 -0.9979 3553600 ACon1_000799 CC(C)C1NC(=O)/C(=C/c2nc[nH]c2C(C)(C)C=C)/NC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 H24 compound treatment 501431.0954 -129000.0 -0.59 505613.7072 -86000.0 -0.46 -0.7423 -0.9915 3558108 ACon1_000800 CC1(C)[C@H]2C[C@@H]1C(=CC2)CO[C@@H]3O[C@H](CO[C@@H]4O[C@@H](CO)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I01 compound treatment 610162.5 -20000.0 -0.09 504485.0746 -87100.0 -0.46 -0.3919 -0.8321 3558341 ACon1_000801 COC(=O)C1=C[C@@H](O)[C@@H](O)[C@@H](C1)O[C@@H]2O[C@H](COC(=O)/C=C/c3ccccc3)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I02 compound treatment 839256.1983 209000.0 0.96 554379.562 -37200.0 -0.2 0.5422 0.551 3558497 ACon1_000802 CC1=CC(=O)C2=C(C)C[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]4[C@H](OC(=O)C4=C)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I03 compound treatment 710410.3586 80200.0 0.37 498591.3978 -93000.0 -0.49 -0.0871 -0.1414 3558461 ACon1_000803 CC(CC[C@@]1(C)[C@H](C)CC[C@]2(C)C1CCC=C2COC(=O)C)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I04 compound treatment 767669.2015 137000.0 0.63 649126.9231 57600.0 0.31 0.6642 0.9439 3558501 ACon1_000804 CC(OC1OC(CO)C(O)C(O)C1O)C2C(O)CC3C4CCC5=CC(=O)CCC5(C)C4CCC23C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I05 mock treatment 587606.0606 -42600.0 -0.2 655824.4898 64300.0 0.34 0.1021 0.2596 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I06 mock treatment 735986.2543 106000.0 0.49 758817.1206 167000.0 0.89 0.9722 0.9603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I07 compound treatment 512306.8966 -118000.0 -0.54 521847.7509 -69700.0 -0.37 -0.6459 -0.9824 3557857 ACon1_000805 COc1c2ccoc2c(OC)c3oc(CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(=O)c13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I08 compound treatment 556435.6846 -73800.0 -0.34 676520.5479 85000.0 0.45 0.0781 0.1383 3614493 ACon1_000806 COc1cc(O)c2c(=O)cc(oc2c1OC)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I09 compound treatment 614080.292 -16100.0 -0.07 698468.5039 107000.0 0.57 0.3484 0.6092 3557926 ACon1_000807 CC1(C)C2CC(OC3OC(CO)C(O)C(O)C3O)C1(C)CC2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I10 compound treatment 589145.9627 -41000.0 -0.19 745710.4377 154000.0 0.82 0.4442 0.5294 3558796 ACon1_000808 COc1cc(O)c(OC)c2OC(CC(=O)c12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I11 compound treatment 519378.7375 -111000.0 -0.51 606259.1241 14700.0 0.08 -0.3063 -0.5925 3558071 ACon1_000809 CC(C)CC(=O)O[C@@H]1OC=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2OC(=O)/C=C/c3ccc(O)cc3)[C@H]4CCC(CO)[C@H]41 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I12 compound treatment 641959.0444 11800.0 0.05 590080.8824 -1490.0 -0.01 0.0328 0.5978 2084711 ACon1_000810 CC(=CCc1c(O)ccc2ccc(=O)oc12)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I13 compound treatment 603290.625 -26900.0 -0.12 616937.2937 25400.0 0.13 0.0074 0.0405 3558138 ACon1_000811 OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](O)[C@@H]4O[C@]4(COC(=O)/C=C/c5ccc(O)cc5)[C@H]32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I14 compound treatment 677973.3333 47800.0 0.22 629760.7143 38200.0 0.2 0.299 0.9991 3555622 ACon1_000812 O[C@H]1[C@@H](O)[C@H](OC(=O)Cc2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1OC(=O)Cc3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I15 compound treatment 481556.2914 -149000.0 -0.69 541721.875 -49800.0 -0.26 -0.6717 -0.9142 3558149 ACon1_000813 OC[C@H]1O[C@@H](OC/C/2=C\[C@H]3OC(=O)C(=C)[C@@H]3[C@@H]4C/C(=C\CC2)/C(=O)O4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I16 compound treatment 502972.5086 -127000.0 -0.59 533387.6812 -58200.0 -0.31 -0.6331 -0.955 3557723 ACon1_000814 CC1[C@@H]2CC/C(=C/CC/C(=C/[C@H]2OC1=O)/C)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I17 compound treatment 616276.0943 -13900.0 -0.06 555287.234 -36300.0 -0.19 -0.1815 -0.8945 3558279 ACon1_000815 C/C(=C\CCC(O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)/CCC(C)(O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I18 compound treatment 602209.375 -28000.0 -0.13 663865.7244 72300.0 0.38 0.1799 0.4446 3558214 ACon1_000816 C[C@H]1[C@H]2[C@H](OC1=O)/C=C(\C)/[C@H](C/C=C(\C)/C[C@@H]2O)OC(=O)C(=C)[C@@H]3CCC(=C)[C@@H]4C[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(=C)[C@@H]4C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I19 compound treatment 647476.0274 17300.0 0.08 588792.0792 -2780.0 -0.01 0.0459 0.5668 3614503 ACon1_000817 CC1OC(=O)CC2C(=CC3(O)CC(C)(C)CC213)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I20 compound treatment 472654.9521 -158000.0 -0.73 509673.1392 -81900.0 -0.43 -0.8209 -0.9698 1072848 ACon1_000818 COc1c(oc2cc(O)cc(O)c2c1=O)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I21 mock treatment 605716.0883 -24500.0 -0.11 595370.7483 3800.0 0.02 -0.0656 -0.5718 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I22 mock treatment 563669.2607 -66500.0 -0.31 518936.3958 -72600.0 -0.39 -0.4893 -0.9936 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I23 compound treatment 313585.3659 -317000.0 -1.46 295427.6316 -296000.0 -1.57 -2.1431 -0.9993 3554830 ACon1_000819 COc1cc(c(OC)c2oc3cc(O)c(O)cc3c12)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 I24 compound treatment 505355.9871 -125000.0 -0.58 533749.1289 -57800.0 -0.31 -0.6239 -0.9565 3558502 ACon1_000820 COc1cc2OCOc2cc1c3coc4cc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)ccc4c3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J01 compound treatment 750968.75 121000.0 0.56 683893.6877 92300.0 0.49 0.7401 0.9979 3553370 ACon1_000821 CC(=O)OC[C@@]12C[C@H](O)C(=C[C@H]2O[C@@H]3[C@H](O)[C@@H](OC(=O)C)[C@@]1(C)[C@@]43CO4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J02 compound treatment 811243.9024 181000.0 0.83 627415.8416 35800.0 0.19 0.7248 0.8465 3558605 ACon1_000822 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5[C@H](O)C[C@]43C)C2C1)C(=O)OC6OCC(OC7OCC(O)C(O)C7O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J03 compound treatment 777140.2715 147000.0 0.68 675487.0849 83900.0 0.45 0.7939 0.9792 3558664 ACon1_000823 CC(C(=O)O)[C@@]12CC[C@H](C)[C@H](CCC(=O)O)C(C)C2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J04 compound treatment 668208.4806 38000.0 0.18 701333.3333 110000.0 0.58 0.5356 0.881 3559918 ACon1_000824 CC(=CCc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c3C(=O)[C@H](O)[C@H](Oc13)c4ccc(O)cc4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J05 mock treatment 718053.1915 87900.0 0.41 718939.3939 127000.0 0.68 0.7642 0.9701 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J06 mock treatment 593602.2727 -36600.0 -0.17 548739.1304 -42800.0 -0.23 -0.28 -0.9893 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J07 compound treatment 640066.9014 9870.0 0.05 729524.6479 138000.0 0.73 0.5496 0.7497 3558736 ACon1_000825 CC1CCC2(C)C(CCC=C2C(=O)O)C1(C)CCC3=CC(O)OC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J08 compound treatment 614983.871 -15200.0 -0.07 596946.5409 5380.0 0.03 -0.0294 -0.3888 3558372 ACon1_000826 CC(=O)OCC1=C[C@@H]2OC(=O)C3=CO[C@@H](OC4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H]1[C@H]23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J09 compound treatment 601472.7891 -28700.0 -0.13 598177.4744 6610.0 0.04 -0.0689 -0.5027 3558673 ACon1_000827 COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c3c(=O)cc(oc3c1OC)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J10 compound treatment 623935.1145 -6260.0 -0.03 684141.129 92600.0 0.49 0.3268 0.6644 3553747 ACon1_000828 CC(O)C(C)CC/C=C(\C)/C(O)C/C=C(\C)/C=C/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J11 compound treatment 612000.0 -18200.0 -0.08 599439.3939 7870.0 0.04 -0.0298 -0.3182 3614508 ACon1_000829 COc1cc(oc(=O)c1C)/C(=C/C(C)CCCC(=O)O)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J12 compound treatment 49079.3651 -581000.0 -2.68 45233.3333 -546000.0 -2.9 -3.944 -0.9992 3554483 ACon1_000830 CN1C(=O)C23CC4=CC=CC(OC(=O)C)C4N3C(=O)C1(CO)SS2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J13 compound treatment 423074.0741 -207000.0 -0.96 438748.2014 -153000.0 -0.81 -1.2486 -0.9967 3559771 ACon1_000831 COc1ccc(/C=C/2\Oc3cc(O)cc(O)c3C2=O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J14 compound treatment 645420.6642 15200.0 0.07 706642.8571 115000.0 0.61 0.4812 0.7833 3557886 ACon1_000832 COc1cc(CCCO)cc2C(CO)C(Oc21)c3ccc(OC)c(OC4OC(CO)C(O)C(O)C4O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J15 compound treatment 481099.3789 -149000.0 -0.69 563164.4295 -28400.0 -0.15 -0.5927 -0.8421 3559738 ACon1_000833 COC1=CC(C)c2c(C)c3c(C)coc3c(OC)c2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J16 compound treatment 362683.0189 -268000.0 -1.23 372852.6786 -219000.0 -1.16 -1.6926 -0.9995 3558192 ACon1_000834 C[C@H]1[C@H]2[C@H](CC3C4CC=C5C[C@H](CC[C@]5(C)C4CC[C@]23C)O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]6O)O[C@@]91CCC(C)CO9 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J17 compound treatment 548568.4932 -81600.0 -0.38 539218.75 -52400.0 -0.28 -0.4625 -0.9888 3558487 ACon1_000835 CC1=C2[C@H](O)C(=O)O[C@H](c3ccoc3)[C@]2(C)CC[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J18 compound treatment 535826.4706 -94400.0 -0.44 678158.5761 86600.0 0.46 0.017 0.0269 3553097 ACon1_000836 C[C@H]1[C@H]2[C@H](OC1=O)/C=C(\C)/[C@H](C/C=C(\C)/C[C@@H]2O)OC(=O)C(=C)[C@@H]3CCC(=C)[C@@H]4C[C@H](O[C@@H]5O[C@H](CO[C@H]6OC[C@](O)(CO)[C@H]6O)[C@@H](O)[C@H](O)[C@H]5O)C(=C)[C@@H]4C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J19 compound treatment 573948.9796 -56200.0 -0.26 603477.6632 11900.0 0.06 -0.1388 -0.5198 3614518 ACon1_000837 CCC(C)C(O)C(C)(O)/C=C/C1=CC2=CC(=O)C(C)(O)C(O)C2CO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J20 compound treatment 562304.8327 -67900.0 -0.31 65392.1569 -526000.0 -2.79 -2.1948 -0.7815 3558583 ACon1_000838 C/C=C(/C)\C(=O)OC1C(=C)C2CC31CCC4[C@](C)(CCC[C@]4(C)C3CC2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J21 mock treatment 496817.0732 -133000.0 -0.62 548900.7634 -42700.0 -0.23 -0.595 -0.9078 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J22 mock treatment 512832.8076 -117000.0 -0.54 508438.7097 -83100.0 -0.44 -0.6945 -0.9948 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J23 compound treatment 500467.0846 -130000.0 -0.6 484814.8148 -107000.0 -0.57 -0.8234 -0.9996 3558317 ACon1_000839 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3CC[C@]4(C)C5CC[C@]6(C)[C@H](CC[C@]6(O)[C@@H]5CCC4=C3)c7ccc(=O)oc7)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 J24 compound treatment 562680.7018 -67500.0 -0.31 486787.4564 -105000.0 -0.56 -0.6131 -0.9625 3614523 ACon1_000840 COC1C(=O)Nc2ccc3C=CC(C)(CCC=C(C)C)Oc3c2C1(O)c4ccc(OC)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K01 compound treatment 623753.6232 -6440.0 -0.03 553959.596 -37600.0 -0.2 -0.1621 -0.8035 3558362 ACon1_000841 CC(=CCC/C(=C/C(O)C/C(=C/C(O)CC(C)(O)C=C)/C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K02 compound treatment 561439.6552 -68800.0 -0.32 527622.5681 -63900.0 -0.34 -0.464 -0.9994 3558452 ACon1_000842 COc1cc(O)c2c(=O)cc(oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K03 compound treatment 711042.9688 80800.0 0.37 622978.7986 31400.0 0.17 0.3814 0.9341 3558557 ACon1_000843 C/C(=C/COc1c(OC2OC(CO)C(O)C(O)C2O)ccc3ccc(=O)oc13)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K04 compound treatment 724792.1147 94600.0 0.44 622255.814 30700.0 0.16 0.4236 0.9097 3558485 ACon1_000844 CC1[C@H]2C[C@@H]3[C@@H](CC[C@@]3(C)O)C(=C)CC2OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K05 compound treatment 721802.2814 91600.0 0.42 670829.932 79300.0 0.42 0.596 1.0 3557306 ACon1_000845 CC1=CC2O[C@@H]3[C@H](O)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@](C)(C53CO5)[C@@]2(CO)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K06 compound treatment 660943.8202 30700.0 0.14 603456.2044 11900.0 0.06 0.1448 0.9334 3614529 ACon1_000846 COc1ccc2C(=O)[C@]3(O)[C@@H](COc4cc5OCOc5cc43)Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K07 mock treatment 642945.7627 12800.0 0.06 612493.6709 20900.0 0.11 0.1201 0.9559 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K08 mock treatment 641461.5385 11300.0 0.05 648019.5313 56400.0 0.3 0.2485 0.8176 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K09 compound treatment 661429.1188 31200.0 0.14 607329.8611 15800.0 0.08 0.161 0.9665 3558035 ACon1_000847 CC1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C3C(CO)C(O)CC31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K10 compound treatment 53682.9268 -577000.0 -2.66 67820.0 -524000.0 -2.78 -3.8443 -0.9998 3554481 ACon1_000848 CN1C(=O)[C@@]2(Cc3ccccc3)SSS[C@]1(CO)C(=O)N2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K11 compound treatment 611313.1313 -18900.0 -0.09 660839.1167 69300.0 0.37 0.1982 0.525 3614533 ACon1_000849 CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC(O)CC(O)CC(=O)O)C12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K12 compound treatment 489480.0 -141000.0 -0.65 559882.3529 -31700.0 -0.17 -0.5777 -0.8618 3558064 ACon1_000850 COc1cc2oc(cc(=O)c2c(O)c1OC)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K13 compound treatment 710381.877 80200.0 0.37 551785.9649 -39800.0 -0.21 0.1123 0.2637 3558118 ACon1_000851 COc1c(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)cc(O)c3c(=O)cc(oc13)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K14 compound treatment 558277.027 -71900.0 -0.33 549026.6667 -42500.0 -0.23 -0.3941 -0.9824 3557898 ACon1_000852 C[C@@H]1O[C@@H](O[C@@H]2[C@H](Oc3cc(O)cc(O)c3C2=O)c4ccc(O)cc4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K15 mock treatment 574034.2466 -56200.0 -0.26 594454.8611 2880.0 0.02 -0.1723 -0.6642 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K16 mock treatment 603899.6865 -26300.0 -0.12 566756.8493 -24800.0 -0.13 -0.1788 -0.9992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K17 compound treatment 590403.1746 -39800.0 -0.18 533704.7619 -57900.0 -0.31 -0.3468 -0.9698 3558293 ACon1_000853 CC(C)c1cc2CCC3C(C)(CO)C[C@H](O)C[C@]3(C)c2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K18 compound treatment 587396.9697 -42800.0 -0.2 557477.9661 -34100.0 -0.18 -0.2674 -0.999 3558216 ACon1_000854 CC1=C2[C@@H]([C@H]3OC(=O)C(=C)[C@@H]3CC1)C(=CC2=O)CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K19 compound treatment 669207.3579 39000.0 0.18 589973.4219 -1600.0 -0.01 0.1212 0.6731 3553957 ACon1_000855 CC1C(OC(=O)C)C(OC(=O)C)C2=C(CCCC2(C)C)C1(C)CCC(C)(O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K20 compound treatment 589489.4895 -40700.0 -0.19 587918.0887 -3650.0 -0.02 -0.1464 -0.776 3558262 ACon1_000856 CC(C)C(O)(C(=O)C)C(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K21 compound treatment 560306.4516 -69900.0 -0.32 577880.4348 -13700.0 -0.07 -0.2792 -0.8452 3558329 ACon1_000857 COc1c(O)cc(CCc2cc(O)cc(O)c2)cc1CC(O)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K22 compound treatment 591647.4164 -38500.0 -0.18 550628.866 -40900.0 -0.22 -0.2793 -0.9951 3553545 ACon1_000858 CC(C)C(OC(=O)C)c1nc2ccccc2c(=O)n1C3CC4(OC3=O)C5N(O)C(C)(C)C(=O)N5c6ccccc64 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K23 mock treatment 542228.013 -88000.0 -0.41 562385.3503 -29200.0 -0.15 -0.3963 -0.9127 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 K24 mock treatment 517795.2218 -112000.0 -0.52 504683.6364 -86900.0 -0.46 -0.6924 -0.9983 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L01 compound treatment 728238.3178 98000.0 0.45 633266.6667 41700.0 0.22 0.4761 0.9459 3552660 ACon1_000859 C[C@@H]1C[C@H]2OC(=O)C(=C)[C@@H]2[C@H](OC(=O)C(=C)C)[C@@H](OC(=O)C)[C@@](C)(O)C(=O)[C@H]3O[C@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L02 compound treatment 534575.9162 -95600.0 -0.44 567657.0048 -23900.0 -0.13 -0.4015 -0.875 3558654 ACon1_000860 COc1cc(/C=C/C(=O)CC(=O)\C=C\c2ccc(O)c(O)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L03 compound treatment 817377.451 187000.0 0.86 986335.1955 395000.0 2.09 2.0909 0.9232 3558666 ACon1_000861 C[C@H]1CC[C@@H]2[C@@H](OC(=O)C2=C)C(=C)[C@H]1CCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L04 compound treatment 791515.2838 161000.0 0.74 610670.1389 19100.0 0.1 0.5977 0.796 3559920 ACon1_000862 CC(=CCc1c(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c3C(=O)[C@H](O)[C@H](Oc13)c4ccc(O)cc4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L05 compound treatment 799284.2466 169000.0 0.78 802693.9502 211000.0 1.12 1.3432 0.9844 3558706 ACon1_000863 CC1C2C3=CCC4C5(C)C[C@@H](O)[C@H](O)C(C)(CO)C5CCC4(C)C3(C)CCC2(CCC1=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L06 compound treatment 737042.3453 107000.0 0.49 635057.9151 43500.0 0.23 0.5115 0.9402 3558287 ACon1_000864 C[C@H]1[C@H]2[C@H](CC3C4C[C@@H](O)[C@H]5C[C@H](CC[C@]5(C)C4CC[C@]23C)O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]9O[C@H](CO)[C@@H](O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)[C@H](O)[C@H]9O)[C@H](O)[C@H]6O)O[C@@]%111CCC(C)CO%11 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L07 mock treatment 690699.6198 60500.0 0.28 641668.9655 50100.0 0.27 0.3852 0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L08 mock treatment 730164.9123 100000.0 0.46 687892.1933 96300.0 0.51 0.6872 0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L09 compound treatment 660847.2222 30700.0 0.14 667173.4317 75600.0 0.4 0.3835 0.902 3552042 ACon1_000865 C/C=C(\C)/CC(/C=C(\C)/C(O)C(C)/C=C(\C)/C(O)C(C)/C=C/C(O)C/C=C/C(O)C(O)C(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L10 compound treatment 809917.2185 180000.0 0.83 787477.2727 196000.0 1.04 1.3208 0.9937 3558492 ACon1_000866 COc1cc(CC2COC(C2COC(=O)C)c3ccc(O)c(OC)c3)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L11 compound treatment 169257.1429 -461000.0 -2.13 75392.1569 -516000.0 -2.74 -3.439 -0.9922 3614544 ACon1_000867 CC1CCC/C=C/2\C3C(OC(=C3C(=O)O1)\C=C\C=C\C=C\C(=O)O)C=CC2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L12 compound treatment 703322.449 73100.0 0.34 803416.3701 212000.0 1.12 1.033 0.8805 3554712 ACon1_000868 COC(=O)c1cc(OC)cc(O)c1C(=O)c2c(O)cc(C)cc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L13 compound treatment 535648.6486 -94500.0 -0.44 492420.1389 -99200.0 -0.53 -0.6802 -0.9957 3559773 ACon1_000869 COc1cc(/C=C/2\Oc3cc(O)cc(O)c3C2=O)cc(OC)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L14 compound treatment 494247.5248 -136000.0 -0.63 61607.8431 -530000.0 -2.81 -2.4309 -0.8441 3558463 ACon1_000870 CC(C)c1cc2C3OC(=O)[C@@]4(CCCC(C)(C)C4[C@H]3O)c2c(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L15 mock treatment 636121.2121 5930.0 0.03 587096.4286 -4470.0 -0.02 0.0025 0.0703 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L16 mock treatment 617101.083 -13100.0 -0.06 663710.8844 72100.0 0.38 0.2279 0.5882 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L17 compound treatment 631011.4613 816.0 0.0 660401.3605 68800.0 0.37 0.2608 0.7144 3555854 ACon1_000871 OC(=O)CCC1OC(=O)C(=C1c2ccccc2)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L18 compound treatment 534260.2339 -95900.0 -0.44 591595.3947 25.2 0.0 -0.3127 -0.7069 3553101 ACon1_000872 C[C@H]1[C@H]2[C@H](OC1=O)/C=C(\C)/[C@H](C/C=C(\C)/C[C@@H]2O)OC(=O)C(=C)[C@@H]3CCC(=C)[C@@H]4C[C@H](O[C@@H]5O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]5O)C(=C)[C@@H]4C3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L19 compound treatment 651135.8025 20900.0 0.1 659273.0263 67700.0 0.36 0.3222 0.8665 3614554 ACon1_000873 CCC(C)C(O)C(C)(O)/C=C/C1=CC2=C(Cl)C(=O)C(C)(O)C(O)C2=CO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L20 compound treatment 593764.9123 -36400.0 -0.17 634648.8889 43100.0 0.23 0.0428 0.1508 3558638 ACon1_000874 C/C=C(/C)\C(=O)O[C@H]\1C[C@@H]2[C@H](OC(=O)C2=C)[C@@H]3O[C@]3(C)CC/C=C1\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L21 compound treatment 518133.1169 -112000.0 -0.52 637799.3631 46200.0 0.25 -0.192 -0.3357 3554505 ACon1_000875 CO[C@@H]1C[C@]2(CC=C)[C@@H](C)[C@@H](OC2=C(OC)C1=O)c3cc4OCOc4c(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L22 compound treatment 600125.731 -30100.0 -0.14 580195.0355 -11400.0 -0.06 -0.1407 -0.9305 3558750 ACon1_000876 CC(=CCCC(=CCCC(=CC1C(O)C=C(C)C1=O)C)C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L23 mock treatment 523376.6234 -107000.0 -0.49 557821.0863 -33700.0 -0.18 -0.4749 -0.9061 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 L24 mock treatment 567300.7246 -62900.0 -0.29 614904.9296 23300.0 0.12 -0.1176 -0.3728 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M01 compound treatment 601498.0843 -28700.0 -0.13 514598.6395 -77000.0 -0.41 -0.3823 -0.8907 2112282 ACon1_000877 CC1=C2C(=O)O[C@@H](c3ccoc3)[C@]2(C)CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M02 compound treatment 513996.2825 -116000.0 -0.54 435062.3053 -157000.0 -0.83 -0.9659 -0.9776 3558453 ACon1_000878 COc1cc(ccc1O)c2cc(=O)c3c(O)c(OC)c(OC)c(O)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M03 compound treatment 579965.7534 -50200.0 -0.23 647208.4942 55600.0 0.3 0.0449 0.1196 3558587 ACon1_000879 COc1cc(C[C@@H]2COC([C@@H]2CO)c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)ccc1O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M04 compound treatment 687258.2781 57100.0 0.26 530586.8852 -61000.0 -0.32 -0.0426 -0.1023 3554680 ACon1_000880 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C)/[C@@H]1CC(=O)OCC(C3CCC(C)C3C(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M05 compound treatment 735743.5897 106000.0 0.49 675852.3077 84300.0 0.45 0.6603 0.9991 3553941 ACon1_000881 CC1=CC2O[C@@H]3[C@H](O)[C@@H](O)[C@@](C)(C43CO4)[C@@]2(CO)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M06 compound treatment 545006.3291 -85200.0 -0.39 418566.5236 -173000.0 -0.92 -0.9266 -0.9283 3559292 ACon1_000882 CO[C@H]1C[C@@H](Oc2c(CC=C(C)C)c(OC)cc(OC)c12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M07 compound treatment 580194.4444 -50000.0 -0.23 515034.9206 -76500.0 -0.41 -0.4501 -0.9641 3557952 ACon1_000883 COc1ccc(C2COc3cc(O)ccc3C2)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M08 compound treatment 623691.8429 -6500.0 -0.03 553089.4569 -38500.0 -0.2 -0.1655 -0.8024 3554197 ACon1_000884 CCC1(C)C(O)C2=COC(=C(C)C2=CC1=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M09 mock treatment 628855.1724 -1340.0 -0.01 574770.428 -16800.0 -0.09 -0.0674 -0.7543 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M10 mock treatment 674894.5687 44700.0 0.21 590814.3939 -756.0 0.0 0.1429 0.6932 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M11 compound treatment 551262.8205 -78900.0 -0.36 568491.3495 -23100.0 -0.12 -0.3439 -0.8956 3553758 ACon1_000885 CC(O)CCCC1Cc2cccc(O)c2C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M12 compound treatment 440958.9041 -189000.0 -0.87 524904.943 -66700.0 -0.35 -0.8671 -0.9209 3554988 ACon1_000886 COc1cc(O)c2c(=O)oc3c(O)c(OC)cc(C)c3c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M13 mock treatment 547596.3303 -82600.0 -0.38 541000.0 -50600.0 -0.27 -0.459 -0.9853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M14 mock treatment 564351.9062 -65800.0 -0.3 566841.5493 -24700.0 -0.13 -0.3075 -0.9295 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M15 compound treatment 626341.8803 -3850.0 -0.02 594285.2459 2720.0 0.01 -0.0024 -0.1042 3614568 ACon1_000887 CC1OC(OC(=O)C2=CC3CC(C)(C)CC34C2CC(=O)OC4C)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M16 compound treatment 653739.521 23500.0 0.11 553727.8912 -37800.0 -0.2 -0.0652 -0.2855 3557904 ACon1_000888 Cc1c(O[C@@H]2O[C@H](COC(=O)CC(C)(O)CC(=O)O)C[C@H](O)[C@H]2O)occc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M17 compound treatment 547898.2558 -82300.0 -0.38 611882.1429 20300.0 0.11 -0.1922 -0.4871 3554555 ACon1_000889 COC(=O)[C@]1(C)CCC[C@@]2(C)C1CC(OC(=O)C)C3=C2CC(OC(=O)C)[C@](C)(C=C)C3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M18 compound treatment 573029.5699 -57200.0 -0.26 570290.411 -21300.0 -0.11 -0.2662 -0.9283 3557955 ACon1_000890 CC(O)CCCCCCCCCC(Cc1cc(O)cc(O)c1)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M19 compound treatment 563000.0 -67200.0 -0.31 580000.0 -11600.0 -0.06 -0.2625 -0.831 3558411 ACon1_000891 C[C@]1(O)CC[C@H]2[C@@H]1[C@H](O[C@@H]3O[C@H](COC(=O)c4ccc(O)cc4)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M20 compound treatment 549244.7552 -81000.0 -0.37 616119.8738 24500.0 0.13 -0.1719 -0.4348 3554267 ACon1_000892 CCCCCC(O)C1OC(=O)CCC(O)C(O)/C=C/C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M21 compound treatment 447098.7261 -183000.0 -0.84 523904.4118 -67700.0 -0.36 -0.8508 -0.9274 3558351 ACon1_000893 Cc1cc(O)c2C(=O)c3c(O)cc(OC4OC(COC(=O)CC(=O)O)C(O)C(O)C4O)cc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M22 compound treatment 664403.5088 34200.0 0.16 562501.7794 -29100.0 -0.15 0.0025 0.0115 3552748 ACon1_000894 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](NC(=O)C)[C@H](O[C@@H]3[C@@H](O)[C@H](C)O[C@@H](Oc4ccc5c(=O)c(coc5c4)c6ccc(O)cc6)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M23 compound treatment 506867.9868 -123000.0 -0.57 601096.2963 9530.0 0.05 -0.3664 -0.6418 3558422 ACon1_000895 CC(=O)OC1C(=C)C2C[C@]31CCC4[C@@](C)(CCC[C@@]4(C)C3CC2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 M24 compound treatment 485064.5161 -145000.0 -0.67 580676.4706 -10900.0 -0.06 -0.5141 -0.7653 3558504 ACon1_000896 C[C@H]1[C@H]2[C@H](OC1=O)[C@@H]3[C@@H](C[C@H](O)C3=C)C(=C)C[C@@H]2O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N01 compound treatment 611366.1417 -18800.0 -0.09 618041.1523 26500.0 0.14 0.0379 0.2295 3555900 ACon1_000897 OC[C@H]1O[C@@H](Oc2cc(O)cc3oc(=O)cc(c4ccc(O)c(O)c4)c23)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N02 compound treatment 810144.5783 180000.0 0.83 801374.5704 210000.0 1.11 1.3737 0.9896 3614577 ACon1_000898 CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1O)C(=O)OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N03 compound treatment 676188.9764 46000.0 0.21 630495.7265 38900.0 0.21 0.296 0.9999 3558675 ACon1_000899 COc1ccccc1c2cc(=O)c3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(OC)c(OC)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N04 compound treatment 790167.8082 160000.0 0.74 744809.7015 153000.0 0.81 1.0964 0.9988 3559922 ACon1_000900 CC(=CCc1c(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c3C(=O)C[C@H](Oc13)c4ccc(O)cc4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N05 compound treatment 693716.6667 63500.0 0.29 656178.1818 64600.0 0.34 0.4495 0.997 3614580 ACon1_000901 CC1=CCC2C(C)(CO)CCCC2(C)C1CC34OC4C(O)C(=CC3O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N06 compound treatment 611768.9394 -18400.0 -0.08 534093.0233 -57500.0 -0.3 -0.2757 -0.871 3558417 ACon1_000902 COc1ccc(/C=C/C(=O)O[C@H]2[C@H](C)O[C@@H](O[C@@H]3[C@@H]4O[C@]4(CO)[C@@H]5[C@H]3C=CO[C@H]5O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](OC(=O)C)[C@@H]2OC(=O)\C=C\c7ccc(OC)cc7)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N07 compound treatment 689920.8633 59700.0 0.28 600483.6364 8910.0 0.05 0.2282 0.8165 3557311 ACon1_000903 CC(C)CCC(O)C1CC(CO)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N08 compound treatment 599324.2424 -30900.0 -0.14 627885.906 36300.0 0.19 0.0355 0.1484 3558683 ACon1_000904 CC(C)(O)CCC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(CC(OC5OC(CO)C(O)C(O)C5O)C(O)C4(C)C)C3(C)CCC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N09 mock treatment 632838.488 2640.0 0.01 665776.2238 74200.0 0.39 0.2869 0.7287 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N10 mock treatment 624217.2285 -5980.0 -0.03 607872.7273 16300.0 0.09 0.0416 0.4589 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N11 compound treatment 571621.3018 -58600.0 -0.27 613368.1159 21800.0 0.12 -0.1093 -0.3718 3614587 ACon1_000905 CC1CCC/C=C/C/C=C\C(OC(=O)/C=C\C=C\C=C\C(=O)O)/C=C/C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N12 compound treatment 649577.7027 19400.0 0.09 504304.5113 -87300.0 -0.46 -0.2641 -0.5602 3558740 ACon1_000906 COc1ccc(cc1)c2oc3cc(OC)cc(O)c3c(=O)c2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N13 mock treatment 587461.2903 -42700.0 -0.2 689540.7166 98000.0 0.52 0.2281 0.4104 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N14 mock treatment 604503.012 -25700.0 -0.12 593402.7778 1830.0 0.01 -0.0769 -0.6469 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N15 compound treatment 509213.5593 -121000.0 -0.56 512240.1316 -79300.0 -0.42 -0.692 -0.9903 3559368 ACon1_000907 CC(=C)C1CCC2(CCC3(C)C(CCC4C5(C)C(C=O)C(O)C(C)(CO)C5CCC43C)C12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N16 compound treatment 564015.4799 -66200.0 -0.31 502878.3784 -88700.0 -0.47 -0.5484 -0.9781 3552752 ACon1_000908 C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)C4C[C@@H](O)[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CCC3=C2)c6ccc(=O)oc6)[C@H](O)[C@H](O)[C@H]1O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N17 compound treatment 628646.0481 -1550.0 -0.01 557843.9716 -33700.0 -0.18 -0.1315 -0.7348 3553640 ACon1_000909 CC(C)Cc1cnc(CCC(=O)N)c(=O)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N18 compound treatment 531997.0845 -98200.0 -0.45 589297.491 -2270.0 -0.01 -0.3287 -0.7257 3558595 ACon1_000910 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@]43C)C2C1)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O[C@H]7OC[C@](O)(CO)[C@H]7O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N19 compound treatment 547000.0 -83200.0 -0.38 511693.2515 -79900.0 -0.42 -0.5709 -0.9988 3614597 ACon1_000911 CCC(C)C(O)C(C)(O)/C=C/C1=CC2=C(Cl)C(=O)C(C)(O)C(OC(=O)C)C2CO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N20 compound treatment 525618.7683 -105000.0 -0.48 541265.3722 -50300.0 -0.27 -0.5297 -0.961 3558712 ACon1_000912 CC(C)C(=O)OC/C(=C/CCC(=C)C1CC=C(COC(=O)C(C)C)C(O)C1)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N21 compound treatment 465852.7607 -164000.0 -0.76 484412.3711 -107000.0 -0.57 -0.9378 -0.9899 3614600 ACon1_000913 CC(CCO)/C=C(\C)/C=C/C1=CC2=CC(=O)C(C)(O)C(O)C2=CO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N22 compound treatment 445027.5591 -185000.0 -0.85 446309.9174 -145000.0 -0.77 -1.1486 -0.9987 3559260 ACon1_000914 CC1OC(OC2C(O)C(CO)OC(O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C6C7CC(C)(C)CC[C@@]7(CC[C@]65C)C(=O)OC8OCC(OC9OCC(O)C(O)C9O)C(O)C8O)C3(C)C)C2O)C(O)C(OC%10OCC(O)(CO)C%10O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N23 compound treatment 511776.1194 -118000.0 -0.55 609623.8532 18100.0 0.1 -0.3184 -0.5744 3558089 ACon1_000915 COC1CC(O[C@H]2CC[C@]3(C)C4[C@H](O)[C@@H](O)[C@]5(C)[C@H](CC[C@]5(O)C4CC=C3C2)[C@H](C)O)OC(C)C1OC6CC(OC)C(OC7CC(OC)C(OC8OC(C)C(OC9OC(CO)C(O)C(O)C9O)C(OC)C8O)C(C)O7)C(C)O6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 N24 compound treatment 544681.6609 -85500.0 -0.39 586139.0728 -5430.0 -0.03 -0.2992 -0.7567 3557301 ACon1_000916 CC(OC(=O)c1cccc(O)c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O01 compound treatment 594054.7945 -36100.0 -0.17 542184.5018 -49400.0 -0.26 -0.3031 -0.9762 3557296 ACon1_000917 C[C@@H]1Cc2c(O)c(O)cc(O)c2C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O02 compound treatment 624504.0984 -5690.0 -0.03 531350.1577 -60200.0 -0.32 -0.2444 -0.7626 3497202 ACon1_000918 CC(=CCO)CCC1C(C)(O)CCC2C(C)(C)CCCC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O03 compound treatment 648640.0 18400.0 0.09 548572.4382 -43000.0 -0.23 -0.1011 -0.4154 3558589 ACon1_000919 CSC(=O)OCC1=C[C@H](O)[C@H]2[C@@H]1[C@H](OC3OC(CO)C(O)C(O)C3O)OC=C2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O04 compound treatment 700527.6753 70300.0 0.32 667649.635 76100.0 0.4 0.5147 0.9941 3558219 ACon1_000920 C[C@@H]1CC[C@]2(C)[C@H](CC[C@@H](O)[C@]2(C)O)[C@@]1(C)CC/C(=C/CO)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O05 compound treatment 593748.9177 -36400.0 -0.17 512582.5826 -79000.0 -0.42 -0.4151 -0.9195 1045397 ACon1_000921 COc1ccc(cc1OC)c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O06 compound treatment 531541.8182 -98700.0 -0.45 467520.7547 -124000.0 -0.66 -0.7869 -0.9838 1046376 ACon1_000922 COc1c(O)c2c(=O)cc(oc2c(OC)c1OC)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O07 compound treatment 565848.249 -64300.0 -0.3 549229.7735 -42300.0 -0.22 -0.3686 -0.9906 3557981 ACon1_000923 OC[C@H]1O[C@@H](OC2OC=C(C3CCC(=C)C32)C(=O)O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O08 compound treatment 472973.8562 -157000.0 -0.73 299200.0 -292000.0 -1.55 -1.6092 -0.94 3554706 ACon1_000924 COC(=O)c1cc(O)cc(OC)c1C(=O)c2c(O)cc(C)cc2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O09 compound treatment 580491.2892 -49700.0 -0.23 503210.0592 -88400.0 -0.47 -0.4935 -0.9459 3551984 ACon1_000925 C/C(=C\OC(=O)/C=C/c1ccc(O)cc1)/C(O)C2OC(=O)/C(=C\COC3OC(CO)C(O)C(O)C3O)/C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O10 compound treatment 572624.5614 -57600.0 -0.27 486936.6667 -105000.0 -0.55 -0.5802 -0.943 3558809 ACon1_000926 CC(C)(O)[C@@H]1Cc2cc3cc(c(=O)oc3cc2O1)C(C)(C)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O11 mock treatment 576310.2041 -53900.0 -0.25 502425.9259 -89100.0 -0.47 -0.51 -0.9549 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O12 mock treatment 513211.2676 -117000.0 -0.54 508470.3704 -83100.0 -0.44 -0.6931 -0.995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O13 compound treatment 544223.3677 -86000.0 -0.4 497111.4983 -94500.0 -0.5 -0.6346 -0.9933 3553125 ACon1_000927 C[C@H]1CC(O)C23COC(=O)[C@@H]3CCC[C@@H]2[C@]41C[C@H](OC4=O)c5ccoc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O14 compound treatment 517438.9313 -113000.0 -0.52 500013.7457 -91600.0 -0.49 -0.7111 -0.9994 3557917 ACon1_000928 C[C@]1(C[C@]2(O)O[C@@H]3O1)[C@]4(C[C@@H]2C34COC(=O)c5ccccc5)O[C@@H]6O[C@H](COC(=O)c7ccccc7)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O15 compound treatment 621458.7814 -8740.0 -0.04 490692.5466 -101000.0 -0.54 -0.4068 -0.7582 3555917 ACon1_000929 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)cc3oc4c(O)c(O)ccc4c(=O)c3c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O16 compound treatment 476553.1915 -154000.0 -0.71 460241.1576 -131000.0 -0.7 -0.9936 -1.0 3557831 ACon1_000930 CC1OC(OC2C(O)C(O)C(Oc3cc(O)c4c(=O)c(coc4c3)c5ccc(O)c(O)c5)OC2CO)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O17 compound treatment 519550.8197 -111000.0 -0.51 496592.8571 -95000.0 -0.5 -0.717 -1.0 3557287 ACon1_000931 CCCC1CCC(C(=C)C(=O)O)C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O18 compound treatment 437333.3333 -193000.0 -0.89 439480.5195 -152000.0 -0.81 -1.1993 -0.9988 3558352 ACon1_000932 C[C@]12C[C@H](OC(=O)C(=C)C(O)CO)[C@@H]3[C@H](OC(=O)C3=C)C2C(CC[C@H]1O)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O19 compound treatment 536853.9683 -93300.0 -0.43 457006.8729 -135000.0 -0.71 -0.8091 -0.9707 1062453 ACon1_000933 COc1c(O)cc2oc(cc(=O)c2c1O)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O20 compound treatment 543390.7692 -86800.0 -0.4 540557.2289 -51000.0 -0.27 -0.4744 -0.9818 3557279 ACon1_000934 COC1=CC(=O)C[C@@H](C)[C@@]21Oc3cc(OC)cc(OC)c3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O21 compound treatment 552642.1405 -77600.0 -0.36 484193.75 -107000.0 -0.57 -0.6556 -0.9749 3558330 ACon1_000935 CC(C)(O)C1Cc2cc(CCc3cc(O)cc(O)c3)ccc2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O22 compound treatment 478372.2397 -152000.0 -0.7 482701.7045 -109000.0 -0.58 -0.9034 -0.9954 3553357 ACon1_000936 CC(=O)OC/C/1=C/CCC(=C)[C@H]2CC(C)(C)[C@@H]2CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O23 compound treatment 434922.2222 -195000.0 -0.9 469814.3713 -122000.0 -0.65 -1.0934 -0.9867 3558425 ACon1_000937 COc1cc(/C=C/C(=O)OCc2ccccc2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 O24 compound treatment 358100.0 -272000.0 -1.25 360584.2697 -231000.0 -1.23 -1.7536 -0.9999 3555971 ACon1_000938 OCCC(CO)c1c(O)cc2C(=O)c3cc(O)cc(O)c3C(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P01 compound treatment 571863.2479 -58300.0 -0.27 589061.1354 -2510.0 -0.01 -0.1996 -0.7412 3558656 ACon1_000939 C[C@@H]/1C[C@H]2OC(=O)C(=C)[C@@H]2[C@H](OC(=O)C(=C)C)[C@@H](OC(=O)C)[C@@](C)(O)C(=O)/C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P02 compound treatment 640763.0522 10600.0 0.05 517782.0069 -73800.0 -0.39 -0.2423 -0.6143 3558684 ACon1_000940 CC(=O)OC1CC2(C)C3CC=C4C(CC(OC5OC(CO)C(O)C(O)C5O)C(O)C4(C)C)C3(C)CCC2(C)C1C(C)(O)C(=O)CCC(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P03 compound treatment 568404.5802 -61800.0 -0.28 586095.679 -5470.0 -0.03 -0.222 -0.7751 3558685 ACon1_000941 CC(=O)OC1CC2(C)C3CC=C4C(CC(O)C(O)C4(C)C)C3(C)CCC2(C)C1C(C)(O)C(=O)CCC(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P04 compound treatment 704648.855 74500.0 0.34 543572.8155 -48000.0 -0.25 0.0628 0.1469 3554701 ACon1_000942 COC(=O)c1cc(O)c(C(=O)c2c(O)cccc2C(=O)O)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P05 compound treatment 549686.8327 -80500.0 -0.37 606029.2887 14500.0 0.08 -0.2083 -0.5494 3614622 ACon1_000943 CC1=CCC2C(C)(CCCC2(C)C1CC34OC4C(O)C(=C)C(O)C3O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P06 compound treatment 612317.9916 -17900.0 -0.08 496163.5688 -95400.0 -0.51 -0.4161 -0.8116 3558470 ACon1_000944 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)[C@](C)(C5CC[C@]43C)C(=O)O)C2C1)C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P07 compound treatment 598460.9665 -31700.0 -0.15 611459.9303 19900.0 0.11 -0.0289 -0.1601 3553189 ACon1_000945 CC(=CCC/C(=C\CC\C(=C\CC\C(=C\CO)\CO)\C)/C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P08 compound treatment 506485.0746 -124000.0 -0.57 474127.0903 -117000.0 -0.62 -0.8439 -0.999 3554753 ACon1_000946 COc1c(C)cc(C(=O)/C=C/c2ccccc2)c(O)c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P09 compound treatment 406329.4118 -224000.0 -1.03 360714.2857 -231000.0 -1.22 -1.5958 -0.9964 3552709 ACon1_000947 C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)/C=C/C(=C/Cc2c(O)c(Cl)c(C)c(C=O)c2O)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P10 compound treatment 504076.3636 -126000.0 -0.58 468313.9932 -123000.0 -0.65 -0.8735 -0.9983 3558180 ACon1_000948 COc1cc(CCCO)cc2[C@@H](CO)[C@@H](Oc21)c3ccc(OC)c(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P11 mock treatment 534797.4138 -95400.0 -0.44 450262.9969 -141000.0 -0.75 -0.8411 -0.9678 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P12 mock treatment 522968.4211 -107000.0 -0.49 488589.3417 -103000.0 -0.55 -0.7359 -0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P13 compound treatment 513264.8221 -117000.0 -0.54 503196.2025 -88400.0 -0.47 -0.7127 -0.9976 3553333 ACon1_000949 CC(=O)O[C@@H]1C[C@](C)(C=C)C=C2[C@H](O)CC3C(C)(C)CC[C@@H](OC(=O)C)[C@]3(C)C12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P14 compound treatment 468626.4591 -162000.0 -0.75 418281.6092 -173000.0 -0.92 -1.1768 -0.9946 3558552 ACon1_000950 CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P15 compound treatment 493868.8047 -136000.0 -0.63 557311.1782 -34300.0 -0.18 -0.573 -0.8756 3559386 ACon1_000951 CC(C)C(O)CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P16 compound treatment 449453.4535 -181000.0 -0.83 438075.6014 -153000.0 -0.81 -1.1651 -0.9999 3558472 ACon1_000952 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)[C@](C)(C5CC[C@]43C)C(=O)O)C2C1)C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P17 compound treatment 476764.3505 -153000.0 -0.71 424029.3255 -168000.0 -0.89 -1.1287 -0.9936 3558567 ACon1_000953 CC1=C(CCC2=CC(=O)OC2O)[C@@]3(C)CCC[C@@]4(C)[C@@H]3C(OC4=O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P18 compound treatment 403251.4286 -227000.0 -1.05 452794.0199 -139000.0 -0.74 -1.2605 -0.9852 3558599 ACon1_000954 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@]43C)C2C1)C(=O)OC6OCC(O[C@H]7OC[C@](O)(CO)[C@H]7O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P19 compound treatment 412759.4203 -217000.0 -1.0 494659.306 -96900.0 -0.51 -1.0725 -0.9518 3614634 ACon1_000955 CC(C)C1NC(=O)C(CC2(O)C3NC(Cc4ccccc4)C(=O)N3c5ccccc52)NC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P20 compound treatment 287551.8672 -343000.0 -1.58 386253.4722 -205000.0 -1.09 -1.8874 -0.9835 3551644 ACon1_000956 CC1Oc2c3C=CC(C)(C)Oc3c4c(cc(=O)oc4c2C(=O)C1C)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P21 compound treatment 426279.5031 -204000.0 -0.94 510079.1789 -81500.0 -0.43 -0.9706 -0.9378 3554485 ACon1_000957 CN1C(=O)c2ccccc2NC(=O)[C@@]31O[C@@H]3c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P22 compound treatment 468055.5556 -162000.0 -0.75 509548.5893 -82000.0 -0.44 -0.8363 -0.9668 3554963 ACon1_000958 COc1cc(O)c(C(=O)O)c(c1)c2c(C)cc(oc2=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P23 compound treatment 398970.9302 -231000.0 -1.07 457374.1497 -134000.0 -0.71 -1.2573 -0.9807 3558309 ACon1_000959 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](OC6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)C5CC[C@]43C)[C@@H]2C1)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2292 P24 compound treatment 374175.5725 -256000.0 -1.18 358288.4615 -233000.0 -1.24 -1.7098 -0.9997 3557994 ACon1_000960 C[C@@H]1C[C@H](OC(=O)c2ccccc2)[C@H](OC(=O)C)[C@@]3(COC(=O)C)[C@H](C[C@@H]4[C@@H](OC(=O)c5ccccc5)[C@]13OC4(C)C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A01 compound treatment 63469.3878 -356000.0 -1.64 59708.3333 -628000.0 -3.33 -3.5181 -0.947 3554483 ACon1_000961 CN1C(=O)C23CC4=CC=CC(OC(=O)C)C4N3C(=O)C1(CO)SS2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A02 compound treatment 790145.5399 370000.0 1.71 680505.102 -7400.0 -0.04 1.1798 0.6907 3554004 ACon1_000962 CC1CC23OC3(/C=C(/C)\C(O)C(O)C4C(C(O)C(C)C2=O)C4(C)C)C1OC5OC(CO)C(O)C(O)C5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A03 compound treatment 918048.1283 498000.0 2.3 869495.2381 182000.0 0.96 2.3057 0.9255 3614644 ACon1_000963 CC(C)CC1NC(=O)C23C1C(=CC(O)C3/C=C/CCC4OC4(C)C(O)CC2=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A04 compound treatment 817574.4681 398000.0 1.83 819848.7805 132000.0 0.7 1.7919 0.9127 3558783 ACon1_000964 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc3cc(O)c4C(=O)C[C@H](Oc4c3)c5ccc(O)c(O)c5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A05 compound treatment 878984.127 459000.0 2.12 812944.7236 125000.0 0.66 1.9662 0.8861 3553738 ACon1_000965 CC(O)(CC[C@H]1C(=C)CCC2[C@@](C)(CCC[C@]12C)C(=O)O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A06 compound treatment 680266.2338 260000.0 1.2 749825.0 61900.0 0.33 1.0815 0.8686 3558578 ACon1_000966 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C6C7CC(C)(C)CC[C@@]7(CC[C@]65C)C(=O)O)[C@]3(C)CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A07 compound treatment 827982.8571 408000.0 1.88 789129.2135 101000.0 0.54 1.7106 0.874 3558828 ACon1_000967 C/C/1=C\CCC2=CC(OC2=O)C(C)(C)/C=C\C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A08 compound treatment 759035.7143 339000.0 1.56 681685.0829 -6220.0 -0.03 1.0828 0.692 3554998 ACon1_000968 COC1CC(O[C@H]2CC[C@@]3(C)[C@H](CCC45OC56CC=C(C7=CC(=O)OC7)[C@@]6(C)CCC43)C2)OC(C)C1O[C@@H]8O[C@H](CO[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@H](O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A09 compound treatment 876520.6186 457000.0 2.11 743670.3911 55800.0 0.3 1.6984 0.7986 3558621 ACon1_000969 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)[C@H](C[C@@]31O)OC(=O)/C=C/c4ccc(OC)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A10 compound treatment 610784.0376 191000.0 0.88 628899.4083 -59000.0 -0.31 0.4014 0.4295 3558846 ACon1_000970 C/C(=C\CC[C@H](CO)[C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)[C@@]4(C)CCC(=O)C(C)(C)C4CC3)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A11 compound treatment 903654.8223 484000.0 2.23 778442.9224 90500.0 0.48 1.9173 0.8401 3614654 ACon1_000971 CC(O)CC(=O)c1cc(O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A12 compound treatment 814821.4286 395000.0 1.82 788502.7624 101000.0 0.53 1.6653 0.8774 3553484 ACon1_000972 CC(C)(OO)C1=C[C@]23CCC4[C@@](C)(CCC[C@]4(C)C3C[C@@H]1OO2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A13 mock treatment 690765.3061 271000.0 1.25 830465.6085 143000.0 0.76 1.4182 0.9711 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A14 mock treatment 905181.8182 485000.0 2.24 826431.4721 139000.0 0.73 2.1022 0.8924 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A15 compound treatment 697151.8325 277000.0 1.28 837935.6436 150000.0 0.8 1.467 0.9739 3558823 ACon1_000973 CC1CCC2C1C(OC3OC(CO)C(O)C(O)C3O)OC=C2C(=O)OC4C5OC5(C)C6C(OC7OC(CO)C(O)C(O)C7O)OC=CC46O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A16 compound treatment 822109.0047 402000.0 1.86 789737.0892 102000.0 0.54 1.6937 0.8766 3558930 ACon1_000974 OC1CCC(O)C(O)(C1O)C(=O)OCc2cc(O)ccc2OC3OC(COC(=O)c4ccccc4)C(O)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A17 compound treatment 761598.9583 342000.0 1.58 732494.6809 44600.0 0.24 1.2817 0.8042 3558444 ACon1_000975 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCCc3ccccc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A18 compound treatment 638351.1905 219000.0 1.01 600601.1561 -87300.0 -0.46 0.3851 0.3473 3558953 ACon1_000976 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)C5CC[C@]43C)[C@@H]2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A19 compound treatment 880962.963 461000.0 2.13 723585.6354 35700.0 0.19 1.6375 0.767 1113957 ACon1_000977 Oc1cc(O)c2c(=O)c(O)c(oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A20 compound treatment 737404.5455 318000.0 1.46 707152.381 19300.0 0.1 1.1078 0.7546 3558990 ACon1_000978 CCCCCC(CC(=O)CCc1ccc(O)c(OC)c1)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A21 compound treatment 753843.3735 334000.0 1.54 663968.3544 -23900.0 -0.13 0.9994 0.6466 3558623 ACon1_000979 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A22 compound treatment 637947.3684 218000.0 1.01 563000.0 -125000.0 -0.66 0.2428 0.2016 3558955 ACon1_000980 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)C5CC[C@]43C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A23 compound treatment 670565.6566 251000.0 1.16 705356.0209 17500.0 0.09 0.8831 0.7613 3554993 ACon1_000981 COc1cc(O)cc(c1)C2=C(C)CC(O)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 A24 compound treatment 714336.0996 295000.0 1.36 515510.2881 -172000.0 -0.91 0.3138 0.1917 3552069 ACon1_000982 C/C=C/C=C/C(=O)C1=C(O)[C@]2(C)C3C(=C(O)C4(C)C1[C@]5(C)O[C@@]4(O)[C@@]3(C)O[C@@]52O)C(=O)\C=C\C=C\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B01 compound treatment 702502.5381 283000.0 1.3 832389.1892 144000.0 0.77 1.4637 0.9679 3558240 ACon1_000983 C[C@@H]1O[C@@H](Oc2ccc3c(=O)c(coc3c2)c4ccc(O)cc4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B02 compound treatment 779591.9283 360000.0 1.66 881201.8349 193000.0 1.03 1.8981 0.9732 3554879 ACon1_000984 COc1cc(ccc1O)C2C(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(CO)Cc4cc(OC)c(O)cc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B03 compound treatment 745487.6847 326000.0 1.5 848009.1324 160000.0 0.85 1.6624 0.9636 3559896 ACon1_000985 COc1ccc(cc1OC)c2oc3cc(OC)c(OC)c(O)c3c(=O)c2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B04 compound treatment 767400.9901 348000.0 1.6 830663.5945 143000.0 0.76 1.6688 0.9414 2060503 ACon1_000986 C1Oc2ccc(cc2O1)[C@H]3OC[C@@H]4[C@@H](OC[C@H]34)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B05 compound treatment 708018.0995 288000.0 1.33 756449.5413 68500.0 0.36 1.1968 0.8686 3557603 ACon1_000987 CC1(CCCC2(C)C3CCC4CC3(CC4(O)CO)CCC12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B06 compound treatment 790415.5844 371000.0 1.71 622468.254 -65400.0 -0.35 0.963 0.5522 3559134 ACon1_000988 Oc1ccc(cc1O)C2CC(=O)c3ccc(O)c(O)c3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B07 compound treatment 1018555.0 599000.0 2.76 1071607.477 384000.0 2.04 3.3915 0.9887 3558984 ACon1_000989 C/C(=C\CCC1(C)C2CC3C(C2)C31C)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B08 compound treatment 857257.1429 437000.0 2.02 790737.6238 103000.0 0.55 1.8121 0.8672 3559662 ACon1_000990 COC1=CC(=O)O[C@@H](CCc2ccccc2)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B09 compound treatment 790287.6712 370000.0 1.71 917026.2009 229000.0 1.22 2.0673 0.9861 3554161 ACon1_000991 CCC(C)CC(C)/C=C(\C)/[C@H]1OC2=C([C@@H](O)[C@@H]1O)C(=C)N(OC)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B10 compound treatment 729362.3853 310000.0 1.43 616679.6537 -71200.0 -0.38 0.7422 0.5027 3558358 ACon1_000992 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1C=CC43OC(=O)C(=C4)[C@H](C)OC(=O)/C=C/c5ccc(O)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B11 compound treatment 738000.0 318000.0 1.47 832276.4977 144000.0 0.77 1.579 0.954 3558976 ACon1_000993 COc1ccc(cc1)C2CC(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B12 compound treatment 672442.9825 253000.0 1.16 794177.2727 106000.0 0.56 1.2223 0.9445 2102488 ACon1_000994 O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B13 mock treatment 758204.1885 338000.0 1.56 728427.8075 40500.0 0.21 1.2554 0.797 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B14 mock treatment 833344.4976 414000.0 1.91 731082.4742 43200.0 0.23 1.5104 0.7864 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B15 compound treatment 51901.9608 -368000.0 -1.7 65866.6667 -622000.0 -3.3 -3.5327 -0.9522 3559076 ACon1_000995 CC1C2C(CC3C4CC=C5C[C@@H](O)CC(O)[C@]5(C)C4CC[C@]23C)OC61CCC(C)CO6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B16 compound treatment 574443.2432 155000.0 0.71 680147.0588 -7750.0 -0.04 0.4751 0.6652 3558644 ACon1_000996 COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c3c(cc(=O)oc3c1)c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B17 compound treatment 815238.342 395000.0 1.82 725926.4069 38000.0 0.2 1.432 0.7806 3559113 ACon1_000997 Cc1c(O)c(C)c2oc(cc(=O)c2c1O)c3ccccc3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B18 compound treatment 628587.6289 209000.0 0.96 807458.3333 120000.0 0.63 1.1291 0.9795 3559079 ACon1_000998 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3ccc(C=C)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B19 compound treatment 626178.744 206000.0 0.95 663439.8148 -24500.0 -0.13 0.5811 0.6051 3558382 ACon1_000999 C[C@@H]1OC(O[C@H]2[C@H](O)[C@@H](COC(=O)/C=C/c3ccc(O)c(O)c3)O[C@@H](OCCc4ccc(O)c(O)c4)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B20 compound treatment 647260.274 227000.0 1.05 826032.2581 138000.0 0.73 1.2597 0.9846 3559123 ACon1_001000 O[C@@]12CO[C@@H]([C@H]2CO[C@@H]1c3ccc4OCOc4c3)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B21 compound treatment 732915.8416 313000.0 1.44 636180.6167 -51700.0 -0.27 0.827 0.5627 3559488 ACon1_001001 C/C=C(\COC(=O)C)/C(=O)O[C@@H]1CC2(C)OC(=CC2=O)\C(=C/[C@@H]3OC(=O)C(=C)C31)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B22 compound treatment 771659.4828 352000.0 1.62 821471.4286 134000.0 0.71 1.6482 0.931 3553151 ACon1_001002 C[C@H]1CCCC2=CC[C@H](C[C@]12C)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B23 compound treatment 768190.4762 348000.0 1.61 589158.0882 -98700.0 -0.52 0.7656 0.4531 3552728 ACon1_001003 C[C@@H]1CCC2C(C)(C)CCC[C@@]2(C)[C@@]1(O)CCC(=CCO)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 B24 compound treatment 66804.3478 -353000.0 -1.63 72020.8333 -616000.0 -3.27 -3.4611 -0.9483 329 ACon1_001004 CC(C)C1NC(=O)C(NC(=O)c2ccc(C)c3oc4c(C)c(=O)c(N)c(C(=O)NC5C(C)OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C6CCCN6C(=O)C(NC5=O)C(C)C)c4nc23)C(C)OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C7CCCN7C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C01 compound treatment 650160.3774 230000.0 1.06 616301.5075 -71600.0 -0.38 0.4825 0.4278 3614681 ACon1_001005 CO[C@H]1C(=O)Nc2ccc(/C=C/C(=C)C)c(O)c2[C@]1(O)c3ccc(OC)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C02 compound treatment 689523.0769 270000.0 1.24 674548.3871 -13400.0 -0.07 0.8293 0.6658 3558734 ACon1_001006 CC1(C)C2CC[C@]3(CC4CC[C@H]3[C@]2(C)CCC1=O)C[C@@]4(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C03 compound treatment 443605.6338 23800.0 0.11 718531.5315 30600.0 0.16 0.1924 0.9817 3553883 ACon1_001007 CC1(C)Oc2c(CCO)c3occ(c4ccc(O)c(O)c4)c(=O)c3c(O)c2C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C04 compound treatment 527027.027 107000.0 0.49 955203.7037 267000.0 1.42 1.3521 0.9005 3555922 ACon1_001008 OC1C(O)C(COC(=O)CC2(O)C=CC(=O)C=C2)OC(OC(=O)CC3(O)C=CC(=O)C=C3)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C05 compound treatment 323027.027 -96800.0 -0.45 733510.0 45600.0 0.24 -0.1446 -0.2848 3552112 ACon1_001009 C/C=C\1/[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C3[C@H]1CC(=O)OC[C@@H]4[C@@H](C)[C@@H](C[C@H]4C(C)CO)OC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C06 compound treatment 492271.028 72400.0 0.33 610566.21 -77300.0 -0.41 -0.0538 -0.1018 3558787 ACon1_001010 C[C@@H]1O[C@@H](OCC2OC(OC3C(O)C(O)C(CO)OC3OC4C(O)C(O)C(CO)OC4Oc5c(oc6cc(O)cc(O)c6c5=O)c7ccc(O)c(O)c7)C(O)C(O)C2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C07 compound treatment 295165.8654 -125000.0 -0.57 657005.5556 -30900.0 -0.16 -0.5224 -0.8738 3558850 ACon1_001011 C[C@@H]1C(=O)[C@@H](O)[C@]2(COC(=O)C)[C@H](CCC[C@@]32CO3)[C@]41CC(OC4OC(=O)C)c5ccoc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C08 compound treatment 273674.6032 -146000.0 -0.67 633864.3216 -54000.0 -0.29 -0.6793 -0.9274 3558834 ACon1_001012 C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](O)[C@H](OC(=O)c5cc(O)c(O)c(O)c5)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C09 compound treatment 443663.5294 23800.0 0.11 904563.1068 217000.0 1.15 0.8903 0.7712 3554277 ACon1_001013 CCCCCC1CC(O)C(O)C(CC(=O)OC(CCC)CCCC(CC(=O)O1)OC2OC(CO)C(O)C(O)C2NC(=O)C)OC(=O)CC(C)(O)CC(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C10 compound treatment 441830.5556 22000.0 0.1 631720.5882 -56200.0 -0.3 -0.139 -0.4415 3558858 ACon1_001014 CC1OC(OC2C(O)C(C)OC(OCC3OC(OC4C(C)OC(Oc5cc(O)c6c(=O)c(O)c(oc6c5)c7ccc(O)c(O)c7)C(O)C4O)C(O)C(O)C3OC(=O)/C=C/c8ccc(O)cc8)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C11 mock treatment 392243.038 -27600.0 -0.13 745201.8779 57300.0 0.3 0.1249 0.3792 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C12 mock treatment 334311.2745 -85500.0 -0.39 762280.4233 74400.0 0.39 1.0E-4 1.0E-4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C13 compound treatment 370044.164 -49800.0 -0.23 697974.026 10100.0 0.05 -0.1246 -0.5285 3558742 ACon1_001015 CC1=CCC2[C@](C)(CCC[C@]2(C)[C@H]1CCc3ccoc3)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C14 compound treatment 429226.6289 9390.0 0.04 714040.9091 26100.0 0.14 0.1287 0.8858 3558795 ACon1_001016 CC(O)(CC(=O)O)CC(=O)OCC1OC(Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)cc4)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C15 mock treatment 324429.2804 -95400.0 -0.44 845885.1675 158000.0 0.84 0.2814 0.2973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C16 mock treatment 455842.8928 36000.0 0.17 723244.0191 35300.0 0.19 0.25 0.9982 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C17 compound treatment 400426.3566 -19400.0 -0.09 895086.0215 207000.0 1.1 0.7138 0.6474 3558891 ACon1_001017 CCCC1CCCCCCCCCC(=O)OC2C(OC3OC(CO)C(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4OC(=O)C(C)CC)C(O)C3O)C(O)C(C)OC2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C18 compound treatment 270288.2206 -150000.0 -0.69 608331.2102 -79600.0 -0.42 -0.7861 -0.9722 3558933 ACon1_001018 CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)O[C@H]1O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC=C7[C@@H]8CC(C)(C)CC[C@@]8(CC[C@]76C)C(=O)O)C4(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C19 compound treatment 241957.9208 -178000.0 -0.82 697777.7778 9880.0 0.05 -0.543 -0.6606 3614691 ACon1_001019 CC1CC(=O)c2c(C1)ccc3C(=O)c4cccc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)c4C(=O)c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C20 compound treatment 834018.7793 414000.0 1.91 682634.1463 -5270.0 -0.03 1.3309 0.6967 3553736 ACon1_001020 CC(NC(=O)c1ccccc1N)C(=O)N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C21 compound treatment 739194.1748 319000.0 1.47 816522.1239 129000.0 0.68 1.5238 0.9388 3558991 ACon1_001021 CCCCCCC[C@@H](O)CC(=O)CCc1ccc(O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C22 compound treatment 794705.2632 375000.0 1.73 807709.6774 120000.0 0.64 1.6718 0.9076 3559021 ACon1_001022 CC(=C)C(=O)O[C@H]1[C@@H]2[C@H](OC(=O)C2=C)/C=C(\CO)/CC/C=C(/C=O)\[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C23 compound treatment 669647.0588 250000.0 1.15 888328.7037 200000.0 1.06 1.5663 0.9992 1102980 ACon1_001023 COc1cc(cc(OC)c1OC)C2C3C(COC3=O)Cc4cc5OCOc5cc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 C24 compound treatment 758878.1726 339000.0 1.56 775742.0814 87800.0 0.47 1.435 0.8796 3552625 ACon1_001024 C[C@@H]1C[C@@H](O)[C@]23CO[C@]3(CO)CCC[C@@H]2[C@]41C[C@H](OC4=O)c5ccoc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D01 compound treatment 630186.8687 210000.0 0.97 707873.7374 20000.0 0.11 0.7608 0.7797 3558448 ACon1_001025 O[C@@H]1[C@@H](O)[C@H](Oc2cc(O)c3c(=O)cc(oc3c2)c4ccc(O)cc4)O[C@@H]([C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D02 compound treatment 873788.1773 454000.0 2.09 853456.4103 166000.0 0.88 2.1012 0.9256 1035250 ACon1_001026 CC(=O)c1c(O)cc(O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D03 compound treatment 396534.4353 -23300.0 -0.11 836929.5775 149000.0 0.79 0.4829 0.6054 3558681 ACon1_001027 CC(C)C1CCC(C)(O)C2CCC(C21)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D04 compound treatment 313673.0769 -106000.0 -0.49 609969.5122 -77900.0 -0.41 -0.6385 -0.9965 3559064 ACon1_001028 COc1cc2OC(C)(C)C=Cc2c3O[C@H](CC(=O)c13)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D05 compound treatment 329950.1134 -89900.0 -0.41 645072.9614 -42800.0 -0.23 -0.4537 -0.9599 3558585 ACon1_001029 COc1cc(C[C@H]2CO[C@@H]([C@H]2CO)c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D06 compound treatment 458791.0448 39000.0 0.18 903696.2617 216000.0 1.14 0.9364 0.8082 3555816 ACon1_001030 OC(=O)C(CCCCCCCCC=C)C1(CCC(=O)O1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D07 compound treatment 322247.6636 -97600.0 -0.45 704471.1111 16600.0 0.09 -0.2561 -0.5585 3557965 ACon1_001031 COc1cc2oc(c(OC)c(=O)c2c(O)c1OC)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D08 compound treatment 277993.2432 -142000.0 -0.65 759960.8939 72100.0 0.38 -0.1923 -0.2538 3559355 ACon1_001032 COc1cc(CC(CO)C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Cc3cc(OC)c(O)c(OC)c3)cc(OC)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D09 compound treatment 250303.9216 -170000.0 -0.78 657994.4751 -29900.0 -0.16 -0.665 -0.8336 3558973 ACon1_001033 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)C2[C@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D10 compound treatment 460686.4198 40900.0 0.19 938995.1456 251000.0 1.33 1.0749 0.7992 3554278 ACon1_001034 CCCCCC1OC2=C(C(O)C1(C)O)C(=O)N(OC)C2CSCC(O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D11 mock treatment 323622.9885 -96200.0 -0.44 788530.6122 101000.0 0.53 0.0637 0.0917 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D12 mock treatment 524367.688 105000.0 0.48 764575.6098 76700.0 0.41 0.6284 0.9964 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D13 compound treatment 335936.7946 -83900.0 -0.39 856971.5909 169000.0 0.9 0.3605 0.3691 3558978 ACon1_001035 C/C(=C\C(=O)O)/CCC1C(=C)CCC2C(C)(C)C(O)CCC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D14 compound treatment 294039.7351 -126000.0 -0.58 591113.3603 -96800.0 -0.51 -0.7732 -0.9981 3558688 ACon1_001036 CC(C)(C=C)c1cc2cc3ccoc3cc2oc1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D15 mock treatment 283193.3842 -137000.0 -0.63 755358.7444 67500.0 0.36 -0.1926 -0.2658 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D16 mock treatment 299736.9615 -120000.0 -0.55 763950.0 76000.0 0.4 -0.1064 -0.1553 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D17 compound treatment 319701.2448 -100000.0 -0.46 583576.2082 -104000.0 -0.55 -0.7178 -0.996 3559116 ACon1_001037 OC(=O)[C@]1(O)C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](OC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](C1)OC(=O)/C=C/c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D18 compound treatment 348827.5109 -71000.0 -0.33 696724.1379 8820.0 0.05 -0.1985 -0.6 3558901 ACon1_001038 O[C@@H](CCc1ccccc1)CC(=O)CCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D19 compound treatment 430111.1111 10300.0 0.05 626882.5758 -61000.0 -0.32 -0.1953 -0.5972 3554848 ACon1_001039 COc1cc(C)c(Oc2cc(C)cc(O)c2)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D20 compound treatment 383397.2222 -36400.0 -0.17 851408.046 164000.0 0.87 0.4944 0.5597 3559313 ACon1_001040 COC(=O)C[C@H]1/C(=C/COC(=O)\C=C\c2ccccc2)/[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D21 compound treatment 691787.1486 272000.0 1.25 758964.9123 71100.0 0.38 1.1533 0.8807 3552014 ACon1_001041 C/C=C(/C)\C(=O)O[C@H]1C(=C)[C@@H]2C[C@]31CC[C@@H]4[C@@](C)(CCC[C@@]4(C)[C@]3(O)CC2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D22 compound treatment 776163.5514 356000.0 1.64 737636.8421 49700.0 0.26 1.3485 0.8102 3559586 ACon1_001042 CC(=O)OC/C/1=C\[C@H]2OC(=O)C(=C)[C@@H]2CC\C(=C\CC1)\CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D23 compound treatment 612181.4815 192000.0 0.89 746558.6854 58700.0 0.31 0.8472 0.9013 3554758 ACon1_001043 COc1c(ccc2Oc3c(O)cc(C)cc3COC(=O)c12)C(O)CC(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 D24 compound treatment 773012.3967 353000.0 1.63 715653.8462 27800.0 0.15 1.2558 0.7679 3557336 ACon1_001044 CC(O)CC1=CC(OC1=O)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E01 mock treatment 662472.6368 243000.0 1.12 639627.027 -48300.0 -0.26 0.6102 0.5316 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E02 mock treatment 685328.0423 265000.0 1.22 683361.1111 -4540.0 -0.02 0.8487 0.6931 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E03 compound treatment 541798.9418 122000.0 0.56 968237.8641 280000.0 1.49 1.4491 0.9115 3553538 ACon1_001045 CC(C)C(NC(=O)C(Cc1ccccc1)NC(=O)C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E04 compound treatment 391880.7786 -28000.0 -0.13 857449.5413 170000.0 0.9 0.5447 0.5996 3555006 ACon1_001046 COc1cc(OC)c2C(=O)OC(C)Cc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E05 compound treatment 368801.9324 -51000.0 -0.24 831773.913 144000.0 0.76 0.3732 0.4673 3558819 ACon1_001047 O[C@H]1C[C@@H]2[C@@H]([C@H]3OC(=O)C(=C)[C@@H]3[C@H](O)CC2=C)C1=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E06 compound treatment 365206.0738 -54600.0 -0.25 761732.7189 73800.0 0.39 0.0988 0.2121 3614704 ACon1_001048 Cc1c(O)cc2C(=O)C(O)(CCCO)OCc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E07 compound treatment 269652.968 -150000.0 -0.69 655075.3769 -32800.0 -0.17 -0.6128 -0.8582 3558866 ACon1_001049 C[C@@H]1O[C@@H](OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c3c(O)cc4oc(cc(=O)c4c3O)c5ccc(O)c(O)c5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E08 compound treatment 218361.7512 -201000.0 -0.93 622655.1724 -65200.0 -0.35 -0.9017 -0.9094 3558836 ACon1_001050 C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](OC(=O)c5cc(O)c(O)c(O)c5)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E09 mock treatment 369053.7897 -50800.0 -0.23 849695.279 162000.0 0.86 0.4412 0.496 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E10 mock treatment 310885.5932 -109000.0 -0.5 731554.1667 43700.0 0.23 -0.1916 -0.3463 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E11 compound treatment 292561.2245 -127000.0 -0.59 453184.6154 -235000.0 -1.24 -1.2953 -0.9411 3558576 ACon1_001051 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@@]45CCC(C)(C)CC5C6=CCC7[C@@]8(C)CC[C@H](O[C@@H]9OC[C@H](O)[C@H](O)[C@H]9O[C@@H]%10O[C@@H](C)[C@H](O)[C@@H](O)[C@H]%10O)C(C)(C)C8CC[C@@]7(C)[C@]6(C)CC4)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E12 compound treatment 350862.7049 -69000.0 -0.32 786570.7763 98700.0 0.52 0.1451 0.237 3558478 ACon1_001052 CC(C)(O)c1cc(O)c2c(CCC3C(C)(CCCC32C)C(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E13 compound treatment 269891.1704 -150000.0 -0.69 676829.6943 -11100.0 -0.06 -0.5305 -0.7644 3558756 ACon1_001053 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C/C)/[C@@H]1CC(=O)OCC(C)[C@@H]3C[C@H]4OC(=O)C5=CO[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)/C(=C/C)/[C@@H]5CC(=O)OC[C@@H]3[C@H]4C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E14 compound treatment 252984.9138 -167000.0 -0.77 626285.7143 -61600.0 -0.33 -0.7752 -0.9273 1859 ACon1_001054 Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c4cc(O)c(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E15 compound treatment 483988.7324 64200.0 0.3 714348.2587 26400.0 0.14 0.3084 0.9419 3558832 ACon1_001055 C/C/1=C\CC\C(=C\[C@H]2OC(=O)C(=C)[C@@H]2[C@@H](O)C1)\CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E16 compound treatment 411553.1335 -8280.0 -0.04 640200.0 -47700.0 -0.25 -0.2059 -0.8047 3555940 ACon1_001056 OC1CCC(=O)C(O)C1(O)C(=O)OCc2cc(O)ccc2OC3OC(COC(=O)c4ccccc4)C(O)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E17 mock treatment 416596.7302 -3240.0 -0.01 770995.5157 83100.0 0.44 0.3011 0.6827 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E18 mock treatment 262957.0136 -157000.0 -0.72 724985.2941 37100.0 0.2 -0.3725 -0.4968 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E19 compound treatment 479498.708 59700.0 0.28 750327.6596 62400.0 0.33 0.4287 0.9958 3557853 ACon1_001057 CC1CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C5CCC43C)C(=O)O)C2C1(C)O)C(=O)OC6OC(CO)C(O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E20 compound treatment 279278.0172 -141000.0 -0.65 839318.408 151000.0 0.8 0.1095 0.1061 3558986 ACon1_001058 COc1cc(CCC(O)CC(O)CCc2ccc(O)c(OC)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E21 compound treatment 301317.757 -119000.0 -0.55 455960.0 -232000.0 -1.23 -1.2564 -0.9333 3559000 ACon1_001059 CCCCCCCCC/C=C/C(=O)CCc1ccc(O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E22 compound treatment 848412.6984 429000.0 1.98 853634.3612 166000.0 0.88 2.0191 0.9334 3559026 ACon1_001060 CC1(C)[C@@H](O)CC[C@@]2(C)[C@@H]3CC[C@@](C)(C=C3CC[C@H]12)C(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E23 compound treatment 742285.0242 322000.0 1.49 714363.2479 26500.0 0.14 1.1507 0.7704 3558682 ACon1_001061 CC(C)c1ccc2c(c1)C(O)CC3C(C)(CO)CCCC32C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 E24 compound treatment 729299.4652 309000.0 1.43 823787.7095 136000.0 0.72 1.5188 0.9499 3552689 ACon1_001062 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O)C(C)(C)C5CC[C@]43C)C2[C@]1(C)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F01 mock treatment 672011.4286 252000.0 1.16 726586.0215 38700.0 0.21 0.9674 0.8192 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F02 mock treatment 666130.8901 246000.0 1.14 709813.1868 21900.0 0.12 0.8853 0.7754 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F03 compound treatment 390063.6792 -29800.0 -0.14 712654.0284 24800.0 0.13 -0.0042 -0.0224 3558778 ACon1_001063 Oc1ccc(/C=C/c2cc(O)cc(O)c2)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F04 compound treatment 477694.5946 57900.0 0.27 710072.5389 22200.0 0.12 0.2718 0.9322 3559033 ACon1_001064 COc1cc(ccc1O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F05 compound treatment 324960.7843 -94900.0 -0.44 747479.638 59600.0 0.32 -0.0859 -0.1592 425 ACon1_001065 Oc1ccc(cc1)c2coc3cc(O)cc(O)c3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F06 compound treatment 343412.6984 -76400.0 -0.35 829311.7647 141000.0 0.75 0.2811 0.3393 3559139 ACon1_001066 C[C@]1(CCC[C@@]2(C)[C@@H]3CC[C@@H]4C[C@@]3(CCC12)C(=O)C4=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F07 compound treatment 514628.3422 94800.0 0.44 663609.375 -24300.0 -0.13 0.218 0.4784 3558995 ACon1_001067 CCCCCCCC(=O)CCc1ccc(O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F08 compound treatment 229329.5711 -191000.0 -0.88 614603.7736 -73300.0 -0.39 -0.8961 -0.9328 3557648 ACon1_001068 OC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)/C=C/c2ccc(O)c(O)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F09 mock treatment 306378.1321 -113000.0 -0.52 600127.2727 -87800.0 -0.47 -0.6992 -0.9983 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F10 mock treatment 291462.9213 -128000.0 -0.59 501113.9706 -187000.0 -0.99 -1.1192 -0.9697 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F11 compound treatment 273314.7752 -147000.0 -0.68 437417.9104 -250000.0 -1.33 -1.4172 -0.9508 3558481 ACon1_001069 COc1cc(/C=C/c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F12 compound treatment 272476.6147 -147000.0 -0.68 538949.4949 -149000.0 -0.79 -1.0392 -0.9972 3557470 ACon1_001070 CCc1cc(O)c(C)c(O)c1C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F13 compound treatment 497403.2258 77600.0 0.36 467083.0565 -221000.0 -1.17 -0.5752 -0.4697 3559015 ACon1_001071 Oc1ccc(cc1)[C@H]2CC(=O)c3c(O)cc(O)c([C@H]4[C@@H](Oc5cc(O)cc(O)c5C4=O)c6ccc(O)cc6)c3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F14 compound treatment 305314.2202 -115000.0 -0.53 569484.6626 -118000.0 -0.63 -0.8176 -0.9963 3555967 ACon1_001072 OCC1OC(OC(CCc2ccccc2)CC(=O)O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F15 compound treatment 373923.6111 -45900.0 -0.21 592829.8611 -95100.0 -0.5 -0.5063 -0.9257 3557355 ACon1_001073 CCCC[C@@H](O)c1cc(OC)cc(=O)o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F16 compound treatment 308359.4771 -111000.0 -0.51 499880.1498 -188000.0 -1.0 -1.0687 -0.9525 3558989 ACon1_001074 CCCCC[C@@H](O)CC(=O)CCc1ccc(O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F17 mock treatment 354640.7767 -65200.0 -0.3 633575.0916 -54300.0 -0.29 -0.4163 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F18 mock treatment 404304.8433 -15500.0 -0.07 771398.01 83500.0 0.44 0.2625 0.5851 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F19 compound treatment 249494.7589 -170000.0 -0.79 717390.1345 29500.0 0.16 -0.4449 -0.5554 3559597 ACon1_001075 COc1cc(C[C@H]2COC(=O)[C@@H]2Cc3ccc(O)c(OC)c3)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F20 compound treatment 421415.7303 1580.0 0.01 1099982.609 412000.0 2.19 1.5507 0.7095 3552025 ACon1_001076 C/C=C(\C)/C(=O)O[C@H]1C=CC(=O)O[C@H]1\C=C\[C@H](O)[C@H](C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F21 compound treatment 367744.7307 -52100.0 -0.24 613511.3636 -74400.0 -0.39 -0.4489 -0.9717 3553341 ACon1_001077 CC(=O)O[C@@H]1CC2[C@@]3(C)CCC(OC(=O)CC(=O)O)C(C)(C)C3CC[C@@]2(C)[C@]4(C)CCC(O)(C14)[C@]5(C)CCC(O5)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F22 compound treatment 144237.5691 -276000.0 -1.27 596674.1573 -91200.0 -0.48 -1.2409 -0.9124 3555308 ACon1_001078 COc1cccc2C(=O)c3c(ccc4CC(C)(O)CC(=O)c43)C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F23 compound treatment 497568.306 77700.0 0.36 488914.4737 -199000.0 -1.06 -0.4928 -0.4421 3559897 ACon1_001079 CC(=CCc1c(O)cc(O)c2c(=O)cc(oc12)c3ccc(O)cc3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 F24 compound treatment 776699.0741 357000.0 1.65 648803.4934 -39100.0 -0.21 1.0171 0.6132 3558760 ACon1_001080 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)[C@@H](O)C[C@@]31O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G01 compound treatment 648813.4715 229000.0 1.06 674009.3897 -13900.0 -0.07 0.6946 0.6562 3558179 ACon1_001081 COc1cc(CCCO)cc2C(COC3OC(CO)C(O)C(O)C3O)C(Oc21)c4ccc(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G02 compound treatment 96648.6487 -323000.0 -1.49 208969.697 -479000.0 -2.54 -2.8501 -0.9677 3554828 ACon1_001082 COc1cc(c(O)c(O)c1c2ccccc2)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G03 mock treatment 416625.7143 -3210.0 -0.01 737328.7037 49400.0 0.26 0.1749 0.6661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G04 mock treatment 629739.7959 210000.0 0.97 659021.978 -28900.0 -0.15 0.5762 0.5879 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G05 compound treatment 342562.6822 -77300.0 -0.36 650891.0891 -37000.0 -0.2 -0.3908 -0.9605 3555886 ACon1_001083 OC[C@H]1O[C@@H](O[C@H]2C[C@@H]3[C@@H]([C@H]4OC(=O)C(=C)[C@@H]4[C@H](O)CC3=C)C2=C)[C@H](O)[C@@H](O)[C@@H]1OC(=O)/C=C/c5ccc(O)c(O)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G06 compound treatment 371560.0 -48300.0 -0.22 627630.5221 -60300.0 -0.32 -0.3835 -0.9844 3614713 ACon1_001084 CC1CC(O)c2c(C1)ccc3C(O)c4c(O)cccc4C(=O)c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G07 compound treatment 287538.6417 -132000.0 -0.61 436966.9421 -251000.0 -1.33 -1.3725 -0.9374 3558875 ACon1_001085 OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3CC=C(CO)[C@H]32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G08 compound treatment 367096.3855 -52700.0 -0.24 441234.3234 -247000.0 -1.31 -1.0971 -0.8244 3558860 ACon1_001086 C/C(=C\CCC(C)(O)C=C)/C(=O)OCC1CCC2C1C(OC3OC(CO)C(O)C(O)C3O)OC=C2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G09 compound treatment 419870.6199 34.8 0.0 392248.2993 -296000.0 -1.57 -1.1087 -0.707 3558972 ACon1_001087 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)C2[C@H]1C)C(=O)O[C@@H]6O[C@H](CO[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G10 compound treatment 354074.9186 -65800.0 -0.3 324535.1171 -363000.0 -1.93 -1.5772 -0.8084 3557781 ACon1_001088 O[C@H]1[C@@H](O)[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)c(O)c5)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G11 compound treatment 184549.7835 -235000.0 -1.09 386787.9859 -301000.0 -1.6 -1.8966 -0.9823 1105254 ACon1_001089 CC12CCC3C4(C)C=CC(=O)C(C)(C)C4CC(O)C3(C)C2=CCC1c5ccoc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G12 compound treatment 321185.2861 -98700.0 -0.45 488655.2795 -199000.0 -1.06 -1.069 -0.9291 3558250 ACon1_001090 CC(C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H]2Oc3cc4oc(=O)ccc4cc3[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G13 compound treatment 260540.0 -159000.0 -0.73 467580.7453 -220000.0 -1.17 -1.3458 -0.975 3553160 ACon1_001091 C[C@H]1OC(=O)[C@@H](C)[C@@H]1C[C@@H](O)[C@](C)(O)[C@H]2CC[C@@]3(O)C4=CC(=O)[C@@H]5C[C@@H](O)[C@@H](O)C[C@]5(C)C4CC[C@]23C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G14 compound treatment 224824.2678 -195000.0 -0.9 408659.824 -279000.0 -1.48 -1.6832 -0.9714 3558272 ACon1_001092 C[C@H]1[C@H](C[C@H]2[C@@H]1[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(=O)O)OC(=O)/C=C/c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G15 compound treatment 324511.3924 -95300.0 -0.44 468917.4603 -219000.0 -1.16 -1.1321 -0.9116 3558437 ACon1_001093 CO[C@@H]1CC(OC2CCC3(C)C(CCC4(CCC(C5=CC(=O)OC5)C6(C)CCC34)C6=O)C2)O[C@H](C)[C@@H]1O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G16 compound treatment 249725.8772 -170000.0 -0.78 446849.3151 -241000.0 -1.28 -1.4588 -0.9725 3559145 ACon1_001094 CC(C)(O)CC(O)CC(C)(O)C1CCC2(O)C3=CC(=O)C4CC(O)C(O)CC4(C)C3CCC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G17 compound treatment 215787.4494 -204000.0 -0.94 537618.8679 -150000.0 -0.8 -1.229 -0.9966 3557962 ACon1_001095 OC[C@H]1O[C@@H](O[C@@H]2OC=CC3C(O)C=C(COC(=O)c4ccccc4)C32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G18 compound treatment 228711.4228 -191000.0 -0.88 551744.0945 -136000.0 -0.72 -1.1339 -0.9951 3558116 ACon1_001096 COc1c(O)c2c(=O)cc(oc2cc1O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G19 mock treatment 433268.4366 13400.0 0.06 766787.234 78900.0 0.42 0.3397 0.803 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G20 mock treatment 325101.0101 -94700.0 -0.44 637640.0 -50300.0 -0.27 -0.4974 -0.9719 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G21 compound treatment 247169.2308 -173000.0 -0.8 616791.3043 -71100.0 -0.38 -0.8297 -0.9417 3554700 ACon1_001097 COC(=O)c1cc(CO)cc(O)c1C(=O)c2c(O)cccc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G22 compound treatment 252953.9474 -167000.0 -0.77 615524.2718 -72400.0 -0.38 -0.8156 -0.9484 3558581 ACon1_001098 C[C@@]1(CCC[C@]2(C)C3CCC4CC3(CCC12)C=C4CO)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G23 compound treatment 457190.1141 37400.0 0.17 481354.7009 -207000.0 -1.1 -0.6528 -0.5887 3555287 ACon1_001099 COc1ccc2c(C=O)c(oc2c1)c3ccc(OC)c(O)c3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 G24 compound treatment 418746.9136 -1090.0 -0.01 284243.6975 -404000.0 -2.14 -1.5175 -0.7088 1787154 ACon1_001100 CC(=CCc1c(O)cc(O)c2C(=O)CC(Oc12)c3ccccc3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H01 compound treatment 814414.2857 395000.0 1.82 718427.9476 30500.0 0.16 1.4012 0.767 3558364 ACon1_001101 CCCCCOC(=O)c1ccccc1C(=O)OCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H02 compound treatment 698946.5021 279000.0 1.29 784700.9804 96800.0 0.51 1.2732 0.9188 3558698 ACon1_001102 CC(=O)OC/C=C(\CO)/CC/C=C(\C)/CC/C=C(\CC/C=C(\C)/COC(=O)C)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H03 mock treatment 591497.4359 172000.0 0.79 733711.3402 45800.0 0.24 0.7316 0.8835 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H04 mock treatment 649126.4368 229000.0 1.06 797645.4545 110000.0 0.58 1.1593 0.9604 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H05 compound treatment 648306.6038 228000.0 1.05 679542.8571 -8360.0 -0.04 0.7137 0.6768 3558811 ACon1_001103 COc1cc(/C=C/C=O)cc(OC)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H06 compound treatment 331395.8869 -88400.0 -0.41 448614.3791 -239000.0 -1.27 -1.1858 -0.8895 3559864 ACon1_001104 OC[C@H]1O[C@@H](O[C@@H]2OC=C3[C@@H](C[C@@H]4N(Cc5c4nc6ccccc6c5O)C3=O)[C@H]2C=C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H07 compound treatment 306346.6387 -113000.0 -0.52 591959.322 -95900.0 -0.51 -0.7299 -0.9999 3557308 ACon1_001105 CCCCCCCCC(C(O)CC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H08 compound treatment 324165.4676 -95700.0 -0.44 437360.3604 -251000.0 -1.33 -1.2516 -0.8939 1001923 ACon1_001106 O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H09 compound treatment 383044.6927 -36800.0 -0.17 360022.8013 -328000.0 -1.74 -1.3497 -0.7724 3557902 ACon1_001107 COc1cc(cc(OC)c1O)[C@H]2OC[C@@H]3[C@H](OC[C@H]23)c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H10 compound treatment 59242.8941 -361000.0 -1.66 169012.931 -519000.0 -2.75 -3.1219 -0.9709 3553984 ACon1_001108 Cc1cc(O)c(Cc2c(O)cc(C)c(C=O)c2O)c(O)c1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H11 compound treatment 367053.6913 -52800.0 -0.24 380747.8754 -307000.0 -1.63 -1.3241 -0.8038 3559002 ACon1_001109 Oc1ccc(CCCc2ccc3OCOc3c2)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H12 compound treatment 352773.0496 -67100.0 -0.31 419273.8095 -269000.0 -1.42 -1.2262 -0.841 3554509 ACon1_001110 CO[C@H]/1\C=C\[C@@](C)(O)/C=C/C(=O)O[C@H](C)[C@@H](C)CC\C=C1/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H13 compound treatment 233300.813 -187000.0 -0.86 432247.5884 -256000.0 -1.36 -1.5671 -0.9759 3559031 ACon1_001111 CC(C)(O)CCC(=O)[C@](C)(O)C1[C@H](O)C[C@@]2(C)C3CC=C4C(C[C@H](O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H14 compound treatment 123196.2366 -297000.0 -1.37 324985.5072 -363000.0 -1.92 -2.3284 -0.986 3554525 ACon1_001112 COC(=O)/C/1=C/CC[C@@]2(C)O[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](OC(=O)C(C)(O)CCl)C1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H15 compound treatment 263104.5131 -157000.0 -0.72 358122.9236 -330000.0 -1.75 -1.7479 -0.9236 3553997 ACon1_001113 Cc1cc(O)cc2oc3cc(O)cc(O)c3c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H16 compound treatment 214269.2308 -206000.0 -0.95 419949.5268 -268000.0 -1.42 -1.6753 -0.9806 1106761 ACon1_001114 COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C(C=C)C1CC3CC(=O)CC(CC(=O)CCc4ccc(O)cc4)O3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H17 compound treatment 385560.6061 -34300.0 -0.16 484543.9189 -203000.0 -1.08 -0.8745 -0.8022 3559112 ACon1_001115 C[C@@H]([C@H]1CC[C@](C)(O1)C=C)C(=O)/C=C/C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H18 compound treatment 298305.9548 -122000.0 -0.56 556327.7592 -132000.0 -0.7 -0.8898 -0.9941 3558839 ACon1_001116 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@]43C)C2[C@@H]1O)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H19 mock treatment 240183.2994 -180000.0 -0.83 593030.5677 -94900.0 -0.5 -0.9416 -0.9714 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H20 mock treatment 230708.5828 -189000.0 -0.87 589547.8261 -98400.0 -0.52 -0.9856 -0.9698 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H21 compound treatment 236994.3182 -183000.0 -0.84 547715.4812 -140000.0 -0.74 -1.122 -0.998 1111461 ACon1_001117 CC(=CCOc1c2occc2cc3ccc(=O)oc13)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H22 compound treatment 7580.0 -412000.0 -1.9 55181.8182 -633000.0 -3.36 -3.7173 -0.9638 3558469 ACon1_001118 OC(=O)c1c(O)cccc1CCCCCCC/C=C\C/C=C\CC=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H23 compound treatment 575015.2284 155000.0 0.72 579395.7447 -109000.0 -0.58 0.0991 0.1079 3559898 ACon1_001119 C[C@@H]1C(O)O[C@@H]2[C@H]1[C@@H](O)C[C@](C)(C=C)[C@H]2C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 H24 compound treatment 511850.8772 92000.0 0.42 531301.8018 -157000.0 -0.83 -0.2873 -0.308 3559171 ACon1_001120 OC[C@H]1O[C@@H](Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c4C(=O)C[C@@H](Oc4c2)c5ccc(O)cc5)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I01 compound treatment 58666.6667 -361000.0 -1.67 58063.8298 -630000.0 -3.34 -3.5399 -0.9483 3554132 ACon1_001121 CCC(C)C(=O)c1c(O)cc2OC(C)(C)C(CC=C(C)C)Cc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I02 compound treatment 52857.1429 -367000.0 -1.69 51785.7143 -636000.0 -3.37 -3.5824 -0.9491 3553195 ACon1_001122 CC(=CCc1c(oc2c(CC=C(C)C)c(O)cc(O)c2c1=O)c3ccc(O)cc3O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I03 compound treatment 653894.7368 234000.0 1.08 719000.0 31100.0 0.16 0.8799 0.8058 3559282 ACon1_001123 OC[C@H]1O[C@@H](Oc2ccc(CC=C)cc2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I04 compound treatment 788717.7033 369000.0 1.7 769161.1374 81300.0 0.43 1.5077 0.8591 3558801 ACon1_001124 C[C@H]1[C@H]2[C@H](OC1=O)[C@@H]3C(=C[C@@H](O)[C@@]3(C)O)[C@@](C)(O)C[C@@H]2OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I05 mock treatment 736115.3846 316000.0 1.46 708123.2227 20200.0 0.11 1.1072 0.7571 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I06 mock treatment 367966.8367 -51900.0 -0.24 704545.8937 16600.0 0.09 -0.1067 -0.4185 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I07 compound treatment 484520.9581 64700.0 0.3 462700.9646 -225000.0 -1.19 -0.6337 -0.5147 3474459 ACon1_001125 OCC1OC(Oc2cc(O)c3c(=O)cc(oc3c2)c4ccc(O)cc4)C(OC5OCC(O)(CO)C5O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I08 compound treatment 444620.4188 24800.0 0.11 594025.7143 -93900.0 -0.5 -0.2713 -0.531 3554178 ACon1_001126 CCC(CCCCC(=O)CCCCC1CCC(=O)O1)O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](OC(=O)/C=C/c4ccc(O)cc4)[C@H](OC(=O)C)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I09 compound treatment 224862.7451 -195000.0 -0.9 252222.2222 -436000.0 -2.31 -2.2698 -0.9154 3558998 ACon1_001127 CCCCCCC/C=C/C(=O)CCc1ccc(O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I10 compound treatment 287670.7317 -132000.0 -0.61 449005.277 -239000.0 -1.27 -1.327 -0.9437 3557509 ACon1_001128 OCC1OC(C(O)C(O)C1O)c2c(O)c(C3OCC(O)C(O)C3O)c(O)c4c(=O)cc(oc24)c5ccc(O)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I11 compound treatment 276756.3805 -143000.0 -0.66 323008.7977 -365000.0 -1.94 -1.8351 -0.8975 3558722 ACon1_001129 CC1OC(OCC2OC(OCCc3ccc(O)c(O)c3)C(OC(=O)C)C(OC4OC(C)C(O)C(O)C4O)C2OC(=O)/C=C/c5ccc(O)c(O)c5)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I12 compound treatment 369242.2062 -50600.0 -0.23 465160.8833 -223000.0 -1.18 -1.0004 -0.8307 3558629 ACon1_001130 OC[C@H]1O[C@@H](Oc2cc3occc3cc2CCC(=O)O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I13 compound treatment 386053.3643 -33800.0 -0.16 441790.8497 -246000.0 -1.31 -1.0332 -0.7859 3558785 ACon1_001131 CC1(C)C2CCC1(C)C(C2)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I14 compound treatment 244174.1803 -176000.0 -0.81 453913.9466 -234000.0 -1.24 -1.4504 -0.9786 3558926 ACon1_001132 Oc1ccc(/C=C/c2ccc(O)cc2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I15 compound treatment 261792.0 -158000.0 -0.73 448234.657 -240000.0 -1.27 -1.4142 -0.9651 3558862 ACon1_001133 CC1CCC2C1C(OC3OC(CO)C(O)C(O)C3O)OC=C2C(=O)OC4C5OC5(C)C6C(OC7OC(CO)C(OC(=O)/C(=C/CCC(C)(O)C=C)/C)C(O)C7O)OC=CC46O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I16 compound treatment 470732.5228 50900.0 0.23 481232.4841 -207000.0 -1.1 -0.6091 -0.5434 3558948 ACon1_001134 COc1cc(/C=C\C(=O)O)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I17 compound treatment 447135.5499 27300.0 0.13 486631.7365 -201000.0 -1.07 -0.6658 -0.6194 3557339 ACon1_001135 C[C@H]1OC(=O)c2c(O)ccc(O)c2[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I18 compound treatment 136723.8095 -283000.0 -1.31 331369.9422 -357000.0 -1.89 -2.2604 -0.9836 3557346 ACon1_001136 CC(C)CCCC/C=C\CCCCCCCC(=O)OCC(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I19 compound treatment 227132.9243 -193000.0 -0.89 555449.1525 -132000.0 -0.7 -1.1251 -0.9932 3557913 ACon1_001137 CC1OC(OC2C(O)C(O)COC2OC3C(O)C(O)C(OC3O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC=C7C8CC(C)(C)CC(O)[C@]8(C)CC[C@]76C)C4(C)C)C(=O)O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I20 compound treatment 312347.4388 -107000.0 -0.5 735218.1818 47300.0 0.25 -0.173 -0.3115 3558986 ACon1_001138 COc1cc(CCC(O)CC(O)CCc2ccc(O)c(OC)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I21 mock treatment 315415.1376 -104000.0 -0.48 650181.3472 -37700.0 -0.2 -0.482 -0.9243 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I22 mock treatment 277794.4573 -142000.0 -0.66 627280.0 -60600.0 -0.32 -0.6905 -0.9463 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I23 compound treatment 55311.1111 -365000.0 -1.68 59340.9091 -629000.0 -3.33 -3.5461 -0.9497 3554969 ACon1_001139 COc1cc(O)c(CC=C(C)C)cc1C(=O)/C=C/c2ccc(O)c(CC=C(C)C)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 I24 compound treatment 561518.3246 142000.0 0.65 595546.875 -92400.0 -0.49 0.1156 0.1416 3554553 ACon1_001140 COC(=O)[C@]1(C)CC[C@H](O)[C@@]2(C)C1C[C@@H](OC(=O)C)C3=C2[C@H](O)C[C@](C)(C=C)[C@@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J01 compound treatment 648664.9485 229000.0 1.06 624731.5789 -63200.0 -0.34 0.5093 0.46 3557527 ACon1_001141 OC[C@H]1O[C@@H](Oc2cc(O)c3C(=O)C[C@H](Oc3c2)c4ccc(O)c(O)c4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J02 compound treatment 642353.2609 223000.0 1.03 741823.2044 53900.0 0.29 0.9278 0.871 3558547 ACon1_001142 COc1ccc(cc1OC)[C@@H]2OC[C@@H]3[C@H](OC[C@H]23)c4ccc(O)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J03 compound treatment 737610.2564 318000.0 1.47 908783.5052 221000.0 1.17 1.8647 0.9938 3554707 ACon1_001143 COC(=O)c1cc(O)cc(OC)c1Oc2c(Cl)c(C)c(Cl)c(O)c2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J04 compound treatment 875086.9565 455000.0 2.1 960831.6327 273000.0 1.45 2.5082 0.9835 3559048 ACon1_001144 CC(C)(O)C(O)Cc1cc2ccc(=O)oc2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J05 mock treatment 465729.8137 45900.0 0.21 794433.1797 107000.0 0.57 0.5492 0.9102 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J06 mock treatment 502559.7668 82700.0 0.38 639935.0649 -48000.0 -0.25 0.0899 0.196 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J07 compound treatment 10128.0488 -410000.0 -1.89 17513.9665 -670000.0 -3.56 -3.8503 -0.9562 3559004 ACon1_001145 Oc1cc(O)c(C(=O)CCCCCCCCc2ccccc2)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J08 compound treatment 429283.3333 9450.0 0.04 424782.3344 -263000.0 -1.4 -0.956 -0.6847 3558537 ACon1_001146 C/C(=C\CC1C(=C)CCC2C(C)(CCCC12C)C(=O)O)/C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J09 compound treatment 286547.9167 -133000.0 -0.61 383290.5983 -305000.0 -1.62 -1.5771 -0.9123 3558931 ACon1_001147 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)cc3O[C@@H](CC(=O)c3c2O)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J10 compound treatment 229203.8627 -191000.0 -0.88 389274.0964 -299000.0 -1.58 -1.7416 -0.9614 3557887 ACon1_001148 COc1cc(ccc1O)C2OCC3C(OCC23)c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J11 compound treatment 320441.6136 -99400.0 -0.46 437052.1739 -251000.0 -1.33 -1.2649 -0.8989 3557666 ACon1_001149 CC(=O)OCC(Cc1ccccc1)NC(=O)C(Cc2ccccc2)NC(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J12 compound treatment 316000.0 -104000.0 -0.48 470851.0638 -217000.0 -1.15 -1.1526 -0.9244 3554146 ACon1_001150 CCC(C)C(=O)O[C@H]1CCC=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)O)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J13 compound treatment 278245.3988 -142000.0 -0.65 621726.8722 -66200.0 -0.35 -0.7099 -0.9576 3559043 ACon1_001151 CC(C)(O)C1CCC(C)(O1)C2[C@H](O)C[C@@]3(C)C4CC=C5C(C[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)C5(C)C)[C@]4(C)C(=O)C[C@]23C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J14 compound treatment 375183.0986 -44700.0 -0.21 596116.7315 -91800.0 -0.49 -0.4898 -0.9267 3557343 ACon1_001152 CCC/C=C\CC(N)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J15 compound treatment 396461.5385 -23400.0 -0.11 448192.1824 -240000.0 -1.27 -0.9752 -0.7643 3559081 ACon1_001153 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc3ccc(C=C)cc3)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J16 compound treatment 269606.4257 -150000.0 -0.69 560149.2537 -128000.0 -0.68 -0.969 -0.9999 3552097 ACon1_001154 C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2CO[C@@H](O)[C@]2(O)[C@@]3(C)CCCC(C)(C)[C@H]13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J17 compound treatment 343842.3237 -76000.0 -0.35 688906.25 1000.0 0.01 -0.244 -0.6963 3559133 ACon1_001155 OC1C(O)c2ccc(O)c(O)c2OC1c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J18 compound treatment 434161.4583 14300.0 0.07 584952.0 -103000.0 -0.55 -0.3394 -0.6171 3558873 ACon1_001156 O[C@H]1[C@@H](Oc2cc(O)cc(O)c2C1=O)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J19 compound treatment 418906.4039 -929.0 0.0 639313.9535 -48600.0 -0.26 -0.1853 -0.7188 3554748 ACon1_001157 COC1=CC(=O)O[C@@H](/C=C/c2ccccc2)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J20 compound treatment 433289.823 13500.0 0.06 606714.2857 -81200.0 -0.43 -0.2606 -0.599 3558844 ACon1_001158 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)[C@@H]2[C@@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J21 mock treatment 248923.7113 -171000.0 -0.79 549514.4928 -138000.0 -0.73 -1.0763 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J22 mock treatment 365678.4038 -54200.0 -0.25 511667.8967 -176000.0 -0.93 -0.8376 -0.8657 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J23 compound treatment 607760.0 188000.0 0.87 742781.6092 54900.0 0.29 0.8186 0.8954 3555129 ACon1_001159 COc1ccc(cc1)C2(O)C(O)C(=O)Nc3ccccc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 J24 compound treatment 523990.4306 104000.0 0.48 550205.4054 -138000.0 -0.73 -0.1768 -0.2022 3552652 ACon1_001160 C[C@@H]1C[C@H](O[C@@H]2O[C@@H](C)[C@H](O[C@@H]3O[C@H](COC(=O)C)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)[C@]4(C)[C@H](CCC=C4C)[C@@]1(C)CC[C@](C)(O[C@@H]5O[C@H](C)[C@H](O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@H](O)[C@H]5O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K01 compound treatment 659830.5085 240000.0 1.11 691376.8116 3480.0 0.02 0.7956 0.7188 3554770 ACon1_001161 COc1c(O)cc2C(Oc3cc4C(O)C(C)OC(=O)c4c(O)c3OC)C(C)OC(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K02 compound treatment 669739.1304 250000.0 1.15 698847.3684 10900.0 0.06 0.856 0.7418 3558741 ACon1_001162 C[C@@]1(CCC[C@]2(C)[C@@H](CCc3ccoc3)C(=C)CCC12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K03 compound treatment 681840.1639 262000.0 1.21 808046.9484 120000.0 0.64 1.305 0.9553 3558575 ACon1_001163 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@@]45CCC(C)(C)CC5C6=CCC7[C@@]8(C)CC[C@H](O[C@@H]9OC[C@H](O)[C@H](O)[C@H]9O[C@@H]%10O[C@@H](C)[C@H](O)[C@@H](O)[C@H]%10O)[C@@](C)(CO)C8CC[C@@]7(C)[C@]6(C)CC4)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K04 compound treatment 650498.008 231000.0 1.06 741232.3232 53300.0 0.28 0.9522 0.8651 3553892 ACon1_001164 CC1[C@@H]2CC[C@@]3(C)[C@H](O)C[C@H](O)C(=C)C3[C@H]2OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K05 compound treatment 312993.6441 -107000.0 -0.49 692579.5455 4680.0 0.02 -0.3309 -0.6706 3558807 ACon1_001165 C[C@H]1[C@@H]2CC/C(=C/C[C@H](O)/C(=C/[C@H]2OC1=O)/C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K06 compound treatment 410475.0594 -9360.0 -0.04 619228.6822 -68700.0 -0.36 -0.2881 -0.7854 3552732 ACon1_001166 C[C@@H]1N2[C@H]3N(C1=O)c4ccccc4[C@@]3(O)C[C@@H]5C(=O)N[C@]2(C)c6nc7ccccc7c(=O)n56 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K07 mock treatment 239097.3631 -181000.0 -0.83 551854.2373 -136000.0 -0.72 -1.0996 -0.9974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K08 mock treatment 361405.868 -58400.0 -0.27 523952.0958 -164000.0 -0.87 -0.8054 -0.8847 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K09 compound treatment 281239.8287 -139000.0 -0.64 472903.0303 -215000.0 -1.14 -1.2583 -0.9626 3558702 ACon1_001167 CC(=CCC/C(=C/CC/C(=C/CC\C(=C\COC(=O)C)\COC(=O)C)/C)/C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K10 compound treatment 333528.5714 -86300.0 -0.4 524252.3962 -164000.0 -0.87 -0.8952 -0.9375 3558881 ACon1_001168 COc1cc(ccc1O)[C@H]2Oc3c(cc(CCCO)cc3O)[C@@H]2CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K11 compound treatment 277016.5975 -143000.0 -0.66 514392.0973 -174000.0 -0.92 -1.1165 -0.9865 3558728 ACon1_001169 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c(C(=O)CCc4ccc(O)cc4)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K12 compound treatment 244450.0 -175000.0 -0.81 428503.2051 -259000.0 -1.38 -1.5448 -0.9679 3558883 ACon1_001170 COc1c(CCC(=O)O)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc3occc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K13 compound treatment 323500.0 -96300.0 -0.44 648337.037 -39600.0 -0.21 -0.4625 -0.9414 3558821 ACon1_001171 OCC1OC(OC2CC3C(C4OC(=O)C(=C)C4C(O)CC3=C)C2=C)C(O)C(OC(=O)/C=C/c5ccc(O)c(O)c5)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K14 compound treatment 478406.4039 58600.0 0.27 619175.0973 -68700.0 -0.36 -0.0668 -0.1472 3558928 ACon1_001172 CC(C)C1C(OC(=O)/C=C/c2ccccc2)C3OC1CC(C)(O)C(O)CCC3(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K15 mock treatment 338848.3412 -81000.0 -0.37 676772.2008 -11100.0 -0.06 -0.3058 -0.8088 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K16 mock treatment 234498.9154 -185000.0 -0.85 628399.1935 -59500.0 -0.32 -0.8275 -0.9083 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K17 compound treatment 348614.6572 -71200.0 -0.33 640307.3593 -47600.0 -0.25 -0.4107 -0.9915 3558508 ACon1_001173 CC(C)C(=O)O[C@@H]1[C@@H](OC(=O)C)[C@@H](OC(=O)C)C(C)(C)/C=C/C(C)C(=O)C2(O)C[C@@](C)(OC(=O)C)[C@H](OC(=O)C)C2[C@H]3OC(=O)CC[C@]31OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K18 compound treatment 289560.0 -130000.0 -0.6 657053.0303 -30800.0 -0.16 -0.5405 -0.8681 3558941 ACon1_001174 CC(C)CC(=O)c1c(O)cc(O)cc1OC2OC(COC(=O)c3cc(O)c(O)c(O)c3)C(O)C(O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K19 compound treatment 322315.508 -97500.0 -0.45 485193.2367 -203000.0 -1.08 -1.0783 -0.9252 3558693 ACon1_001175 COC(=O)/C/1=C/CC[C@@]2(C)O[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](OC(=O)C(C)(O)C(C)Cl)C1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K20 compound treatment 288400.8264 -131000.0 -0.61 635205.6738 -52700.0 -0.28 -0.6262 -0.9382 3558988 ACon1_001176 CCCCCC(O)CC(O)CCc1ccc(O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K21 compound treatment 263465.2087 -156000.0 -0.72 624351.7241 -63500.0 -0.34 -0.7483 -0.94 3559019 ACon1_001177 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]3[C@@H](O)[C@H](C)O[C@@H](O[C@@H]4[C@@H](O)[C@@H](O)CO[C@H]4O[C@H]5CC[C@@]6(C)C(CC[C@]7(C)C6CC=C8[C@@H]9CC(C)(C)CC[C@@]9(CC[C@]87C)C(=O)O)[C@]5(C)CO)[C@@H]3O)O[C@H](CO)[C@H]2O[C@@H]%10O[C@H](CO)[C@@H](O[C@@H]%11OC[C@@H](O)[C@H](O)[C@H]%11O)[C@H](O)[C@H]%10O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K22 compound treatment 328922.9025 -90900.0 -0.42 612024.4755 -75900.0 -0.4 -0.581 -0.9998 3559027 ACon1_001178 CC(=O)OC[C@]1(O)C[C@@]2(C[C@H]1CC[C@H]23)CC[C@@H]4[C@@](C)(CCC[C@@]34C)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K23 mock treatment 639050.4202 219000.0 1.01 675163.7931 -12700.0 -0.07 0.6671 0.6584 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 K24 mock treatment 647635.5556 228000.0 1.05 601828.1938 -86100.0 -0.46 0.42 0.3667 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L01 compound treatment 846659.5745 427000.0 1.97 873032.2581 185000.0 0.98 2.0862 0.9484 3554154 ACon1_001179 CCC(C)c1cnc(Cc2ccccc2)c(=O)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L02 compound treatment 700061.5385 280000.0 1.29 734925.1101 47000.0 0.25 1.0902 0.8283 3557616 ACon1_001180 COc1cc(cc(OC)c1O)C2C(COC3OCC(O)C(O)C3O)C(CO)Cc4cc(OC)c(O)c(OC)c24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L03 compound treatment 505444.4444 85600.0 0.39 873265.625 185000.0 0.98 0.9744 0.9197 3554516 ACon1_001181 CO[C@H]1C(=O)Nc2ccc(/C=C/C3(C)CCC(C)(C)CO3)c(O)c2[C@]1(O)c4ccc(OC)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L04 compound treatment 460264.9573 40400.0 0.19 842650.0 155000.0 0.82 0.7122 0.8462 3559072 ACon1_001182 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H](C)[C@@H](OC(=O)/C=C/c4ccc(O)cc4)[C@@H](O)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L05 compound treatment 364941.8838 -54900.0 -0.25 912081.6327 224000.0 1.19 0.6618 0.5444 3557828 ACon1_001183 Oc1ccc(CCCCC(=O)CCc2ccc(O)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L06 compound treatment 10155.0388 -410000.0 -1.89 58450.9804 -629000.0 -3.34 -3.6967 -0.9637 2095398 ACon1_001184 CC(=CCCC1(C)Oc2ccc3c4cc(C)c(O)cc4[nH]c3c2C=C1)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L07 mock treatment 519341.9355 99500.0 0.46 895568.2819 208000.0 1.1 1.1033 0.9247 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L08 mock treatment 313555.3047 -106000.0 -0.49 626795.082 -61100.0 -0.32 -0.5758 -0.9798 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L09 compound treatment 344270.1613 -75600.0 -0.35 642037.931 -45900.0 -0.24 -0.4184 -0.9846 3558935 ACon1_001185 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)[C@H](C[C@@]31O)OC(=O)/C=C/c4ccc(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L10 compound treatment 497296.9543 77500.0 0.36 709102.1277 21200.0 0.11 0.3321 0.8868 3558649 ACon1_001186 CC1=CCC2C(C)(C)CCC[C@]2(C)[C@]31CC[C@](C)(CC(=O)O)O3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L11 compound treatment 292425.8189 -127000.0 -0.59 525630.0 -162000.0 -0.86 -1.0241 -0.9827 3557542 ACon1_001187 Oc1ccc(cc1)C2CC(=O)c3c(O)cc(O)c(C4C(Oc5cc(O)cc(O)c5C4=O)c6ccc(O)c(O)c6)c3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L12 compound treatment 340644.1048 -79200.0 -0.37 704226.2295 16300.0 0.09 -0.197 -0.5249 3558613 ACon1_001188 OC[C@H]1O[C@@H](OCCc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L13 compound treatment 255942.1296 -164000.0 -0.76 766604.5455 78700.0 0.42 -0.2393 -0.2771 3558939 ACon1_001189 CC(=O)[C@@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L14 compound treatment 282446.4286 -137000.0 -0.63 709689.8396 21800.0 0.12 -0.3663 -0.5687 3558993 ACon1_001190 CCCCC/C=C/C(=O)CCc1ccc(O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L15 mock treatment 358426.8293 -61400.0 -0.28 669559.6708 -18300.0 -0.1 -0.269 -0.8985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L16 mock treatment 316997.7427 -103000.0 -0.47 626933.3333 -61000.0 -0.32 -0.564 -0.9826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L17 compound treatment 458430.4348 38600.0 0.18 715604.1667 27700.0 0.15 0.2298 0.9955 3559131 ACon1_001191 C[C@@]1(CCC[C@@]2(C)C3CCC4CC3(C[C@@]4(O)CO)CCC12)C(=O)O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L18 compound treatment 353276.7677 -66600.0 -0.31 599425.3968 -88500.0 -0.47 -0.5489 -0.9788 3559237 ACon1_001192 O[C@H]1[C@@H](Oc2c([C@H]3[C@@H](Oc4cc(O)cc(O)c4C3=O)c5ccc(O)cc5)c(O)cc(O)c2C1=O)c6ccc(O)cc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L19 compound treatment 200123.2558 -220000.0 -1.01 528410.8911 -159000.0 -0.85 -1.3146 -0.996 3559639 ACon1_001193 CC(=O)/C=C(\O)/C=C/c1ccc(O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L20 compound treatment 222841.4376 -197000.0 -0.91 539344.9782 -149000.0 -0.79 -1.1995 -0.9975 3554658 ACon1_001194 COC(=O)C1(Cc2ccc(O)c(CC=C(C)C)c2)OC(=O)C(=C1c3ccc(O)c(O)c3)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L21 compound treatment 284972.1116 -135000.0 -0.62 678069.7674 -9830.0 -0.05 -0.4767 -0.7637 3557983 ACon1_001195 CC1CCC2C1C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L22 compound treatment 350824.9497 -69000.0 -0.32 710860.5442 23000.0 0.12 -0.1389 -0.4077 3554257 ACon1_001196 CCCCC[C@@H]1OC2=C([C@H](O)[C@]1(C)O)C(=O)N(OC)C2=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L23 mock treatment 682356.0606 263000.0 1.21 603051.5873 -84800.0 -0.45 0.5378 0.4164 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 L24 mock treatment 664552.4862 245000.0 1.13 617435.4839 -70500.0 -0.37 0.5337 0.4489 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M01 compound treatment 607304.6875 187000.0 0.86 691254.9801 3350.0 0.02 0.6239 0.7215 2110684 ACon1_001197 COC(=O)[C@]12C(=O)C(C)C(=O)[C@]2(C)C(=C[C@@H]3[C@]1(C)CC[C@@H]4C(C)(C)[C@H](CC[C@]43C=O)OC(=O)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M02 compound treatment 608354.8387 189000.0 0.87 721211.1554 33300.0 0.18 0.7397 0.8338 3558775 ACon1_001198 C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C5C6CC(C)(C)CC[C@@]6(CC[C@]54C(=O)O)C(=O)O)C2(C)C)[C@H](O)[C@@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M03 compound treatment 468531.9767 48700.0 0.22 639622.549 -48300.0 -0.26 -0.0223 -0.0654 3557303 ACon1_001199 COc1cc(O)cc2CC(C)OC(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M04 compound treatment 431540.8451 11700.0 0.05 723029.1667 35100.0 0.19 0.1699 0.8759 3558815 ACon1_001200 C[C@@H]1O[C@@H](O[C@@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C5[C@@H]6CC(C)(C)CC[C@@]6(CC[C@]54C)C(=O)O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)[C@]2(C)CO)[C@H](O)[C@H](O[C@@H]9OC[C@@H](O)[C@H](O)[C@H]9O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M05 compound treatment 451991.6667 32200.0 0.15 710145.9459 22200.0 0.12 0.1883 0.9936 3553725 ACon1_001201 CC(CO)C(=O)O[C@H]1C/C(=C/CC/C(=C/[C@H]2OC(=O)C(CN3CCCC3C(=O)O)[C@@H]21)/CO)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M06 compound treatment 259473.9229 -160000.0 -0.74 744407.8947 56500.0 0.3 -0.311 -0.3897 3558829 ACon1_001202 CC1CCCC2=CC(OC2=O)C(C)(C)CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M07 compound treatment 478513.2275 58700.0 0.27 726942.4779 39000.0 0.21 0.3378 0.9913 3558899 ACon1_001203 CC(C)C(=O)OCC1(CO1)c2ccc(C)cc2OC(=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M08 compound treatment 330956.7198 -88900.0 -0.41 610063.745 -77800.0 -0.41 -0.5818 -1.0 3558868 ACon1_001204 CC(=O)CCCCCCCc1[nH]c2ccccc2c(=O)c1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M09 mock treatment 258541.841 -161000.0 -0.74 672846.1538 -15100.0 -0.08 -0.5824 -0.7785 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M10 mock treatment 328981.9005 -90900.0 -0.42 716582.6446 28700.0 0.15 -0.1887 -0.4233 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M11 compound treatment 8240.2827 -412000.0 -1.9 61325.5814 -627000.0 -3.32 -3.6921 -0.9647 3558753 ACon1_001205 CC(=CCc1c(oc2c3C=CC(C)(C)Oc3cc(O)c2c1=O)c4ccc(O)cc4O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M12 compound treatment 365675.6032 -54200.0 -0.25 613714.2857 -74200.0 -0.39 -0.4548 -0.9759 3558895 ACon1_001206 C[C@H]1O[C@@H](OC(C)(C)C2CCC(=CC2)C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M13 mock treatment 339148.7805 -80700.0 -0.37 695961.2676 8060.0 0.04 -0.2329 -0.6218 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M14 mock treatment 245087.5912 -175000.0 -0.81 594693.0693 -93200.0 -0.49 -0.9194 -0.9725 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M15 compound treatment 236716.3866 -183000.0 -0.84 675245.614 -12700.0 -0.07 -0.6446 -0.7609 3558864 ACon1_001207 C/C(=C\CC[C@@](C)(O)C=C)/C(=O)O[C@@H]1[C@@H]2O[C@]2(C)[C@H]3[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)OC=C[C@@]13OC(=O)\C(=C\CC[C@](C)(O)C=C)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M16 compound treatment 348136.9509 -71700.0 -0.33 678084.6154 -9820.0 -0.05 -0.2706 -0.8085 3558691 ACon1_001208 COC(=O)/C/1=C/CC[C@@]2(C)O[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](OC(=O)C(=C)CO)C1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M17 compound treatment 363434.7826 -56400.0 -0.26 582705.2239 -105000.0 -0.56 -0.5785 -0.9397 3558897 ACon1_001209 CC(C)C(=O)OCC(O)(COC(=O)C(C)C)c1ccc(C)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M18 compound treatment 385741.8478 -34100.0 -0.16 589042.0168 -98900.0 -0.52 -0.4819 -0.8804 3558942 ACon1_001210 CC1=CCC(CC1)C(C)(C)O[C@@H]2O[C@H](COC(=O)c3cc(O)c(O)c(O)c3)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M19 compound treatment 10142.4731 -410000.0 -1.89 53750.0 -634000.0 -3.36 -3.7144 -0.9628 3553659 ACon1_001211 CC(C)CCCC/C=C\CCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M20 compound treatment 441514.2857 21700.0 0.1 530571.885 -157000.0 -0.83 -0.5194 -0.618 3558700 ACon1_001212 CC(=O)OC/C=C(\C)/CC/C=C(\C)/C(C/C=C(\CC/C=C(\C)/COC(=O)C)/C(=O)O)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M21 compound treatment 239605.87 -180000.0 -0.83 653467.5926 -34400.0 -0.18 -0.7169 -0.8424 3614729 ACon1_001213 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](OC(=O)/C=C/c6ccc(O)cc6)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M22 compound treatment 12841.1215 -407000.0 -1.88 81125.0 -607000.0 -3.22 -3.6029 -0.967 3559009 ACon1_001214 CCCCCCCC/C=C\CCCCCCCc1cccc(O)c1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M23 compound treatment 484883.2117 65000.0 0.3 519733.871 -168000.0 -0.89 -0.4186 -0.4448 3558724 ACon1_001215 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCCc3ccc(O)c(O)c3)[C@H](OC(=O)C)[C@@H](O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H]2OC(=O)/C=C/c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 M24 compound treatment 452277.3109 32400.0 0.15 503180.6723 -185000.0 -0.98 -0.587 -0.5923 3558423 ACon1_001216 C[C@]1(CCC[C@@]2(C)C3CCC4CC3(CC4=C)CCC12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N01 compound treatment 807252.5253 387000.0 1.79 775351.9313 87500.0 0.46 1.5913 0.8621 1000005 ACon1_001217 CCCCCC(O)/C=C/C=C\CCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N02 compound treatment 910206.8966 490000.0 2.26 765810.9244 77900.0 0.41 1.8913 0.8227 2119184 ACon1_001218 CC(=CCC/C(=C/Cc1cc2ccc(=O)oc2cc1O)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N03 compound treatment 703414.557 284000.0 1.31 819907.4074 132000.0 0.7 1.4198 0.9571 3553469 ACon1_001219 CC(C)(O)C1=CC23CC[C@H]4[C@@](C)(CCC[C@]4(C)C3C[C@@H]1OO2)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N04 compound treatment 387012.2549 -32800.0 -0.15 821761.0619 134000.0 0.71 0.395 0.5441 3614731 ACon1_001220 CC1=C[C@@H](O)[C@H]2C(C)(C)CCC[C@]2(C)[C@@]1(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N05 compound treatment 346546.729 -73300.0 -0.34 874489.083 187000.0 0.99 0.4608 0.4406 3558777 ACon1_001221 C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C5C6CC(C)(C)CC[C@@]6(CC[C@]54C(=O)O)C(=O)O)C2(C)C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N06 compound treatment 307691.4153 -112000.0 -0.52 733238.806 45300.0 0.24 -0.1957 -0.3431 3559649 ACon1_001222 Oc1ccc(/C=C/C(=O)c2c(O)cc(O)cc2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N07 compound treatment 488969.863 69100.0 0.32 711739.9267 23800.0 0.13 0.3148 0.918 3553701 ACon1_001223 CC(CCC=C(C)C)C1CC(O)C(C)(O)C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N08 compound treatment 533902.2346 114000.0 0.53 796305.7851 108000.0 0.57 0.7785 0.999 3557653 ACon1_001224 OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N09 mock treatment 309251.1848 -111000.0 -0.51 738660.3774 50800.0 0.27 -0.1702 -0.2952 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N10 mock treatment 342140.2299 -77700.0 -0.36 742855.8559 55000.0 0.29 -0.0473 -0.1023 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N11 compound treatment 395399.4911 -24400.0 -0.11 697836.7347 9940.0 0.05 -0.0424 -0.341 3559029 ACon1_001225 CC(C)(O)CCC(=O)[C@](C)(O)C1[C@H](O)C[C@@]2(C)C3CC=C4C(C[C@H](O)[C@@H](O)C4(C)C)[C@]3(C)C(=O)C[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N12 compound treatment 320715.9353 -99100.0 -0.46 599888.8889 -88000.0 -0.47 -0.6533 -0.9999 1077975 ACon1_001226 COc1cc(CCC(=O)O)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N13 mock treatment 360567.9825 -59300.0 -0.27 679631.1111 -8270.0 -0.04 -0.2243 -0.8102 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N14 mock treatment 295432.3144 -124000.0 -0.57 606922.179 -81000.0 -0.43 -0.7094 -0.9898 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N15 compound treatment 784977.4436 365000.0 1.68 699780.6691 11900.0 0.06 1.2353 0.7331 2060475 ACon1_001227 COc1cc(OC)c2C(=O)CC(Oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N16 compound treatment 445181.4815 25300.0 0.12 565092.7152 -123000.0 -0.65 -0.3779 -0.5711 3558625 ACon1_001228 COc1c(O)cc(cc1O)c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N17 compound treatment 475299.1453 55500.0 0.26 621301.2048 -66600.0 -0.35 -0.0689 -0.158 3559125 ACon1_001229 COc1ccc(cc1OC)C2OCC3[C@@H](OCC23)c4ccc(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N18 compound treatment 506718.0451 86900.0 0.4 545822.7425 -142000.0 -0.75 -0.2495 -0.2924 3559207 ACon1_001230 CC1(C)C(O)CCC2(C)C3CCC4CC3(CCC12)C=C4CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N19 compound treatment 311294.702 -109000.0 -0.5 596603.3058 -91300.0 -0.48 -0.6964 -0.9999 3559663 ACon1_001231 CC(=CCc1c(O)cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c1O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N20 compound treatment 235280.8989 -185000.0 -0.85 443888.8889 -244000.0 -1.29 -1.517 -0.9793 3559567 ACon1_001232 COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H](CCc3ccoc3)C(=CC[C@@H]12)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N21 compound treatment 280369.6682 -139000.0 -0.64 564763.1579 -123000.0 -0.65 -0.9166 -1.0 3558313 ACon1_001233 COc1cc(/C=C/C(=O)NCCc2ccc(O)cc2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N22 compound treatment 266586.7769 -153000.0 -0.71 493391.8495 -195000.0 -1.03 -1.2292 -0.983 3554671 ACon1_001234 COC(=O)C1=C2C(Oc3cc(CO)cc(O)c3C2=O)C(O)C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N23 compound treatment 597360.3604 178000.0 0.82 671498.2332 -16400.0 -0.09 0.5174 0.6284 3558632 ACon1_001235 C/C=C(\C)/C(=O)OC(C)(C)C1Cc2cc3ccc(=O)oc3cc2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 N24 compound treatment 552992.3372 133000.0 0.61 545617.7606 -142000.0 -0.75 -0.0994 -0.1022 3559148 ACon1_001236 OCC1OC(Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)C(O[C@H]5OC[C@](O)(CO)[C@H]5O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O01 compound treatment 602333.3333 182000.0 0.84 587928.0303 -100000.0 -0.53 0.2202 0.2213 3559908 ACon1_001237 CC1(CO)Oc2cc(O)c3c(=O)c(coc3c2C=C1)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O02 compound treatment 750990.8257 331000.0 1.53 703767.7725 15900.0 0.08 1.1394 0.7449 3558779 ACon1_001238 C[C@H](C[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)C3CC[C@]12C)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O03 compound treatment 718556.6502 299000.0 1.38 689864.8649 1960.0 0.01 0.9815 0.7124 3553208 ACon1_001239 CC(=O)c1cc(C)c(O)c(COC2OC(CO)C(O)C(O)C2O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O04 compound treatment 743671.7172 324000.0 1.49 759853.0612 72000.0 0.38 1.3259 0.8602 3558817 ACon1_001240 C[C@@H]1O[C@@H](O[C@@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C5[C@@H]6CC(C)(C)CC[C@@]6(CC[C@]54C)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@]2(C)CO)[C@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O05 compound treatment 732874.3961 313000.0 1.44 791774.1935 104000.0 0.55 1.4104 0.9128 3558838 ACon1_001241 COc1cc(CCC(O)CC(=O)CCc2ccccc2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O06 compound treatment 591061.7761 171000.0 0.79 546596.7742 -141000.0 -0.75 0.0284 0.0261 3558830 ACon1_001242 CC(=O)OC1/C=C(/CCC=C(C)C(=O)C=CC1(C)C)\C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O07 compound treatment 672794.2584 253000.0 1.17 682946.5021 -4950.0 -0.03 0.8063 0.691 3554193 ACon1_001243 CCC[C@H]1C[C@H]2OC(=O)c3c(O)c(OC)c(OC)cc3[C@H]2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O08 compound treatment 706902.9536 287000.0 1.32 684875.0 -3030.0 -0.02 0.9248 0.6985 3558870 ACon1_001244 CC(=O)CCCCCCCc1cc(=O)c2ccccc2[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O09 compound treatment 578129.4643 158000.0 0.73 643298.8048 -44600.0 -0.24 0.3489 0.4547 3614735 ACon1_001245 OC[C@H]1O[C@@H](Oc2ccc(/C=C/c3cc(O)cc(O)c3)cc2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O10 compound treatment 480881.3559 61000.0 0.28 554173.0769 -134000.0 -0.71 -0.3025 -0.3964 3558880 ACon1_001246 CC1OC(OC2C(O)C(O)C(OC2Oc3cc(O)c4c(=O)cc(oc4c3)c5ccc(O)c(O)c5)C(=O)O)C(O)C(O)C1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O11 mock treatment 646234.5679 226000.0 1.04 669655.0218 -18200.0 -0.1 0.6698 0.6388 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O12 mock treatment 587368.8889 168000.0 0.77 689706.1404 1800.0 0.01 0.5531 0.7158 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O13 compound treatment 617484.3049 198000.0 0.91 738365.8537 50500.0 0.27 0.8338 0.8777 3558794 ACon1_001247 CCCCCCCCCCCC(O)CC(=O)OCC(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O14 compound treatment 638682.4034 219000.0 1.01 716182.2034 28300.0 0.15 0.8197 0.8034 3555946 ACon1_001248 OC1CCC(O)(C(=O)O)C1(O)C(=O)OCc2cc(O)ccc2OC3OC(COC(=O)c4ccccc4)C(O)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O15 compound treatment 653432.3308 234000.0 1.08 576462.0939 -111000.0 -0.59 0.3438 0.2798 3558871 ACon1_001249 CC(=O)c1c(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O16 compound treatment 441715.5172 21900.0 0.1 619787.4396 -68100.0 -0.36 -0.1841 -0.4908 3558697 ACon1_001250 COC(=O)/C/1=C/CC[C@@]2(C)O[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3[C@@H](OC(=O)/C(=C/C)/C)C1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O17 compound treatment 489276.8595 69400.0 0.32 598187.7395 -89700.0 -0.48 -0.11 -0.1918 3558900 ACon1_001251 CCC(C)C(=O)OCC1(CO1)c2ccc(C)cc2OC(=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O18 compound treatment 508717.3913 88900.0 0.41 676126.9231 -11800.0 -0.06 0.2457 0.5925 3557674 ACon1_001252 OC1COC(Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O19 compound treatment 518123.4568 98300.0 0.45 604990.3846 -82900.0 -0.44 0.0096 0.0151 3558944 ACon1_001253 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)[C@@H]2C1)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O20 compound treatment 605527.1318 186000.0 0.86 666169.9605 -21700.0 -0.12 0.524 0.6065 3559017 ACon1_001254 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)[C@@H]2C1)C(=O)O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O21 compound treatment 531606.5574 112000.0 0.52 596491.5254 -91400.0 -0.48 0.0216 0.0306 3555821 ACon1_001255 OC(=O)C(CCCCCCOC(=O)C(=O)OCCCCCCC(C(=O)O)C(=C)C(=O)O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O22 compound treatment 409803.2787 -10000.0 -0.05 416234.7826 -272000.0 -1.44 -1.0516 -0.7294 3559011 ACon1_001256 CCCCCCCCCC/C=C\CCCCCCCc1cccc(O)c1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O23 compound treatment 509463.8298 89600.0 0.41 576003.5587 -112000.0 -0.59 -0.1274 -0.1762 3558726 ACon1_001257 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2c3c(O)cc(O)c4c(=O)cc(oc34)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 O24 compound treatment 502848.5915 83000.0 0.38 612917.8082 -75000.0 -0.4 -0.0105 -0.0191 3557891 ACon1_001258 OC[C@H]1O[C@@H](Oc2cc(O)c3C(=O)CC(Oc3c2)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P01 compound treatment 596575.2212 177000.0 0.82 707628.4404 19700.0 0.1 0.6503 0.7914 1104287 ACon1_001259 CCCCCCCCCCCCCC1=C(O)C(=O)C=C(O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P02 compound treatment 759702.8986 340000.0 1.57 722154.3624 34300.0 0.18 1.2367 0.7838 3559023 ACon1_001260 CC(=C)C(=O)OC1CC(CO)CCC/C(=C/C2OC(=O)C(=C)C21)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P03 compound treatment 678432.2917 259000.0 1.19 614791.8367 -73100.0 -0.39 0.5691 0.4538 3558101 ACon1_001261 COc1ccc(C[C@H]2COC(=O)[C@@H]2Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P04 compound treatment 571654.6392 152000.0 0.7 593748.8987 -94200.0 -0.5 0.142 0.1651 3554885 ACon1_001262 COc1cc(ccc1O)C2Oc3c(C2CO)c(ccc3O)[C@@H]4Oc5cc(O)cc(O)c5C(=O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P05 compound treatment 666281.8182 246000.0 1.14 659859.6491 -28000.0 -0.15 0.6985 0.6094 1034727 ACon1_001263 COc1ccc(cc1)c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P06 compound treatment 629137.931 209000.0 0.97 662547.0085 -25400.0 -0.13 0.5874 0.6028 3559423 ACon1_001264 OCC(Cc1ccc2OCOc2c1)C(CO)Cc3ccc4OCOc4c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P07 compound treatment 679228.5714 259000.0 1.2 647141.0788 -40800.0 -0.22 0.693 0.5701 1096015 ACon1_001265 CC12CC(O)CC(C)(C)C2=CC(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P08 compound treatment 636371.5596 217000.0 1.0 630567.6692 -57300.0 -0.3 0.4911 0.4704 1115322 ACon1_001266 COc1ccn(C)c(=O)c1C#N 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P09 compound treatment 463635.468 43800.0 0.2 609045.8333 -78900.0 -0.42 -0.1529 -0.3292 3558968 ACon1_001267 O[C@@H]1Cc2c(O)cc3O[C@]4(Oc5cc(O)cc(O)c5[C@H]([C@H]4O)c3c2O[C@@H]1c6ccc(O)c(O)c6)c7ccc(O)cc7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P10 compound treatment 587791.5058 168000.0 0.77 592435.1852 -95500.0 -0.51 0.1896 0.2049 288 ACon1_001268 C[C@@H]1Cc2c(Cl)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P11 mock treatment 527524.3902 108000.0 0.5 603483.4123 -84400.0 -0.45 0.0346 0.0517 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P12 mock treatment 543049.1803 123000.0 0.57 608713.7809 -79200.0 -0.42 0.1048 0.1483 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P13 compound treatment 533061.2245 113000.0 0.52 539931.8182 -148000.0 -0.78 -0.1857 -0.197 3558980 ACon1_001269 C/C(=C\C(=O)O)/CCC1C(=C)CCC2C(C)(CO)CCCC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P14 compound treatment 288633.6634 -131000.0 -0.61 291971.4286 -396000.0 -2.1 -1.9128 -0.8752 3558996 ACon1_001270 CCCCCCCCC[C@@H](O)CC(=O)CCc1ccc(O)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P15 compound treatment 88622.2222 -331000.0 -1.53 61833.3333 -626000.0 -3.32 -3.4281 -0.9379 3555936 ACon1_001271 Oc1ccc(/C=C/c2cc3O[C@H]([C@@H](c3c(O)c2)c4cc5O[C@@H]([C@H](c5c(O)c4)c6cc(O)cc(O)c6)c7ccc(O)c(O)c7)c8ccc(O)cc8)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P16 compound treatment 559875.0 140000.0 0.65 593246.0317 -94700.0 -0.5 0.1017 0.1243 3559197 ACon1_001272 CO/C(=C\1/OC(=O)C=C1OC)/[C@@H]2O[C@H]2c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P17 compound treatment 595247.191 175000.0 0.81 516894.8949 -171000.0 -0.91 -0.0694 -0.0571 3559114 ACon1_001273 COc1ccc(cc1OC)[C@H]2OC[C@@H]3[C@H](OC[C@H]23)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P18 compound treatment 578928.934 159000.0 0.73 549167.8571 -139000.0 -0.74 -0.0015 -0.0015 1025510 ACon1_001274 COc1ccc(cc1OC)C2OCC3(O)C(OCC23)c4ccc(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P19 compound treatment 546511.5385 127000.0 0.58 604216.6065 -83700.0 -0.44 0.0992 0.1352 2141039 ACon1_001275 CO[C@H]1C[C@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)C6=CC(=O)OC6)O[C@H](C)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P20 compound treatment 528861.1111 109000.0 0.5 498565.9164 -189000.0 -1.0 -0.3546 -0.3157 3552212 ACon1_001276 C[C@@H]([C@@H]1CC[C@@](C)(O1)C=C)C(=O)CC=C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P21 compound treatment 441454.2254 21600.0 0.1 421710.9145 -266000.0 -1.41 -0.9278 -0.6555 3552101 ACon1_001277 C/C=C/C=C/C=C/C(=O)O[C@@H]1C=C2COC(=O)[C@]2(O)[C@@]3(C)CCCC(C)(C)[C@H]13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P22 compound treatment 305768.1159 -114000.0 -0.53 331363.6364 -357000.0 -1.89 -1.7092 -0.8707 3558924 ACon1_001278 CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@]43C)C12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P23 compound treatment 455719.1781 35900.0 0.17 481839.2283 -206000.0 -1.09 -0.6558 -0.5933 3557752 ACon1_001279 OCC1OC(Oc2cc(O)c3C(=O)C(O)C(Oc3c2)c4ccc(O)cc4)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2293 P24 compound treatment 511573.3333 91700.0 0.42 493252.8736 -195000.0 -1.03 -0.4309 -0.3862 1102176 ACon1_001280 COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C=CC3(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A01 compound treatment 750039.2157 30000.0 0.14 803995.3271 91800.0 0.49 0.4424 0.8736 3555976 ACon1_001281 ON1CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A02 compound treatment 600735.426 -119000.0 -0.55 567731.1828 -144000.0 -0.77 -0.9305 -0.9868 3557285 ACon1_001282 COC(=O)[C@]12Oc3cc(C)c(c(O)c3C(=O)C2=C(O)CC[C@@H]1O)c4ccc(O)c5C(=O)C6=C(O)C[C@H](C)[C@H](OC(=O)C)[C@@]6(Oc45)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A03 compound treatment 63068.1818 -657000.0 -3.03 63441.8605 -649000.0 -3.44 -4.5752 -0.998 3554124 ACon1_001283 CCC(C)[C@@H]1N(C)C(=O)[C@H](OC(=O)[C@H](C(C)CC)N(C)C(=O)[C@H](OC(=O)[C@H](C(C)CC)N(C)C(=O)[C@H](OC1=O)C(C)C)C(C)C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A04 compound treatment 853806.4516 134000.0 0.62 833469.697 121000.0 0.64 0.8913 0.9998 3558541 ACon1_001284 OC[C@H]1O[C@@H](O[C@@H]2OC=C3C(=O)OCC=C3[C@H]2C=C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A05 compound treatment 631411.3924 -88600.0 -0.41 625011.236 -87100.0 -0.46 -0.6157 -0.9981 3559091 ACon1_001285 OC1[C@H](OC(=O)c2cc(O)c(O)c(O)c2)OC3COC(=O)c4cc(O)c(O)c(O)c4-c5c(O)c(O)c(O)cc5C(=O)O[C@@H]1[C@@H]3OC(=O)c6cc(O)c(O)c(O)c6c7c(O)c(O)c(O)cc7C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A06 compound treatment 735555.0459 15600.0 0.07 636888.8889 -75300.0 -0.4 -0.2315 -0.5709 3559109 ACon1_001286 COc1c(O)c(O)cc2ccc3cccc(O)c3c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A07 compound treatment 780655.1724 60700.0 0.28 709994.9749 -2160.0 -0.01 0.1897 0.6776 3557604 ACon1_001287 COc1cc(O[C@@H]2O[C@H](COC3OCC(O)C(O)C3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A08 compound treatment 810689.8148 90700.0 0.42 871442.2111 159000.0 0.84 0.8932 0.9474 3559066 ACon1_001288 OC[C@H]1O[C@@H](Oc2ccc(COC(=O)CC(O)(CC(=O)OCc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3)C(=O)OCc5ccc(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)cc5)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A09 compound treatment 735868.1319 15900.0 0.07 827650.4854 116000.0 0.61 0.4849 0.786 3559055 ACon1_001289 C[C@@H]1O[C@@H](O[C@@H]2C=C(CO)[C@@H]3[C@H]2C=CO[C@H]3O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H](O)[C@H]1OC(=O)/C=C/c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A10 compound treatment 695790.4762 -24200.0 -0.11 741606.7416 29500.0 0.16 0.0315 0.1642 3559247 ACon1_001290 COc1c(C)c(O)c(C)c(O)c1C(=O)CCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A11 compound treatment 705284.9741 -14700.0 -0.07 734984.6154 22800.0 0.12 0.0377 0.2713 3552701 ACon1_001291 C[C@@H]1CC[C@]2(C)[C@@]3(C)CC[C@@]2(OC3=O)[C@]41C[C@@H](OC4=O)c5ccoc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A12 compound treatment 812366.1972 92400.0 0.43 876620.3704 164000.0 0.87 0.918 0.9457 3559273 ACon1_001292 COC(=O)[C@H](OC(=O)C)[C@H]1C(C)(C)C(=O)C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CC[C@@H](C3=C)[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A13 mock treatment 707169.1542 -12800.0 -0.06 613594.2857 -98600.0 -0.52 -0.4115 -0.7821 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A14 mock treatment 767230.7692 47200.0 0.22 779702.7027 67600.0 0.36 0.4074 0.9715 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A15 compound treatment 745388.6256 25400.0 0.12 805946.8599 93800.0 0.5 0.4346 0.8503 2097145 ACon1_001293 COc1c(ccc2Oc3c(O)cc(C)cc3COC(=O)c12)C(CC(C)C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A16 compound treatment 634341.2322 -85700.0 -0.4 625824.7863 -86300.0 -0.46 -0.6031 -0.9973 3559137 ACon1_001294 O=C(CCc1ccccc1)/C=C/CCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A17 compound treatment 745753.8462 25800.0 0.12 903581.2808 191000.0 1.02 0.8019 0.7845 3552685 ACon1_001295 C[C@@H]1CC(=O)C2=C(C1)C[C@@H](O)[C@]3(O)[C@@H](O)c4c(O)cccc4C(=O)C23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A18 compound treatment 679158.1633 -40800.0 -0.19 766676.1905 54500.0 0.29 0.0713 0.2067 3559173 ACon1_001296 COc1cc(OC)c(cc1OC)C(O)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A19 compound treatment 856819.9052 137000.0 0.63 786823.2323 74700.0 0.4 0.7262 0.9748 3189183 ACon1_001297 CN[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@H]1O[C@H]2[C@H](O[C@@H]3[C@@H](O)[C@H](O)[C@@H](NC(=N)N)[C@H](O)[C@H]3NC(=N)N)O[C@@H](C)[C@]2(O)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A20 compound treatment 708705.2023 -11300.0 -0.05 634405.5556 -77700.0 -0.41 -0.3284 -0.7901 3559107 ACon1_001298 CC1(C)[C@H](O)[C@H](O)C[C@]2(C)[C@H]3CCC(C)(C=C3CCC12)C(=O)CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A21 compound treatment 718492.6108 -1500.0 -0.01 675685.0829 -36500.0 -0.19 -0.1417 -0.732 3557672 ACon1_001299 OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4cc(O)c(O)c(O)c4)[C@H](O)[C@@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A22 compound treatment 675912.3711 -44100.0 -0.2 657191.1765 -55000.0 -0.29 -0.3499 -0.9845 3559201 ACon1_001300 COc1cc(cc(OC)c1OC)C2OCC3C(OCC23)c4cc(OC)c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A23 compound treatment 493520.2703 -226000.0 -1.04 385306.6667 -327000.0 -1.73 -1.9643 -0.9706 2089505 ACon1_001301 Cc1cc(O)cc2oc(=O)c3c(O)cc(O)cc3c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 A24 compound treatment 651784.6154 -68200.0 -0.31 784990.8676 72800.0 0.39 0.0508 0.1019 3557367 ACon1_001302 CC(=O)O[C@@H]1C[C@@]2(C)[C@]3(CO3)[C@@H]1O[C@@H]4C=C(C)C(O)C[C@@]42C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B01 compound treatment 774233.945 54200.0 0.25 816597.1564 104000.0 0.55 0.5686 0.9354 3553926 ACon1_001303 CC1=CC(=O)[C@H]2C(C)(C)CCC[C@]2(C)[C@@]1(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B02 compound treatment 143157.8947 -577000.0 -2.66 115381.8182 -597000.0 -3.17 -4.1192 -0.9963 3614774 ACon1_001304 CCCC(O)c1c(O)cccc1C(=O)CC(O)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B03 compound treatment 981445.0 261000.0 1.21 1082182.266 370000.0 1.96 2.2404 0.9726 3553162 ACon1_001305 C[C@H]1OC(=O)c2c(O)c(C(=O)O)c(O)c(C)c2[C@@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B04 compound treatment 746935.9606 26900.0 0.12 734755.7604 22600.0 0.12 0.1726 0.9998 3614776 ACon1_001306 COc1ccc(/C=C/c2cc(OC)cc3OC(C)(C)CCc23)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B05 compound treatment 459955.9471 -260000.0 -1.2 533772.093 -178000.0 -0.95 -1.517 -0.9931 3614779 ACon1_001307 C/C=C(/C)\C(=O)O[C@H]1[C@H](OC(=O)/C(=C\C)/C)[C@]2(CO)[C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](OC6OC(C(O)C(OC7OC(C)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C6O)C(=O)O)C(C)(C)C5CC[C@]43C)[C@@H]2CC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B06 compound treatment 805421.2963 85400.0 0.39 970577.4648 258000.0 1.37 1.2478 0.8749 1032451 ACon1_001308 CC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B07 compound treatment 678056.5217 -41900.0 -0.19 803558.0357 91400.0 0.48 0.2061 0.3948 3614784 ACon1_001309 CC(C)C1=C(O)C(=O)C2=C([C@@H](CC3C(C)(C)CCC[C@@]32CO)OC(=O)C)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B08 compound treatment 747968.0851 28000.0 0.13 781341.3462 69200.0 0.37 0.3507 0.9016 3614787 ACon1_001310 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(=O)C)[C@@H]1CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B09 compound treatment 866271.3568 146000.0 0.67 775809.0452 63700.0 0.34 0.7157 0.9488 3614791 ACon1_001311 CCC(C)CCC(O)C1=C(C)C(O)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B10 compound treatment 885041.2371 165000.0 0.76 782086.7347 69900.0 0.37 0.8005 0.9454 3554503 ACon1_001312 CO[C@@H]1[C@@H](O)[C@H](C)O[C@@H](O[C@H]2CC[C@@]3(C)[C@H](CCC4C3CC[C@]5(C)[C@@H](CC[C@]45O)C6=CC(=O)OC6)C2)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B11 compound treatment 875447.0046 155000.0 0.72 837698.4127 126000.0 0.67 0.9778 0.9993 3614794 ACon1_001313 COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)Oc3cc(C)c(C(=O)NC(C)C(=O)O)c(O)c3)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c2)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B12 compound treatment 923623.9316 204000.0 0.94 807555.0847 95400.0 0.51 1.0218 0.9579 3614796 ACon1_001314 COc1c(C)c(OC/C=C(\C)/C(=O)OCC(O)C(O)C(O)C(O)CO)cc(CO)c1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B13 mock treatment 722461.5385 2460.0 0.01 772211.6402 60100.0 0.32 0.2333 0.7319 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B14 mock treatment 727376.2887 7380.0 0.03 798668.4492 86500.0 0.46 0.3485 0.7575 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B15 compound treatment 1006985.849 287000.0 1.32 866139.1753 154000.0 0.82 1.5134 0.9731 3614799 ACon1_001315 C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(CO)[C@@H](CCC4C3CC[C@]5(C)[C@H](CC[C@]45O)C6=CC(=O)OC6)C2)[C@H](O)[C@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B16 compound treatment 831850.2415 112000.0 0.52 740138.0952 28000.0 0.15 0.4697 0.8751 3614803 ACon1_001316 CCN1C[C@]2(C)CC[C@H](OC)[C@]3([C@@H]4C[C@H]5[C@H](O)[C@@H]4[C@@](C[C@@H]5OC)(OC)C6[C@@H](O)C32)[C@@H]61 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B17 compound treatment 573800.8475 -146000.0 -0.67 440590.1639 -272000.0 -1.44 -1.4952 -0.9402 3614807 ACon1_001317 COc1cc(c(OC)c2oc3cc(O)c(O)cc3c12)c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B18 compound treatment 788426.4706 68400.0 0.32 728811.1111 16700.0 0.09 0.2856 0.8716 3614809 ACon1_001318 COc1ccc2nccc(C(O)C3CC4CC[N+]3([O-])CC4C=C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B19 compound treatment 811714.2857 91700.0 0.42 867534.5622 155000.0 0.82 0.8818 0.952 3614812 ACon1_001319 CC1OC(OC2CCC3(C)C(CCC4(C)C3CC=C5C6CC(C)(CCC6(CCC54C)C(=O)OC7OC(CO)C(O)C(O)C7O)C(=O)O)C2(C)CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B20 compound treatment 994932.2034 275000.0 1.27 800745.7627 88600.0 0.47 1.2288 0.9088 3614813 ACon1_001320 CCN1C[C@]2(COC)CC[C@H](O)[C@]3([C@@H]4C[C@H]5[C@H](OC)[C@@H]4[C@](O)(C[C@@H]5OC)[C@]6(O)CC32)[C@H]16 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B21 compound treatment 538904.0404 -181000.0 -0.84 656641.3043 -55500.0 -0.29 -0.7987 -0.902 3558920 ACon1_001321 Oc1cc(cc(O)c1O)C(=O)O[C@@H]2O[C@@H]3COC(=O)c4cc(O)c(O)c(O)c4-c5c(O)c(O)c(O)cc5C(=O)O[C@H]3[C@H](OC(=O)c6cc(O)c(O)c(O)c6)[C@H]2OC(=O)c7cc(O)c(O)c(O)c7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B22 compound treatment 747435.7798 27400.0 0.13 682049.5495 -30100.0 -0.16 -0.0234 -0.115 1099690 ACon1_001322 COC(=O)C12CC3CC(C(C)O)C2N(C3)CCc4c1[nH]c5ccc(OC)cc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B23 compound treatment 696521.3675 -23500.0 -0.11 699365.0794 -12800.0 -0.07 -0.1245 -0.9746 3614819 ACon1_001323 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@H](O)[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(=O)O)[C@@](C)(CO)C5CC[C@]43C)[C@@H]2C1)C(=O)O[C@@H]8OC[C@H](O[C@@H]9OC[C@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 B24 compound treatment 738041.6667 18000.0 0.08 698566.21 -13600.0 -0.07 0.0079 0.0717 3614822 ACon1_001324 COc1cc2CCN(C)C3(Cc4ccc5OCOc5c4C3O)c2cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C01 compound treatment 735981.9005 16000.0 0.07 593272.7273 -119000.0 -0.63 -0.3937 -0.6202 3180147 ACon1_001325 CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]4NCCc5cc(O)c(OC)cc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C02 compound treatment 108375.0 -612000.0 -2.82 60853.6585 -651000.0 -3.45 -4.4371 -0.9949 3558915 ACon1_001326 Oc1ccc(cc1)C2Oc3cc(O)cc(O)c3C(=O)C2C4C(Oc5cc(O)cc(O)c5C4=O)c6ccc(O)cc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C03 compound treatment 748480.198 28500.0 0.13 909246.696 197000.0 1.05 0.8321 0.7897 3559041 ACon1_001327 COc1ccc(/C=C/C(=O)O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C04 compound treatment 732945.3552 12900.0 0.06 869695.0 158000.0 0.84 0.6331 0.7557 3559084 ACon1_001328 OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)cc(O)c(C(=O)c3ccc(O)cc3)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C05 compound treatment 894331.7972 174000.0 0.8 859803.9216 148000.0 0.78 1.1223 0.9999 3554661 ACon1_001329 COC(=O)C1(Cc2ccc(O)cc2)OC(=O)C(=C1c3ccc(O)cc3)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C06 compound treatment 776638.0952 56600.0 0.26 881474.6544 169000.0 0.9 0.8197 0.8764 3558716 ACon1_001330 COc1cc(/C=C/c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)ccc1O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C07 compound treatment 815097.4359 95100.0 0.44 860853.4031 149000.0 0.79 0.8678 0.9616 3552084 ACon1_001331 C/C=C/C=C/C(=O)N1CC[C@]23[C@@H]1N4CC[C@]3([C@H]5Nc6ccccc62)c7c(cccc7[C@@H]4C8OC8(C)C)N5C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C08 compound treatment 610696.8085 -109000.0 -0.5 670712.766 -41400.0 -0.22 -0.5118 -0.9308 3559229 ACon1_001332 OC[C@H]1O[C@@H](Oc2ccc(cc2)c3cc(=O)c4c(O)cc(O)cc4o3)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C09 compound treatment 741957.9439 22000.0 0.1 874009.2166 162000.0 0.86 0.6787 0.7851 3559102 ACon1_001333 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C6C7CC(C)(C)CC[C@@]7(CC[C@]65C)C(=O)O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)C3(C)C)O[C@@H]([C@H]2O[C@@H]9OC[C@@H](O)[C@H](O)[C@H]9O)C(=O)O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C10 compound treatment 779956.5217 60000.0 0.28 775861.7512 63700.0 0.34 0.4345 0.995 3559180 ACon1_001334 C[C@@H]1O[C@@H](O[C@H]2[C@@H](O)[C@@H](C)O[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5C=CC7=C8CC(C)(C)CC[C@]8(CO)CC[C@]76C)[C@]4(C)CO)O[C@@H]3CO)[C@@H]2O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C11 mock treatment 861373.057 141000.0 0.65 839318.1818 127000.0 0.67 0.938 0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C12 mock treatment 821834.2246 102000.0 0.47 716306.5327 4160.0 0.02 0.3477 0.7395 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C13 compound treatment 962000.0 242000.0 1.12 807958.7629 95800.0 0.51 1.1485 0.9366 3558601 ACon1_001335 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@]43C)C2C1)C(=O)OC6OCC(OC7OCC(O)C(O)C7O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C14 compound treatment 718532.6633 -1460.0 -0.01 678437.5 -33700.0 -0.18 -0.1312 -0.7333 3557383 ACon1_001336 CO[C@H]1C(O[C@@H]2C[C@H]3O[C@@H]([C@@H](O)[C@H](OC(=O)/C(=C/C)/CO)[C@]3(O)O[C@H]12)C(=O)OC)n4cnc5c(N)ncnc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C15 mock treatment 798351.0638 78400.0 0.36 815571.4286 103000.0 0.55 0.6434 0.9795 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C16 mock treatment 701573.8397 -18400.0 -0.08 825324.1758 113000.0 0.6 0.3644 0.601 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C17 compound treatment 840136.3636 120000.0 0.55 767248.9451 55100.0 0.29 0.5984 0.9553 3555977 ACon1_001337 ON1CCCCCNC(=O)CCC(=O)N(O)CCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C18 compound treatment 914203.0457 194000.0 0.9 821733.6957 110000.0 0.58 1.0443 0.9781 3559187 ACon1_001338 CC(C)C[C@@](O)(CC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C19 compound treatment 889035.3982 169000.0 0.78 672330.3965 -39800.0 -0.21 0.4019 0.4976 3614831 ACon1_001339 C[C@H]1O[C@@H](OC/2C[C@@H]3O[C@@](O)(C[C@H](O)[C@H]3C(=O)O)C[C@@H](O)[C@H](O)CC[C@@H](O)C[C@@H](O)C[C@@H](O)CC(=O)O[C@@H](C)[C@H](C)[C@H](O)[C@@H](C)/C=C/C=C/CC\C=C\C=C\C=C\C=C2)[C@@H](O)[C@@H](N)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C20 compound treatment 812044.1989 92000.0 0.42 776655.7377 64500.0 0.34 0.5421 0.9943 3559183 ACon1_001340 COc1ccc(cc1)c2cc(=O)c3c(O)cc(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(=O)O)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C21 compound treatment 683821.8623 -36200.0 -0.17 775394.6188 63200.0 0.34 0.1192 0.3183 3558289 ACon1_001341 C[C@H]1[C@H]2[C@H](CC3C4C[C@@H](O)[C@H]5C[C@H](CC[C@]5(C)C4CC[C@]23C)O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H](O)[C@H]6O)O[C@@]%101CCC(C)CO%10 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C22 compound treatment 713892.8571 -6100.0 -0.03 726438.5965 14300.0 0.08 0.0337 0.4166 3559203 ACon1_001342 C[C@H]1[C@@H]2CC[C@]3(C)O[C@]4(C)C(O)[C@@H]5[C@H]6[C@H](C(=C7[C@@H]6C[C@@](C)(O)C[C@H]8[C@H](C)C(=O)O[C@@H]87)C)C4(C53)[C@H]2OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C23 compound treatment 743423.9631 23400.0 0.11 735741.3793 23600.0 0.13 0.1649 0.9973 3554240 ACon1_001343 CCCCC/C=C\C/C=C\C(O)CCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 C24 compound treatment 660548.7805 -59400.0 -0.27 695431.2796 -16700.0 -0.09 -0.2566 -0.8904 3555026 ACon1_001344 COc1cc2[C@@H]3CCN4CC=C[C@]56CC[C@H]3[C@]64N(C(=O)C5)c2cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D01 compound treatment 875975.2066 156000.0 0.72 747705.0 35600.0 0.19 0.642 0.8633 3553596 ACon1_001345 CC(C)C1NC(=O)/C(=C/c2c[nH]cn2)/NC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D02 compound treatment 480461.5385 -240000.0 -1.1 246937.5 -465000.0 -2.47 -2.5259 -0.9343 3614835 ACon1_001346 OCc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D03 compound treatment 733126.2626 13100.0 0.06 710530.303 -1620.0 -0.01 0.0367 0.6007 3559559 ACon1_001347 C[C@@H]1C2[C@@H](CC(C)C(=O)C/C=C(\C)/C[C@@H]2O)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D04 compound treatment 661633.8028 -58400.0 -0.27 986601.8957 274000.0 1.46 0.839 0.5668 3614837 ACon1_001348 C[C@H]1C2[C@H](CC3C4CC=C5C[C@@H](O)C[C@@H](O[C@@H]6OC[C@H](O)[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]8O[C@@H](C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]8OC(=O)C)[C@]5(C)C4CC[C@]23C)O[C@]91OCC(=C)[C@H](OC%10OC(C)C(O)C(O)C%10O)[C@@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D05 compound treatment 788254.5455 68300.0 0.31 605120.0 -107000.0 -0.57 -0.1788 -0.2755 3614840 ACon1_001349 OCc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D06 compound treatment 716946.0784 -3050.0 -0.01 500865.4971 -211000.0 -1.12 -0.8024 -0.7159 3614842 ACon1_001350 COc1cc(OC)c(CC=C(C)C)c(/C=C/c2ccc(OC)c(OC)c2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D07 compound treatment 748307.6923 28300.0 0.13 771557.8947 59400.0 0.32 0.3151 0.9239 1054271 ACon1_001351 COc1ccc(cc1O)c2cc(=O)c3c(O)c(OC)c(OC)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D08 compound treatment 663390.0 -56600.0 -0.26 804933.6493 92800.0 0.49 0.1634 0.2933 3614846 ACon1_001352 CC/C=C/c1ccc(C)cc1\C=C\CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D09 compound treatment 825750.0 106000.0 0.49 713191.3876 1040.0 0.01 0.3488 0.7151 3614849 ACon1_001353 OC[C@H]1O[C@@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D10 compound treatment 938636.7713 219000.0 1.01 791737.9679 79600.0 0.42 1.0115 0.9253 3614853 ACon1_001354 CCC(O)C(O)/C=C\C/C=C\CCCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D11 mock treatment 790666.6667 70700.0 0.33 729715.0838 17600.0 0.09 0.2963 0.8742 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D12 mock treatment 733909.0909 13900.0 0.06 757087.3786 44900.0 0.24 0.2139 0.8666 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D13 compound treatment 707592.7602 -12400.0 -0.06 627319.0476 -84800.0 -0.45 -0.3586 -0.7906 3614858 ACon1_001355 OC(=O)C(Cc1ccc(O)c(O)c1)OC(=O)C2C(C(C2c3ccc(O)c(O)c3)c4ccc(O)c(O)c4)C(=O)OC(Cc5ccc(O)c(O)c5)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D14 compound treatment 753931.7073 33900.0 0.16 803704.2254 91600.0 0.49 0.454 0.8899 3614860 ACon1_001356 OC/C=C\1/CN2CC[C@]34[C@@H]2C[C@@H]1[C@@H]5[C@@H]4N(C(=O)CC5O)c6ccccc63 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D15 mock treatment 874015.3061 154000.0 0.71 740051.5464 27900.0 0.15 0.6069 0.8365 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D16 mock treatment 722000.0 2000.0 0.01 686410.8108 -25700.0 -0.14 -0.09 -0.6578 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D17 compound treatment 725828.6853 5830.0 0.03 856416.2896 144000.0 0.77 0.5601 0.7315 3614863 ACon1_001357 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)C2C1)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D18 compound treatment 614389.7638 -106000.0 -0.49 712663.7168 513.0 0.0 -0.3425 -0.7031 1099692 ACon1_001358 CCC1C2N3CCC24C(=C(C1CC3)C(=O)OC)Nc5ccccc54 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D19 compound treatment 654187.5 -65800.0 -0.3 658724.8908 -53400.0 -0.28 -0.415 -0.9994 3614868 ACon1_001359 CCCCCCCCCC(O)C(C)C(O)C(CO)/C=C(\C)/C1=CC(=O)C(C)CO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D20 compound treatment 658529.9145 -61500.0 -0.28 797201.0309 85100.0 0.45 0.1185 0.2225 3614872 ACon1_001360 CCC1CC2CC3(C1N(CCc4c3[nH]c5ccc(OC)cc45)C2=O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D21 compound treatment 689850.3937 -30100.0 -0.14 673409.4488 -38700.0 -0.21 -0.2436 -0.9819 3614874 ACon1_001361 CC(C1CC(O)C(C)(C)O1)C2CC[C@@]3(C)C4CC[C@H]5C(C)C(CC[C@]65C[C@@]46CC[C@]23C)OC7OC(COC(=O)C)C(OC8OC(CO)C(OC9OC(CO)C(O)C(O)C9O)C(OC%10OC(C)C(O)C(O)C%10O)C8O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D22 compound treatment 651358.0786 -68600.0 -0.32 670285.7143 -41900.0 -0.22 -0.3808 -0.985 3614877 ACon1_001362 CC(C)C(NC=O)C(=O)N1CCC2Oc3ccc(/C=C\NC(=O)C(Cc4ccccc4)NC(=O)C21)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D23 compound treatment 616948.0519 -103000.0 -0.48 735731.7073 23600.0 0.13 -0.2476 -0.5038 3614881 ACon1_001363 CO[C@H]1[C@H](O)[C@@H](O)[C@H](OC2CC3C(=CC2(C)C=C)CCC4C(C)(C)C(CCC34C)O[C@@H]5O[C@@H](CO)[C@H](O)[C@H]5O)O[C@@H]1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 D24 compound treatment 581195.2381 -139000.0 -0.64 617974.2489 -94200.0 -0.5 -0.8058 -0.9925 3614885 ACon1_001364 COc1ccc2[nH]c3C4CC/5C(CO)C(Cc3c2c1)[N+]4([O-])C\C5=C\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E01 mock treatment 687144.9275 -32900.0 -0.15 613584.2697 -98600.0 -0.52 -0.4768 -0.876 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E02 mock treatment 709925.7426 -10100.0 -0.05 648165.7459 -64000.0 -0.34 -0.2728 -0.7965 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E03 compound treatment 725923.8095 5930.0 0.03 852523.8095 140000.0 0.74 0.5458 0.7326 3559005 ACon1_001365 CC1OC(O[C@H]2[C@@H](C)O[C@@H](OC(=O)[C@@]34CCC(C)(C)C[C@H]4C5=CCC6[C@@]7(C)CC[C@H](O[C@@H]8O[C@@H]([C@@H](O)[C@H](O[C@@H]9OC[C@@H](O)[C@H](O)[C@H]9O)[C@H]8O[C@@H]%10O[C@H](CO)[C@H](O)[C@H](O)[C@H]%10O)C(=O)O)[C@@](C)(C=O)C7CC[C@@]6(C)[C@]5(C)C[C@H]3O)[C@H](OC%11OC(CO)C(O)C(O)C%11O)[C@H]2O)C(O)C(O)C1OC%12OCC(O)C(O)C%12O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E04 compound treatment 806283.8428 86300.0 0.4 917576.9231 205000.0 1.09 1.0518 0.9068 3472823 ACon1_001366 COc1ccc(cc1)C(C)C(=O)c2ccc(O)cc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E05 compound treatment 66282.6087 -654000.0 -3.01 79953.4884 -632000.0 -3.35 -4.5028 -0.9986 3554702 ACon1_001367 COC(=O)c1cc(O)cc(O)c1C(=O)c2c(O)c(Cl)c(C)c(Cl)c2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E06 compound treatment 765294.1176 45300.0 0.21 866124.3523 154000.0 0.82 0.7252 0.8603 3559119 ACon1_001368 O[C@@H]1Cc2c(O)cc(O)cc2O[C@H]1c3cc(O)c(OC(=O)c4cc(O)c(O)c(O)c4)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E07 compound treatment 668411.7647 -51600.0 -0.24 745761.6279 33600.0 0.18 -0.0422 -0.1418 3558966 ACon1_001369 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O)[C@@](C)(C5CC[C@]43C)C(=O)O)C2[C@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E08 compound treatment 715838.1503 -4160.0 -0.02 710484.8485 -1670.0 -0.01 -0.0198 -0.9381 3559152 ACon1_001370 OC[C@H]1O[C@@H](Oc2ccccc2COC(=O)C3(O)C=CCCC3=O)[C@H](OC(=O)c4ccccc4)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E09 mock treatment 721710.2804 1710.0 0.01 796966.0194 84800.0 0.45 0.3237 0.7194 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E10 mock treatment 892000.0 172000.0 0.79 872251.3369 160000.0 0.85 1.1613 0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E11 compound treatment 853023.5849 133000.0 0.61 841480.198 129000.0 0.69 0.9188 0.9984 3554750 ACon1_001371 COC1=CC(=O)O[C@@H](CCc2ccc3OCOc3c2)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E12 compound treatment 589196.0784 -131000.0 -0.6 656100.5025 -56000.0 -0.3 -0.6367 -0.9469 3558916 ACon1_001372 CC1OC(OC2C(O)C(O)C(CO)OC2OC3C(O)C(O)C(OC3O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC=C7[C@@H]8CC(C)(C)C[C@@H](O)[C@]8(C)CC[C@]76C)C4(C)C)C(=O)O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E13 compound treatment 703441.048 -16600.0 -0.08 819345.6221 107000.0 0.57 0.348 0.6067 3555404 ACon1_001373 CON1c2ccccc2[C@@]3(C=C(O)C(=O)N4/C(=C/c5c[nH]cn5)/C(=O)N[C@]143)C(C)(C)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E14 compound treatment 932208.7379 212000.0 0.98 828701.6807 117000.0 0.62 1.1291 0.9755 3558010 ACon1_001374 COc1cc(ccc1O)c2oc3cc(O)cc(O)c3c(=O)c2OC4OC(CO)C(O)C(O)C4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E15 compound treatment 695800.995 -24200.0 -0.11 711388.6256 -762.0 0.0 -0.0818 -0.7322 3554188 ACon1_001375 CCC(O)CC1CCC(O1)C(C)C(=O)OC(CC)CC2CCC(O2)C(C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E16 compound treatment 809046.1538 89000.0 0.41 793013.4529 80900.0 0.43 0.5937 0.9998 3557363 ACon1_001376 CC1=CC2OC3[C@H](O)C[C@@](C)([C@@]43CO4)[C@@]2(CO)[C@H](O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E17 mock treatment 793355.9322 73400.0 0.34 726468.1818 14300.0 0.08 0.2929 0.8448 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E18 mock treatment 679629.2135 -40400.0 -0.19 770417.5824 58300.0 0.31 0.0869 0.2408 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E19 compound treatment 56275.0 -664000.0 -3.06 78512.1951 -634000.0 -3.36 -4.5408 -0.9989 1001646 ACon1_001377 CO[C@H]1C[C@H](O[C@H]2[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@@H]3OC(=O)C)N(C)C)[C@@H](C)C[C@]4(CO4)C(=O)[C@H](C)[C@@H](OC(=O)C)[C@@H](C)[C@@H](C)OC(=O)[C@@H]2C)O[C@@H](C)[C@@H]1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E20 compound treatment 613428.5714 -107000.0 -0.49 709707.8652 -2440.0 -0.01 -0.3567 -0.7255 3557369 ACon1_001378 CC1(C[C@@H](O)[C@H]2C3[C@H]1O)C2(C)CCC[C@]3(C)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E21 compound treatment 781786.2903 61800.0 0.28 746665.0718 34500.0 0.18 0.3309 0.9771 3553566 ACon1_001379 CC(C)c1cc2CCC3C(C)(COC(=O)C)C[C@H](O)C[C@]3(C)c2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E22 compound treatment 903372.807 183000.0 0.85 879376.2376 167000.0 0.89 1.2252 0.9997 3558597 ACon1_001380 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@]43C)C2C1)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E23 compound treatment 756662.6016 36700.0 0.17 700034.9345 -12100.0 -0.06 0.0741 0.4098 3553861 ACon1_001381 CC1(C)CCC[C@@]2(C)[C@H]1[C@H](O)C=C3COC(=O)[C@@]32O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 E24 compound treatment 843286.9955 123000.0 0.57 718229.5918 6080.0 0.03 0.4248 0.746 3557439 ACon1_001382 OC(=O)C[C@@H](NCCN[C@H](CC(=O)O)C(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F01 mock treatment 841788.5463 122000.0 0.56 671711.2299 -40400.0 -0.21 0.2455 0.4083 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F02 mock treatment 907111.1111 187000.0 0.86 806677.9661 94500.0 0.5 0.9647 0.9666 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F03 compound treatment 791521.9298 71500.0 0.33 809787.3303 97600.0 0.52 0.5994 0.9763 3559574 ACon1_001383 C[C@H]1CC[C@H](CC2=C(C)C(=O)C[C@@H]12)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F04 compound treatment 952115.7895 232000.0 1.07 843838.0952 132000.0 0.7 1.2508 0.9786 3614899 ACon1_001384 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC(=O)[C@@]34CCC(C)(C)C[C@H]4C5=CCC6[C@@]7(C)CC[C@H](O[C@@H]8O[C@@H]([C@@H](O)[C@H](O)[C@H]8O)C(=O)O)C(C)(C)C7CC[C@@]6(C)[C@]5(C)CC3)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F05 compound treatment 541752.8736 -178000.0 -0.82 523608.9385 -189000.0 -1.0 -1.2884 -0.9953 3614903 ACon1_001385 C/C=C(\C)/C(=O)OC1C(OC(=O)\C=C(\C)/CC(=O)O)C2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(C(O)C(OC7OC(C)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C6O)C(=O)O)C(C)(C)C5CCC43C)C2CC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F06 compound treatment 799618.2796 79600.0 0.37 796780.2198 84600.0 0.45 0.577 0.995 2119735 ACon1_001386 C[N+](C)(C)C(Cc1c[nH]c2ccccc12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F07 compound treatment 816104.3956 96100.0 0.44 880290.3226 168000.0 0.89 0.944 0.9479 3614907 ACon1_001387 CCCCCCCC(O)/C=C\C(O)CCC(O)CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F08 compound treatment 809715.1163 89700.0 0.41 793269.7095 81100.0 0.43 0.5968 0.9998 3614911 ACon1_001388 COc1cc(ccc1O)C2OCC3(OC4OC(CO)C(O)C(O)C4O)C(OCC23)c5ccc(O)c(OC)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F09 mock treatment 799526.3158 79500.0 0.37 866665.1163 155000.0 0.82 0.8388 0.9343 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F10 mock treatment 836523.3161 117000.0 0.54 751207.4468 39100.0 0.21 0.5265 0.9141 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F11 compound treatment 778126.1682 58100.0 0.27 769800.0 57600.0 0.31 0.4058 0.9978 3614913 ACon1_001389 CC1CC(=O)C2=C(O1)OC3(C)CCC4(O)C(C)(C)CCC(=O)C4(C)C3C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F12 compound treatment 747364.5833 27400.0 0.13 721428.5714 9280.0 0.05 0.124 0.9157 3614916 ACon1_001390 COC(=O)C[C@H]1/C(=C/C)/[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C1C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F13 compound treatment 672841.9244 -47200.0 -0.22 859690.9091 148000.0 0.78 0.3996 0.492 3614920 ACon1_001391 CC1(C)CCC[C@@]2(C)[C@H]1[C@H](O)C=C(CO)[C@]2(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F14 compound treatment 789861.2717 69900.0 0.32 763702.2222 51600.0 0.27 0.4212 0.9967 3614922 ACon1_001392 OC/C=C\1/CN2CCC3(C2CC1C4=CCC(=O)N5C43)c6ccccc56 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F15 compound treatment 732065.9341 12100.0 0.06 665562.2318 -46600.0 -0.25 -0.1354 -0.5345 3614924 ACon1_001393 CC(C)CCCCC(=O)OC1OC(CO)C(O)C2OCC(COC12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F16 compound treatment 85534.8837 -634000.0 -2.93 70866.6667 -641000.0 -3.4 -4.4741 -0.9972 1244529 ACon1_001394 CN1CCc2cc3OCOc3c4-c5ccccc5CC1c24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F17 mock treatment 729004.2735 9010.0 0.04 708942.2222 -3210.0 -0.02 0.0173 0.3863 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F18 mock treatment 731360.6557 11400.0 0.05 702463.9175 -9690.0 -0.05 7.0E-4 0.0099 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F19 compound treatment 790834.7458 70800.0 0.33 717793.2489 5640.0 0.03 0.2522 0.7687 3614927 ACon1_001395 COc1cc-2c(C[C@H]3COC(=O)[C@@H]3Cc4c(OC)c(OC)c(OC)cc42)c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F20 compound treatment 656912.844 -63100.0 -0.29 788049.1803 75900.0 0.4 0.0789 0.1589 3614931 ACon1_001396 CC(=O)N1CCC(CCC(=O)c2ccnc3ccccc23)C(C1)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F21 compound treatment 750158.7302 30200.0 0.14 668173.516 -44000.0 -0.23 -0.0666 -0.2452 3614932 ACon1_001397 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2OC3=C[C@@H]4C(=CC[C@H]5[C@]6(C)C[C@@H](O)[C@H]([C@@](C)(OC(=O)C)C(=O)/C=C/C(C)(C)O)[C@@]6(C)CC(=O)[C@]54C)C(C)(C)C3=O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F22 compound treatment 674153.4884 -45800.0 -0.21 731907.489 19800.0 0.1 -0.0754 -0.3195 3614935 ACon1_001398 CCN1C[C@]2(COC)CC[C@H](O)[C@]3(C4C[C@H]5[C@@H](OC(=O)C)C4[C@@](C[C@@H]5OC)(OC(=O)C)C6[C@H](OC)C32)[C@@H]61 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F23 compound treatment 595003.6364 -125000.0 -0.58 560590.0383 -152000.0 -0.8 -0.976 -0.9867 3554229 ACon1_001399 CCCc1c(C(=O)O)c(O)cc2C(=O)c3cccc(O)c3C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 F24 compound treatment 639810.8108 -80200.0 -0.37 566030.6513 -146000.0 -0.78 -0.8095 -0.9427 3614940 ACon1_001400 CN1CCc2cc3OCOc3cc2C4OC(O)c5c6OCOc6ccc5C41 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G01 compound treatment 679400.0 -40600.0 -0.19 739914.1631 27800.0 0.15 -0.0283 -0.1186 3554156 ACon1_001401 CCC(C)C1NC(=O)C(CCC(=O)O)N(C)C(=O)C(C(C)C)N(C)C(=O)CNC(=O)C2CCCN2C(=O)C(Cc3ccccc3)NC(=O)C(OC(=O)C(CCC(=O)O)N(C)C(=O)C(NC(=O)C4CCCCN4C1=O)C(C)C)C(C)CC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G02 compound treatment 564655.9633 -155000.0 -0.72 531321.7822 -181000.0 -0.96 -1.1848 -0.9897 3558958 ACon1_001402 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCCc3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2OC(=O)/C=C/c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G03 mock treatment 695266.0099 -24700.0 -0.11 662025.9067 -50100.0 -0.27 -0.2686 -0.9286 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G04 mock treatment 705145.8333 -14900.0 -0.07 743060.1852 30900.0 0.16 0.0675 0.3799 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G05 compound treatment 837933.6283 118000.0 0.54 702219.3878 -9930.0 -0.05 0.3473 0.6357 3557320 ACon1_001403 CN/1C(=O)c2ccccc2NC(=O)\C1=C/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G06 compound treatment 575557.377 -144000.0 -0.67 527165.9751 -185000.0 -0.98 -1.1648 -0.9822 3559121 ACon1_001404 O[C@@H]1Cc2c(O)cc(O)cc2O[C@H]1c3ccc(OC(=O)c4cc(O)c(O)c(O)c4)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G07 compound treatment 646241.206 -73800.0 -0.34 637995.5556 -74200.0 -0.39 -0.5186 -0.9974 3559035 ACon1_001405 OC[C@@]12O[C@H]2[C@@H](O)[C@@H]3C=CO[C@@H](O[C@@H]4O[C@H](COC(=O)/C=C/c5ccc(O)cc5)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G08 compound treatment 561734.5972 -158000.0 -0.73 585155.0802 -127000.0 -0.67 -0.9924 -0.9992 3559216 ACon1_001406 CC(=CCC/C(=C/Cc1cc(cc(CC=C(C)C)c1O)C(=O)O)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G09 compound treatment 661848.4848 -58100.0 -0.27 730352.381 18200.0 0.1 -0.1214 -0.4258 3559155 ACon1_001407 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)C[C@@H](O)[C@@]31O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G10 compound treatment 68476.1905 -652000.0 -3.0 75341.4634 -637000.0 -3.38 -4.5129 -0.9983 1089114 ACon1_001408 COc1cc(O)c(Cc2ccccc2O)c(O)c1C(=O)CCc3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G11 compound treatment 540663.1016 -179000.0 -0.83 622949.5413 -89200.0 -0.47 -0.9193 -0.9649 3553711 ACon1_001409 CC(CCCc1ccoc1)C2CC=C(CCC=C(C)C)C(=O)O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G12 compound treatment 606529.6296 -113000.0 -0.52 642185.4545 -70000.0 -0.37 -0.6324 -0.9858 3557253 ACon1_001410 CC(=CCC/C(=C/CC[C@]1(C)Oc2c3CNC(=O)c3cc(O)c2C[C@@H]1O)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G13 compound treatment 621827.8689 -98200.0 -0.45 610549.2228 -102000.0 -0.54 -0.7012 -0.9962 3554972 ACon1_001411 COc1cc(O)c(CCO)c2O[C@H](C)CC(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G14 compound treatment 583868.2927 -136000.0 -0.63 713372.1973 1220.0 0.01 -0.4393 -0.6998 3557300 ACon1_001412 CC(O)CC1CCC(O1)C(C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G15 compound treatment 609415.8879 -111000.0 -0.51 598298.4496 -114000.0 -0.6 -0.7876 -0.9965 3553811 ACon1_001413 CC[C@H](O)C[C@@H]1CC[C@@H](O1)[C@@H](C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G16 compound treatment 561494.382 -159000.0 -0.73 580041.0959 -132000.0 -0.7 -1.0123 -0.9998 3558027 ACon1_001414 C[C@@H]1O[C@@H](O[C@@H]2C=C(CO)[C@@H]3[C@H]2C=CO[C@H]3O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](OC(=O)/C=C/c5ccc(O)cc5)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G17 compound treatment 750764.7059 30800.0 0.14 724543.956 12400.0 0.07 0.1468 0.9388 3553505 ACon1_001415 CC(C)[C@H]1OC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](OC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](OC(=O)[C@H](C(C)C)N(C)C1=O)C(C)C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G18 compound treatment 581469.697 -139000.0 -0.64 695944.664 -16200.0 -0.09 -0.5125 -0.7951 3557922 ACon1_001416 CC(=O)OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G19 mock treatment 666123.8938 -53900.0 -0.25 589480.6202 -123000.0 -0.65 -0.6357 -0.9128 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G20 mock treatment 625143.5644 -94900.0 -0.44 598391.5344 -114000.0 -0.6 -0.736 -0.9875 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G21 compound treatment 613427.8351 -107000.0 -0.49 647954.3147 -64200.0 -0.34 -0.5883 -0.9839 3552815 ACon1_001417 C[C@]1(C[C@]2(O)O[C@@H]3O1)[C@]4(C[C@@H]2[C@@]34COC(=O)c5ccccc5)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G22 compound treatment 670440.5941 -49600.0 -0.23 613760.0 -98400.0 -0.52 -0.5306 -0.9314 1109010 ACon1_001418 COc1cc(cc2OCOc21)C3OCC4C(OCC34)c5cc(OC)c(OC)c(OC)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G23 compound treatment 684162.5616 -35800.0 -0.17 570125.0 -142000.0 -0.75 -0.6495 -0.8422 3557629 ACon1_001419 COc1cc(ccc1O)c2oc3cc(O)cc(O)c3c(=O)c2OC4OC(CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)C(O)C(O)C4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 G24 compound treatment 742559.6708 22600.0 0.1 623955.8233 -88200.0 -0.47 -0.2572 -0.5367 3553937 ACon1_001420 CC1=CC(=O)C2C(C)(C)C(O)CCC2(C)C1(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H01 compound treatment 878694.4444 159000.0 0.73 827701.4925 116000.0 0.61 0.9509 0.9961 3555028 ACon1_001421 COc1cc2C(O)CCC(=O)c2c(O)c1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H02 compound treatment 708771.0843 -11200.0 -0.05 650531.4286 -61600.0 -0.33 -0.2677 -0.809 3614951 ACon1_001422 Cc1cc(O)c2C(=O)C3=C(C(O)C(O)C(O)C3O)C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H03 mock treatment 837672.9858 118000.0 0.54 679026.3158 -33100.0 -0.18 0.2595 0.4549 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H04 mock treatment 810196.1722 90200.0 0.42 783787.4396 71600.0 0.38 0.5628 0.999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H05 compound treatment 654931.0345 -65100.0 -0.3 666525.4237 -45600.0 -0.24 -0.3833 -0.9943 1074963 ACon1_001423 Cc1cc(O)c2C(=O)C3=C(O)C4C(O)C5C6C(O)C(C(=C7C(=O)c8c(O)cc(C)cc8C(=O)C647)O)C53C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H06 compound treatment 824919.0141 105000.0 0.48 969763.4855 258000.0 1.37 1.3083 0.9026 3614955 ACon1_001424 CCCCCC(CC(O)CC(=O)OC(CCCCC)CC(CC(=O)O)OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)OC3OC(CO)C(O)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H07 compound treatment 738139.1304 18100.0 0.08 725752.0325 13600.0 0.07 0.1102 0.9973 3614956 ACon1_001425 C[C@H]1OC(=O)[C@@]2(C(=C)[C@]3(C)C[C@@H]4C(=C)[C@]5(CC[C@]42C)C=CC(=O)OC5(C)C)[C@@]1(O)C3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H08 compound treatment 569211.8227 -151000.0 -0.7 635180.6167 -77000.0 -0.41 -0.7804 -0.9678 3614960 ACon1_001426 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4C(=O)CC(Oc4c3)c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H09 compound treatment 696930.8756 -23100.0 -0.11 585234.2657 -127000.0 -0.67 -0.5512 -0.8088 3614965 ACon1_001427 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2OC(=O)[C@@]34CCC(C)(C)C[C@H]4C5=CCC6[C@@]7(C)CC[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)C(C)(C)C7CC[C@@]6(C)[C@]5(C)C[C@H]3O)[C@H](O)[C@H](O[C@@H]9OC[C@H](O)[C@H](O)[C@H]9O)[C@H]1O[C@@H]%10OC[C@@H](O)[C@H](O[C@@H]%11OC[C@H](O)[C@H](O)[C@H]%11O)[C@H]%10O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H10 compound treatment 689326.8293 -30700.0 -0.14 686061.674 -26100.0 -0.14 -0.1979 -0.9999 3614969 ACon1_001428 C[C@H]1OC(=O)CC[C@@H](O)/C=C/[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H11 compound treatment 75152.1739 -645000.0 -2.97 71117.6471 -641000.0 -3.4 -4.507 -0.9978 3614972 ACon1_001429 COc1cc(ccc1O)C2OC(c3ccc(O)c(OC)c3)C(C)(O)C2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H12 compound treatment 706230.7692 -13800.0 -0.06 663341.1215 -48800.0 -0.26 -0.228 -0.8552 3614974 ACon1_001430 C[C@@H]1CCC2C(C)(C)[C@H](OC(=O)C)[C@@H](O)C[C@]2(C)C31Cc4c(O3)c5CN([C@@H](CCC(=O)O)C(=O)O)C(=O)c5cc4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H13 compound treatment 486725.4902 -233000.0 -1.08 539447.9167 -173000.0 -0.92 -1.4084 -0.9968 3559258 ACon1_001431 CC1OC(OC2C(O)C(CO)OC(O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C6C7CC(C)(C)CC[C@@]7(CC[C@]65C)C(=O)OC8OCC(OC9OCC(O)C(O)C9O)C(O)C8O)C3(C)C)C2O)C(O)C(OC%10OCC(O)(CO)C%10O)C1OC%11OCC(O)(CO)C%11O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H14 compound treatment 597707.6023 -122000.0 -0.56 587750.0 -124000.0 -0.66 -0.8653 -0.9969 3614977 ACon1_001432 COc1cc2N3C4C5C(CC3=O)OCC=C6CN(C)CCC4(C(=O)CC56)c2cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H15 compound treatment 542720.8481 -177000.0 -0.82 508182.5397 -204000.0 -1.08 -1.3431 -0.9905 3614978 ACon1_001433 CC1CC(=O)C2=C(O1)OC3(C)CCC4C(C)(C)C(O)CC(O)C4(C)C3C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H16 compound treatment 516479.3103 -204000.0 -0.94 632252.7881 -79900.0 -0.42 -0.9633 -0.9354 3614980 ACon1_001434 OC(C1CC2CC[N+]1([O-])CC2C=C)c3ccnc4ccccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H17 compound treatment 627195.0207 -92800.0 -0.43 547836.7347 -164000.0 -0.87 -0.9189 -0.9464 3614982 ACon1_001435 CC1OC(OC2C(O)C(OC3OC(C)C(OC(=O)C)C(O)C3O)C(CO)OC2OC(=O)[C@@]45CCC(C)(C)CC5C6=CCC7[C@@]8(C)CC[C@H](OC9OC(CO)C(OC%10OC(CO)C(OC%11OCC(O)C(O)C%11O)C(O)C%10O)C(O)C9O)[C@@](C)(CO)C8CC[C@@]7(C)[C@]6(C)CC4)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H18 compound treatment 596661.2903 -123000.0 -0.57 614988.0478 -97200.0 -0.52 -0.7666 -0.9988 3614986 ACon1_001436 C=CC1CN(CCC1CCC(=O)c2ccnc3ccccc23)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H19 mock treatment 707088.5609 -12900.0 -0.06 588371.0407 -124000.0 -0.66 -0.5063 -0.7681 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H20 mock treatment 535675.2137 -184000.0 -0.85 642056.4103 -70100.0 -0.37 -0.8639 -0.9312 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H21 compound treatment 482992.9577 -237000.0 -1.09 501509.1575 -211000.0 -1.12 -1.5629 -0.9999 3614988 ACon1_001437 OC[C@H]1O[C@@H](Oc2c(O)cccc2COC(=O)C3(O)C4C=CC(C3=O)c5ccc(O)c(O)c45)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H22 compound treatment 588250.0 -132000.0 -0.61 574184.7826 -138000.0 -0.73 -0.9471 -0.9957 3614991 ACon1_001438 C=Cc1cncc2c(=O)n3CCc4c([nH]c5ccccc45)-c3cc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H23 compound treatment 603000.0 -117000.0 -0.54 574475.6098 -138000.0 -0.73 -0.8979 -0.9889 3614994 ACon1_001439 CC1OC(O[C@H]2[C@@H](O)C[C@]3(C)C4CC=C5[C@@H]6CC(C)(C)CC[C@@]6(CC[C@@]5(C)[C@]4(C)C[C@@H](O)C3[C@]2(C)CO)C(=O)OC7OC(C)C(OC8OCC(OC9OCC(O)C(OC%10OCC(O)C(O)C%10O)C9O)C(O)C8O)C(O)C7O)C(O)C(OC%11OC(CO)C(O)C(O)C%11O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 H24 compound treatment 572602.5641 -147000.0 -0.68 559721.393 -152000.0 -0.81 -1.0523 -0.9963 3614997 ACon1_001440 CN1Cc2cc3OCOc3cc2CCC(=O)c4cc5OCOc5cc4C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I01 compound treatment 659783.6735 -60200.0 -0.28 639696.8326 -72500.0 -0.38 -0.4681 -0.9873 3552717 ACon1_001441 C[C@@H]1CCC2C(C)(C)[C@H](O)CC[C@]2(C)[C@]31Cc4c(O3)c5CN([C@@H](CCC(=O)O)C(=O)O)C(=O)c5cc4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I02 compound treatment 675208.1218 -44800.0 -0.21 649450.2618 -62700.0 -0.33 -0.3812 -0.9738 3559086 ACon1_001442 COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C(O)CC3(C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I03 compound treatment 733066.6667 13100.0 0.06 717596.6851 5450.0 0.03 0.063 0.9433 3559083 ACon1_001443 OCC1OC(OC2C(O)C(O)C(CO)OC2Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)cc5)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I04 compound treatment 768436.3636 48400.0 0.22 648250.0 -63900.0 -0.34 -0.0817 -0.2013 3559093 ACon1_001444 COc1cc(ccc1O)[C@@H]2[C@@H](CO)[C@](O)(CO)Cc3cc(OC)c(O)cc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I05 mock treatment 695183.8565 -24800.0 -0.11 880106.599 168000.0 0.89 0.549 0.6113 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I06 mock treatment 720807.6923 810.0 0.0 761690.0 49500.0 0.26 0.1884 0.7171 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I07 compound treatment 299414.966 -421000.0 -1.94 62761.9048 -649000.0 -3.44 -3.807 -0.9631 3558957 ACon1_001445 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)[C@@H]2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I08 compound treatment 418956.1404 -301000.0 -1.39 454081.3953 -258000.0 -1.37 -1.9496 -1.0 3557372 ACon1_001446 CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@]1(C)CCC3[C@@]4(C)CC[C@H](O)C[C@]54OO[C@@]23C=C5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I09 compound treatment 697454.1063 -22500.0 -0.1 656237.069 -55900.0 -0.3 -0.2832 -0.9012 3615002 ACon1_001447 C[C@H]1[C@H]2[C@H](CC3[C@@H]4CC=C5C[C@H](CC[C@]5(C)C4CC[C@]23C)O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@H]8O)O[C@@]%101CC[C@@](C)(CO[C@@H]%11O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%11O)O%10 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I10 compound treatment 697436.2745 -22600.0 -0.1 612850.5155 -99300.0 -0.53 -0.446 -0.8307 3558208 ACon1_001448 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](C)O[C@H](O[C@@H]3C4O[C@]4(CO)C5C3C=CO[C@H]5O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6O)[C@H]2OC(=O)C)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I11 compound treatment 516380.4878 -204000.0 -0.94 611242.7746 -101000.0 -0.54 -1.0424 -0.9645 3553143 ACon1_001449 C[C@H]1CC[C@H]2O[C@]23C(=O)c4occ(C)c4[C@@H](OC(=O)C)[C@]13C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I12 compound treatment 559363.1579 -161000.0 -0.74 618836.2832 -93300.0 -0.49 -0.8738 -0.9808 3557701 ACon1_001450 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I13 compound treatment 553204.7619 -167000.0 -0.77 635843.318 -76300.0 -0.4 -0.8301 -0.955 3552066 ACon1_001451 C/C=C/C=C/C(=C/1\[C@@H]2[C@@H]([C@@H](C(=O)\C=C\C=C\C)[C@](C)(C1=O)C(=O)C2(C)O)[C@]3(C)OC(=O)C(=C3O)C)/O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I14 compound treatment 596463.035 -124000.0 -0.57 656205.7416 -55900.0 -0.3 -0.6127 -0.9538 3558037 ACon1_001452 OC[C@H]1O[C@@H](Oc2ccccc2COC(=O)c3c(O)cccc3O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I15 compound treatment 601941.6667 -118000.0 -0.54 609787.234 -102000.0 -0.54 -0.7689 -1.0 3555441 ACon1_001453 CSCC1OC(C(O)C1O)n2cnc3c(=O)[nH]cnc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I16 compound treatment 677433.5664 -42600.0 -0.2 649539.1705 -62600.0 -0.33 -0.3736 -0.9685 3557495 ACon1_001454 CC1OC(OCC2OC(Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)cc5)C(O)C(O)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I17 compound treatment 344743.4783 -375000.0 -1.73 552239.819 -160000.0 -0.85 -1.8234 -0.9461 3555348 ACon1_001455 COc1nc(C/C=C(\C)/C\C=C\C(=C\[C@@H](C)[C@@H](O)\C(=C\C)\C)\C)c(C)c(O)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I18 compound treatment 604265.7658 -116000.0 -0.53 716045.0 3890.0 0.02 -0.3628 -0.6792 3559191 ACon1_001456 CC(C)C[C@@](O)([C@H](O)C(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)C(=O)OCc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I19 compound treatment 619072.7273 -101000.0 -0.47 571057.0175 -141000.0 -0.75 -0.8583 -0.9739 3555032 ACon1_001457 COc1cc2nc3occc3c(OC)c2cc1OCC(OC(=O)C)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I20 compound treatment 714680.4124 -5320.0 -0.02 624324.3243 -87800.0 -0.47 -0.3467 -0.7433 3559208 ACon1_001458 COC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@H]4C[C@]3(C[C@H]4C(=O)O)CC[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I21 mock treatment 676008.8496 -44000.0 -0.2 786788.9908 74600.0 0.4 0.1365 0.3068 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I22 mock treatment 674876.5432 -45100.0 -0.21 654346.6135 -57800.0 -0.31 -0.3639 -0.9822 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I23 compound treatment 658380.5668 -61600.0 -0.28 629188.9401 -83000.0 -0.44 -0.5121 -0.9776 3552080 ACon1_001459 C/C=C/C=C/C(=O)c1cc(C)c(O)c(C)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 I24 compound treatment 654818.5484 -65200.0 -0.3 540821.7054 -171000.0 -0.91 -0.8551 -0.8934 3557310 ACon1_001460 CC(O)Cc1cc2c(C)cc(O)cc2c(=O)o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J01 compound treatment 828856.4815 109000.0 0.5 810571.4286 98400.0 0.52 0.7241 0.9998 3557337 ACon1_001461 C[C@H](O)CC1=C[C@H](O)[C@@H](C)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J02 compound treatment 707333.3333 -12700.0 -0.06 759015.7895 46900.0 0.25 0.1345 0.5266 3553966 ACon1_001462 CC1CC(=O)c2c(C1)ccc3C(O)c4c(O)cccc4C(=O)c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J03 compound treatment 787451.4563 67500.0 0.31 892172.7749 180000.0 0.95 0.8951 0.8914 3559779 ACon1_001463 C[C@H]1[C@@H](O)[C@H](O)C[C@]2(C)CC[C@H](C=C12)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J04 compound treatment 730459.2275 10500.0 0.05 681768.0412 -30400.0 -0.16 -0.0798 -0.4746 3615013 ACon1_001464 CC(=O)Cc1cc(O)cc2oc(C)cc(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J05 mock treatment 909186.3636 189000.0 0.87 841672.8972 130000.0 0.69 1.1027 0.993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J06 mock treatment 764777.2021 44800.0 0.21 859530.9278 147000.0 0.78 0.6988 0.8643 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J07 compound treatment 756300.0 36300.0 0.17 710800.0 -1350.0 -0.01 0.1133 0.6762 3615015 ACon1_001465 COC(=O)Cc1c(CCC(=O)O)oc2cc(C)cc(O)c2c1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J08 compound treatment 452896.1039 -267000.0 -1.23 426051.6129 -286000.0 -1.52 -1.944 -0.9946 1057044 ACon1_001466 COc1ccc(cc1O)c2oc3cc(O)cc(O)c3c(=O)c2OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J09 compound treatment 791862.069 71900.0 0.33 891101.8519 179000.0 0.95 0.9055 0.9007 3615018 ACon1_001467 O[C@@H]1CO[C@@H](OC(CCCCc2ccc(O)cc2)CCc3ccc(O)cc3)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J10 compound treatment 742714.9758 22700.0 0.1 685317.1806 -26800.0 -0.14 -0.0266 -0.1503 3615022 ACon1_001468 COC(=O)c1c(C)cc2CC3(Oc2c(C)c1=O)C(C)CCC4C3(C)C=CC(=O)OC4(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J11 compound treatment 834581.1518 115000.0 0.53 774035.8744 61900.0 0.33 0.6057 0.9738 3615023 ACon1_001469 CC1CCC2C(C)(C)CCCC2(C)C1(O)/C=C/C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J12 compound treatment 670248.7805 -49700.0 -0.23 654000.0 -58200.0 -0.31 -0.3803 -0.9894 2060335 ACon1_001470 Oc1ccc2C3Oc4cc5OCOc5cc4C3COc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J13 compound treatment 721836.8201 1840.0 0.01 729576.6423 17400.0 0.09 0.0714 0.7688 3615027 ACon1_001471 C[C@H]1[C@H]2OC3=C(C(=O)OC3(C)O)C(=O)[C@]1(C)[C@H]4CCCC[C@]4(O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J14 compound treatment 55226.4151 -665000.0 -3.07 56534.8837 -656000.0 -3.48 -4.6266 -0.998 3615031 ACon1_001472 C1Oc2cc3CCNC4Cc5ccccc5-c(c2O1)c43 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J15 compound treatment 391117.6471 -329000.0 -1.52 623448.6486 -88700.0 -0.47 -1.4051 -0.8849 3557473 ACon1_001473 CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(CO)COP(=O)(O)OCC[N+](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J16 compound treatment 707564.0 -12400.0 -0.06 655917.5627 -56200.0 -0.3 -0.2514 -0.8279 1093674 ACon1_001474 COc1ccc(Cc2nccc3cc(O)c(OC)cc23)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J17 compound treatment 597000.0 -123000.0 -0.57 615257.0423 -96900.0 -0.51 -0.7645 -0.9988 3615035 ACon1_001475 CCCCCCCCCC(O)C(C)C(O)C(CO)/C=C(\C)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J18 compound treatment 505642.0233 -214000.0 -0.99 554506.993 -158000.0 -0.84 -1.2902 -0.9965 1014127 ACon1_001476 COC(=O)C1=COC(C)C2CN3CCc4c([nH]c5cc(OC)ccc45)C3CC21 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J19 compound treatment 678820.2247 -41200.0 -0.19 818413.7931 106000.0 0.56 0.2643 0.4443 3615039 ACon1_001477 COC(=O)c1cc(O)c(O)c(O)c1c2c(O)c(O)c3oc(=O)c4cc(O)c(O)c5oc(=O)c2c3c45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J20 compound treatment 551777.027 -168000.0 -0.78 596569.7674 -116000.0 -0.61 -0.982 -0.9932 3615041 ACon1_001478 CCC1C2C34CC[N+]2([O-])CCC1C(=C4Nc5c3cccc5OC)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J21 mock treatment 667038.2979 -53000.0 -0.24 630835.1254 -81300.0 -0.43 -0.4777 -0.9637 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J22 mock treatment 541297.1888 -179000.0 -0.82 490905.7239 -221000.0 -1.17 -1.4125 -0.985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J23 compound treatment 223756.4103 -496000.0 -2.29 265325.0 -447000.0 -2.37 -3.294 -0.9998 3615043 ACon1_001479 CCCC(O)c1c(O)cccc1C/2(O)CC(=O)C\C2=C/C(O)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 J24 compound treatment 589781.5126 -130000.0 -0.6 497691.9643 -214000.0 -1.14 -1.2289 -0.9554 3615046 ACon1_001480 COC1OC2C(N(C)CCc3cc4OCOc4cc23)c5ccc6OCOc6c15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K01 compound treatment 727521.5054 7520.0 0.03 710954.7739 -1200.0 -0.01 0.0201 0.5685 3559758 ACon1_001481 CC[C@H]1CN2CC[C@H]1C[C@@H]2[C@@H](O)c3ccnc4ccc(OC)cc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K02 compound treatment 766817.3913 46800.0 0.22 735213.198 23100.0 0.12 0.2392 0.9638 3559087 ACon1_001482 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@@H](C[C@]3(C)OC(=O)C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K03 compound treatment 861385.0 141000.0 0.65 686443.8503 -25700.0 -0.14 0.3646 0.5474 3559128 ACon1_001483 C[N+](C)(C)C(Cc1ccccc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K04 compound treatment 769296.4824 49300.0 0.23 795025.641 82900.0 0.44 0.4716 0.9529 3558370 ACon1_001484 CC(=O)OCC1=C[C@H](O)[C@H]2[C@@H]1[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K05 compound treatment 913093.4579 193000.0 0.89 761931.9149 49800.0 0.26 0.8164 0.8789 3559003 ACon1_001485 COc1ccc(CC2C(Cc3ccc4OCOc4c3)COC2=O)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K06 compound treatment 48666.6667 -671000.0 -3.1 28676.6917 -683000.0 -3.63 -4.7525 -0.9969 3553192 ACon1_001486 CC(=CCc1c(O)cc2oc3c(CC=C(C)C)c(O)c(O)c(CC=C(C)C)c3c(=O)c2c1O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K07 mock treatment 672255.102 -47700.0 -0.22 711514.5631 -636.0 0.0 -0.1581 -0.7179 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K08 mock treatment 644967.4797 -75000.0 -0.35 708688.7755 -3460.0 -0.02 -0.2576 -0.7436 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K09 compound treatment 886130.7692 166000.0 0.77 1027958.678 316000.0 1.68 1.7262 0.9372 3554961 ACon1_001487 COc1cc(O)c(C(=O)c2c(C)cc(O)cc2OC)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K10 compound treatment 592682.9268 -127000.0 -0.59 661285.0242 -50900.0 -0.27 -0.6059 -0.9378 3558843 ACon1_001488 COc1cc2c(ccc3cc(OC)c(OC)c(O)c32)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K11 compound treatment 649285.0679 -70700.0 -0.33 578739.6694 -133000.0 -0.71 -0.7309 -0.9381 1254 ACon1_001489 O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K12 compound treatment 538443.3962 -182000.0 -0.84 618842.1053 -93300.0 -0.49 -0.942 -0.9685 3557313 ACon1_001490 C[C@H]1CC[C@@H]2[C@H]([C@@H](C)C=C[C@H]2C1)C(=O)c3c(O)c(c[nH]c3=O)[C@]4(O)CC[C@@H](O)[C@H]5O[C@H]54 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K13 compound treatment 598195.572 -122000.0 -0.56 589656.5657 -122000.0 -0.65 -0.8566 -0.9974 3555009 ACon1_001491 COc1cc(OC)c2c(O)c3CO[C@@H](C)[C@@H](O)c3c(c4c5[C@H](O)[C@H](C)OCc5c(O)c6c(OC)cc(OC)cc46)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K14 compound treatment 595828.125 -124000.0 -0.57 559691.358 -152000.0 -0.81 -0.9767 -0.9857 3559158 ACon1_001492 Cc1ccc2C(=O)c3cc(O[C@@H]4O[C@H](CO[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)ccc3C(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K15 mock treatment 607237.069 -113000.0 -0.52 617883.4951 -94300.0 -0.5 -0.7212 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K16 mock treatment 603086.9565 -117000.0 -0.54 684270.8333 -27900.0 -0.15 -0.4858 -0.869 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K17 compound treatment 623528.9855 -96500.0 -0.44 633756.7568 -78400.0 -0.42 -0.6086 -0.9994 3552826 ACon1_001493 C[C@]1(CO)CCC[C@@]2(C)C1[C@H](O)CC3=C2COC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K18 compound treatment 609586.9565 -110000.0 -0.51 623283.5249 -88900.0 -0.47 -0.6933 -0.9993 3559193 ACon1_001494 CC(C)C[C@](CC(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)OCc4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K19 compound treatment 618934.0278 -101000.0 -0.47 547919.1176 -164000.0 -0.87 -0.9455 -0.9571 3557988 ACon1_001495 OC[C@H]1O[C@@H](Oc2cc(O)c3c(=O)c(coc3c2)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K20 compound treatment 587536.0 -132000.0 -0.61 604859.7285 -107000.0 -0.57 -0.8343 -0.9994 3557832 ACon1_001496 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OCCc3ccc(O)c(O)c3)O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@H]2OC(=O)/C=C/c5ccc(O)c(O)c5)[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K21 compound treatment 636363.6364 -83600.0 -0.39 653741.9355 -58400.0 -0.31 -0.4918 -0.9941 3557515 ACon1_001497 OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@@H](OCCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K22 compound treatment 511324.4681 -209000.0 -0.96 437105.2632 -275000.0 -1.46 -1.712 -0.9796 3559214 ACon1_001498 CC/C=C\C=C\1/C(CCCCCCCC(=O)O)C=CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K23 mock treatment 621396.3964 -98600.0 -0.45 622925.7426 -89200.0 -0.47 -0.6562 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 K24 mock treatment 649970.1493 -70000.0 -0.32 561726.3682 -150000.0 -0.8 -0.7925 -0.9208 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L01 compound treatment 869221.2389 149000.0 0.69 976108.6957 264000.0 1.4 1.4766 0.9465 3552939 ACon1_001499 C[C@H](O)c1nc2ccccc2c(=O)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L02 compound treatment 749152.381 29200.0 0.13 827859.2233 116000.0 0.61 0.529 0.842 3615055 ACon1_001500 CC/C=C/c1ccc(C)cc1CCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L03 compound treatment 842092.5926 122000.0 0.56 876072.7273 164000.0 0.87 1.0129 0.9779 3559801 ACon1_001501 C[C@@H]1[C@H]2[C@H](OC1=O)[C@H]3C(=CC(=O)C3=C(C)C[C@@H]2O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L04 compound treatment 624936.3636 -95100.0 -0.44 552114.8649 -160000.0 -0.85 -0.9102 -0.9527 3615060 ACon1_001502 COc1cc(O)c(CC=C(C)C)c(/C=C/c2ccc(OC)c(O)c2)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L05 compound treatment 803185.3659 83200.0 0.38 854678.5714 143000.0 0.76 0.8058 0.9506 3615064 ACon1_001503 COc1cc(CCC(=O)N2CCC=CC2=O)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L06 compound treatment 874553.4884 155000.0 0.71 837051.6432 125000.0 0.66 0.9724 0.9993 3615066 ACon1_001504 CCCC1=C(/C=C/C(=O)O)C(=O)C(O1)C(C)(C)C2OC(=C(/C=C/C(=O)O)C2=O)CCC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L07 mock treatment 774113.4021 54100.0 0.25 831312.7753 119000.0 0.63 0.6234 0.9174 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L08 mock treatment 722783.1858 2790.0 0.01 714695.6522 2550.0 0.01 0.0186 0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L09 compound treatment 148700.0 -571000.0 -2.63 114821.4286 -597000.0 -3.17 -4.1032 -0.9958 2113350 ACon1_001505 COc1cc(CC(C)C(C)Cc2ccc(O)c(OC)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L10 compound treatment 757235.2941 37200.0 0.17 944170.8333 232000.0 1.23 0.9916 0.798 3615071 ACon1_001506 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C)/C1CC(=O)OC[C@@H]3[C@H](C)[C@H](C[C@H]3C(CO)CO)OC(=O)CC4\C(=C\C)\C(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)OC=C4C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L11 compound treatment 280122.449 -440000.0 -2.03 239322.5806 -473000.0 -2.51 -3.2077 -0.9945 3615072 ACon1_001507 CC1CC(=O)[C@]2(C)CC[C@]3(C)C(=C(O)C(O)C4[C@@]5(C)CC[C@H](O)C(C)(C5CC[C@]43C)C(=O)O)C2C1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L12 compound treatment 733843.4783 13800.0 0.06 746453.7037 34300.0 0.18 0.1738 0.9014 3557524 ACon1_001508 OC1COC(OCC2OC(OCc3ccccc3)C(O)C(O)C2O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L13 compound treatment 445012.9032 -275000.0 -1.27 559034.2857 -153000.0 -0.81 -1.471 -0.9768 3615077 ACon1_001509 CC1CCC2C(C)(C)CCCC2(C)C1(O)C/C=C(\CCOC(=O)C)/COC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L14 compound treatment 707011.236 -13000.0 -0.06 661519.6078 -50600.0 -0.27 -0.2322 -0.8441 3615080 ACon1_001510 CCC(O)CC1CCCC(CC(O)c2ccccc2)N1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L15 mock treatment 632667.9842 -87300.0 -0.4 728045.045 15900.0 0.08 -0.2252 -0.5472 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L16 mock treatment 804146.2451 84100.0 0.39 787595.2381 75400.0 0.4 0.5574 0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L17 compound treatment 840778.1818 121000.0 0.56 600338.0282 -112000.0 -0.59 -0.0255 -0.0313 3615082 ACon1_001511 C[C@H]1CC[C@@H]2N(C1)C[C@H]3[C@@H]4C[C@]5(O[C@@]6(O)[C@H]7C[C@@H](O)[C@H]5[C@]4(O)[C@@H](O)[C@H](O)[C@@H]3[C@]2(C)O)[C@@]7(C)CC[C@@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L18 compound treatment 628645.283 -91400.0 -0.42 683220.5882 -28900.0 -0.15 -0.4064 -0.9064 3615084 ACon1_001512 CCN1C[C@]2(C)CC[C@H](OC)[C@]3([C@@H]4C[C@H]5[C@H](O)[C@@H]4[C@@](C[C@@H]5OC)(OC)C6[C@@H](OC(=O)C)C32)[C@@H]61 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L19 compound treatment 648452.6627 -71500.0 -0.33 623395.8333 -88800.0 -0.47 -0.5662 -0.9849 3615086 ACon1_001513 CC(C)C1NC(=O)C(C)NC(=O)CCCNC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(C)NC(=O)C(NC(=O)C(NC1=O)C(C)c4ccccc4)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L20 compound treatment 643283.4395 -76700.0 -0.35 595150.0 -117000.0 -0.62 -0.689 -0.9645 1050697 ACon1_001514 CC(C)C(O)(C(C)O)C(=O)OCC1=CCN2CCC(O)C21 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L21 compound treatment 711525.3623 -8470.0 -0.04 588610.9091 -124000.0 -0.66 -0.491 -0.7479 3615088 ACon1_001515 C[C@@H]1O[C@@H](O[C@H]2[C@H](C)O[C@@H](OC(=O)[C@@]34CCC(C)(C)C[C@H]4C5=CCC6[C@@]7(C)C[C@H](O)[C@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@H](O)[C@H]9O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)[C@H]8O)[C@@](C)(CO)C7CC[C@@]6(C)[C@]5(C)C[C@H]3O)[C@H](O[C@@H]%11O[C@@H](CO)[C@H](O)[C@H]%11O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L22 compound treatment 688468.0 -31500.0 -0.15 547263.3588 -165000.0 -0.87 -0.7212 -0.8135 3615092 ACon1_001516 COc1cc2CCN(C)C3c4c(CC3(O)c2cc1O)ccc5OCOc54 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L23 mock treatment 674173.7589 -45800.0 -0.21 563194.1392 -149000.0 -0.79 -0.7081 -0.8658 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 L24 mock treatment 568703.9711 -151000.0 -0.7 569895.5823 -142000.0 -0.75 -1.0269 -0.9992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M01 compound treatment 573327.5862 -147000.0 -0.68 528092.5926 -184000.0 -0.98 -1.1686 -0.9839 3553702 ACon1_001517 CC(CCC1(C)C(C)CCC2(CO)C1CCC=C2CO)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M02 compound treatment 582641.8605 -137000.0 -0.63 623955.3571 -88200.0 -0.47 -0.7787 -0.9889 3559098 ACon1_001518 COc1c(O)cc(cc1O)[C@@H]2Oc3cc(O)cc(O)c3C[C@@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M03 compound treatment 744567.2269 24600.0 0.11 823601.7699 111000.0 0.59 0.4981 0.8276 3559053 ACon1_001519 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](O)[C@H]1OC(=O)/C=C/c6ccccc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M04 compound treatment 692774.8918 -27200.0 -0.13 688186.0465 -24000.0 -0.13 -0.1786 -1.0 3559037 ACon1_001520 COc1cc(ccc1O)C(=O)O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M05 compound treatment 722110.0917 2110.0 0.01 669827.2059 -42300.0 -0.22 -0.1518 -0.6758 3554112 ACon1_001521 CCC(C)/C=C/C1=CC2=C(Cl)C(=O)C3(C)OC(=O)C(C3C2=CO1)C(=O)C(C)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M06 compound treatment 691854.0773 -28100.0 -0.13 847084.0336 135000.0 0.72 0.4143 0.5696 3559185 ACon1_001522 C[C@]12C[C@H](OC(=O)C2CC[C@]3(C)[C@H]1[C@@H]4OC(=O)[C@@]3(O)C=C4)c5ccoc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M07 compound treatment 687317.7966 -32700.0 -0.15 681988.9706 -30200.0 -0.16 -0.2197 -0.9996 3559057 ACon1_001523 COc1ccc(/C=C/C(=O)O[C@H]2[C@H](C)O[C@@H](O[C@@H]3[C@@H]4O[C@]4(CO)[C@@H]5[C@H]3C=CO[C@H]5O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@@H]2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M08 compound treatment 649553.6913 -70400.0 -0.32 691108.0139 -21000.0 -0.11 -0.3086 -0.8985 3557382 ACon1_001524 CC(=O)N(O)CCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M09 mock treatment 699169.9605 -20800.0 -0.1 743063.0252 30900.0 0.16 0.048 0.2527 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M10 mock treatment 679173.2852 -40800.0 -0.19 732783.4101 20600.0 0.11 -0.0557 -0.256 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M11 compound treatment 808309.2784 88300.0 0.41 761827.381 49700.0 0.26 0.4743 0.9778 3553353 ACon1_001525 CC(=O)OC/1C\C=C(/C)\CC(OC(=O)/C(=C\CO)/C)C2C(OC(=O)C2=C)\C=C1/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M12 compound treatment 674393.617 -45600.0 -0.21 566670.0337 -145000.0 -0.77 -0.6943 -0.8682 3558922 ACon1_001526 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)[C@@](C)(C5CC[C@]43C)C(=O)O)C2[C@]1(C)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M13 mock treatment 620082.9694 -99900.0 -0.46 698783.6735 -13400.0 -0.07 -0.3759 -0.8064 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M14 mock treatment 621856.4593 -98100.0 -0.45 554732.7935 -157000.0 -0.83 -0.9104 -0.9586 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M15 compound treatment 680173.0769 -39800.0 -0.18 642913.3333 -69200.0 -0.37 -0.3895 -0.9487 3554846 ACon1_001527 COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)Oc3cc(C)c(C(=O)NC(C)C(=O)O)c(O)c3)c(OC)c2)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M16 compound treatment 523692.3077 -196000.0 -0.91 603054.1872 -109000.0 -0.58 -1.0493 -0.9766 3558380 ACon1_001528 COc1cc(CCOC2OC(CO)C(OC(=O)/C=C/c3ccc(O)c(OC)c3)C(OC4OC(C)C(O)C(O)C4O)C2O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M17 compound treatment 607182.5095 -113000.0 -0.52 732054.0541 19900.0 0.11 -0.2932 -0.5524 3554709 ACon1_001529 COC(=O)c1cc(O)cc(OC)c1Oc2cc(C)cc(O)c2C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M18 compound treatment 533684.9315 -186000.0 -0.86 565792.8571 -146000.0 -0.78 -1.1565 -0.9987 3557627 ACon1_001530 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[C@@H]6OC[C@](O)(CO)[C@H]6O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M19 compound treatment 70297.8723 -650000.0 -3.0 426801.4184 -285000.0 -1.51 -3.1888 -0.95 3552018 ACon1_001531 C/C=C(/C)\C(=O)O[C@H]1C=C(C)C[C@H](OC(=O)c2ccc(O)cc2)C3[C@@](O)(CC[C@@]31C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M20 compound treatment 535367.4242 -185000.0 -0.85 451337.3016 -261000.0 -1.38 -1.5802 -0.9728 3558024 ACon1_001532 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)/C=C/c6ccc(O)cc6)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M21 compound treatment 676992.4812 -43000.0 -0.2 636713.7405 -75400.0 -0.4 -0.4232 -0.9476 3553253 ACon1_001533 CC(=O)Cc1cc(=O)c2c(C)cc(O)c(C3OC(CO)C(O)C(O)C3O)c2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M22 compound treatment 633024.3902 -87000.0 -0.4 524616.7883 -188000.0 -0.99 -0.987 -0.9202 3559206 ACon1_001534 CC1(C)C(O)CCC2(C)C3CCC4CC3(CC4(O)CO)CCC12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M23 compound treatment 519293.8931 -201000.0 -0.93 630263.9405 -81900.0 -0.43 -0.9616 -0.9405 3559039 ACon1_001535 COc1cc(/C=C/C(=O)O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 M24 compound treatment 574811.6592 -145000.0 -0.67 588510.6383 -124000.0 -0.66 -0.9371 -0.9999 3553939 ACon1_001536 CC1=CC(=O)C2C(C)(C)CC(O)CC2(C)C1(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N01 compound treatment 996026.3158 276000.0 1.27 790874.3719 78700.0 0.42 1.1954 0.8923 1037131 ACon1_001537 Cc1cc(C)c(O)c(c1)C(=O)CC2CC(=O)NC(=O)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N02 compound treatment 858217.7778 138000.0 0.64 921060.3448 209000.0 1.11 1.2342 0.9655 3615103 ACon1_001538 CC1CC(O)CC(C)(C)C1(O)/C=C/C(CO)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N03 compound treatment 810816.1435 90800.0 0.42 698334.7458 -13800.0 -0.07 0.2443 0.5747 3559788 ACon1_001539 CC(C)[C@@H]1CC[C@@](C)(O)[C@@H]2C[C@H](O)[C@@H]([C@H]21)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N04 compound treatment 906049.505 186000.0 0.86 811000.0 98800.0 0.52 0.9774 0.9721 3615108 ACon1_001540 CC(C)(O)CCC(=O)[C@](C)(O)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4C(C=C(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N05 compound treatment 777434.3434 57400.0 0.26 854334.8416 142000.0 0.75 0.7206 0.9015 3069522 ACon1_001541 COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N06 compound treatment 687023.2558 -33000.0 -0.15 934133.8583 222000.0 1.18 0.725 0.6107 3615112 ACon1_001542 CCCC(O)c1ccc(C)cc1CCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N07 compound treatment 576693.5484 -143000.0 -0.66 566792.4528 -145000.0 -0.77 -1.0125 -0.9971 3615113 ACon1_001543 Cc1cc(C(=O)Oc2c(C)cc(C(=O)O)c(O)c2C)c(O)c(C)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N08 compound treatment 720791.3386 794.0 0.0 731252.4752 19100.0 0.1 0.0742 0.7322 3559245 ACon1_001544 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2c3c(O)cc4oc(cc(=O)c4c3O)c5ccc(O)cc5)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N09 mock treatment 834895.2381 115000.0 0.53 791862.9442 79700.0 0.42 0.6736 0.9937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N10 mock treatment 737452.7363 17500.0 0.08 781455.6452 69300.0 0.37 0.3168 0.842 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N11 compound treatment 745289.0995 25300.0 0.12 774776.1905 62600.0 0.33 0.3174 0.9014 3615116 ACon1_001545 COC(/C=C/CC\C=C\C(=O)O)C(O)C(C)C(O)/C(=C/C(C)C(=O)CCCC1CC(=O)NC(=O)C1)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N12 compound treatment 731939.5161 11900.0 0.06 699049.2611 -13100.0 -0.07 -0.0102 -0.115 3615120 ACon1_001546 CCCC[C@H](O)[C@@H]1CC(=CC(=O)O1)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N13 mock treatment 827592.4171 108000.0 0.5 722431.8182 10300.0 0.05 0.3894 0.7801 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N14 mock treatment 675225.1309 -44800.0 -0.21 715410.0 3260.0 0.02 -0.1338 -0.6456 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N15 compound treatment 695186.4407 -24800.0 -0.11 618248.1481 -93900.0 -0.5 -0.4331 -0.8475 3615123 ACon1_001547 COC(=O)c1cccc(O)c1C(=O)c2c(O)cc(C)cc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N16 compound treatment 657852.2337 -62100.0 -0.29 611014.0187 -101000.0 -0.54 -0.582 -0.9569 3615126 ACon1_001548 COc1ccc(cc1Cl)C(=O)NCCc2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N17 compound treatment 760544.6429 40500.0 0.19 692357.7236 -19800.0 -0.1 0.058 0.2704 3615128 ACon1_001549 COc1cc(OC)c(cc1OC)c2coc3c4C=CC(C)(C)Oc4c(OC)cc3c2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N18 compound treatment 586481.0127 -134000.0 -0.62 593471.4286 -119000.0 -0.63 -0.8805 -0.9999 2259 ACon1_001550 CN1CCc2cc3OCOc3cc2C(=O)Cc4ccc5OCOc5c4C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N19 compound treatment 563700.3745 -156000.0 -0.72 531568.6275 -181000.0 -0.96 -1.1869 -0.9902 3615132 ACon1_001551 COc1ccc2C[C@@H]3[C@H](COC3=O)[C@H](OC(=O)/C(=C\C)/C)c4cc(OC)c(OC)cc4-c2c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N20 compound treatment 480201.4134 -240000.0 -1.11 586077.2947 -126000.0 -0.67 -1.2548 -0.971 3615136 ACon1_001552 CC(O)c1cncc2c(=O)n3CCc4c([nH]c5ccccc45)-c3cc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N21 compound treatment 614879.562 -105000.0 -0.48 539030.303 -173000.0 -0.92 -0.9921 -0.9554 3615138 ACon1_001553 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2OC(=O)[C@@]34CCC(C)(C)C[C@H]4C5=CCC6[C@@]7(C)C[C@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@](C)(CO)C7[C@H](O)C[C@@]6(C)[C@]5(C)CC3)[C@H](O)[C@H](O)[C@H]1O[C@@H]9OC[C@@H](O)[C@H](O[C@@H]%10OC[C@](O)(CO)[C@H]%10O)[C@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N22 compound treatment 601459.7015 -119000.0 -0.55 634017.301 -78100.0 -0.41 -0.6796 -0.9907 3615141 ACon1_001554 C/C=C(/C)\C(=O)OC1CCN2CC=C(COC(=O)C(O)(C(C)O)C(C)(C)O)C12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N23 compound treatment 376544.3038 -343000.0 -1.58 431632.3529 -281000.0 -1.49 -2.1721 -0.9995 3614951 ACon1_001555 Cc1cc(O)c2C(=O)C3=C(C(O)C(O)C(O)C3O)C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 N24 compound treatment 545349.6503 -175000.0 -0.81 556232.0 -156000.0 -0.83 -1.1543 -0.9999 3615144 ACon1_001556 CO/C=C(/C1CC2N(CCC23C(=O)Nc4ccccc43)CC1C=C)\C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O01 compound treatment 720814.6718 817.0 0.0 787238.4937 75100.0 0.4 0.2843 0.7138 3559328 ACon1_001557 CC1OC1(C)C(=O)O[C@@H]2CC[C@]3(C)CC(=O)C(=C(C)C)C[C@H]3[C@]2(C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O02 compound treatment 678591.3462 -41400.0 -0.19 740463.8298 28300.0 0.15 -0.0288 -0.1187 3559070 ACon1_001558 C[C@@H]1C[C@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)[C@]5(C)[C@H](CCC=C5C)[C@@]1(C)CC[C@](C)(O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O03 compound treatment 598641.791 -121000.0 -0.56 788550.9259 76400.0 0.41 -0.1092 -0.158 1093459 ACon1_001559 COc1cc(CC2COC(=O)C2(O)Cc3ccc(O)c(OC)c3)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O04 compound treatment 984397.0588 264000.0 1.22 905417.3228 193000.0 1.03 1.587 0.9963 3559095 ACon1_001560 C/C=C(/C)\C(=O)O[C@H]1C[C@]2(C)O[C@@H]2[C@H]3O[C@H]3C(=C)[C@@H](O)[C@H]4OC(=O)C(=C)[C@@H]41 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O05 compound treatment 743250.996 23300.0 0.11 729282.8685 17100.0 0.09 0.1401 0.9966 3558913 ACon1_001561 OC(=O)C[C@](O)(Cc1ccc(O)cc1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O06 compound treatment 654512.0968 -65500.0 -0.3 732008.3682 19900.0 0.11 -0.1391 -0.4348 3559222 ACon1_001562 COc1c(O)cc(cc1O)c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]4O[C@@H](C)[C@H](OC(=O)C)[C@@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O07 compound treatment 653193.6937 -66800.0 -0.31 631328.8889 -80800.0 -0.43 -0.521 -0.9869 3557351 ACon1_001563 C[C@@H](OC(=O)C)[C@@H]1[C@]23O[C@@]3([C@H](O)c4c(O)c(ccc4C2=O)c5ccc6C(=O)[C@@]78O[C@@]8([C@H](O)c6c5O)C(=O)C[C@](C)(O)[C@@H]7[C@@H](C)OC(=O)C)C(=O)C[C@]1(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O08 compound treatment 637643.9024 -82400.0 -0.38 755063.9269 42900.0 0.23 -0.1076 -0.243 3559212 ACon1_001564 CC(C)C(C)(O)C(=O)OCC1=CCN2CCC(O)C21 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O09 compound treatment 731339.0558 11300.0 0.05 726501.9455 14400.0 0.08 0.0908 0.9832 3615151 ACon1_001565 C[C@@H]1C2[C@H](CC3[C@@H]4CC=C5C[C@H](CC[C@]5(C)C4CC[C@]23C)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]7O)O[C@@]91CC[C@@](C)(CO[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)O9 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O10 compound treatment 611327.2727 -109000.0 -0.5 613409.0909 -98700.0 -0.52 -0.7247 -0.9998 3557334 ACon1_001566 CC(C)(C=C)[C@]12C[C@@H]3N([C@@H]2Nc4ccccc41)C(=O)/C(=C/c5cnc[nH]5)/NC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O11 mock treatment 650262.9108 -69700.0 -0.32 635638.7435 -76500.0 -0.41 -0.5144 -0.9934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O12 mock treatment 712857.7778 -7140.0 -0.03 683139.3443 -29000.0 -0.15 -0.1321 -0.8394 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O13 compound treatment 645203.6199 -74800.0 -0.34 620674.3119 -91500.0 -0.49 -0.587 -0.986 3554512 ACon1_001567 CO[C@H]1/C=C/C=C(\C)/C[C@H](C)[C@H](O)[C@H](C)/C=C(\C)/C=C(\OC)/C(=O)O[C@@H]1[C@@H](C)[C@@H](O)[C@H](C)C(=O)\C=C\[C@H](C)[C@H](O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O14 compound treatment 540919.0283 -179000.0 -0.83 665818.5654 -46300.0 -0.25 -0.7577 -0.8794 3180421 ACon1_001568 COc1ccc2[C@@H]3COc4cc(O)ccc4[C@@H]3Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O15 compound treatment 706729.0837 -13300.0 -0.06 667814.6718 -44300.0 -0.24 -0.2095 -0.8624 3557322 ACon1_001569 CC/C=C/C=C/1\CO[C@@]2(CC[C@@H](CO)O2)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O16 compound treatment 617835.206 -102000.0 -0.47 628385.2459 -83800.0 -0.44 -0.6473 -0.9996 3557362 ACon1_001570 CC(=O)c1nc2ccccc2c(=O)[nH]1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O17 compound treatment 392886.5979 -327000.0 -1.51 403265.625 -309000.0 -1.64 -2.2252 -0.9992 3553815 ACon1_001571 CC[C@H]/1CC[C@H]2O[C@@]3(CC[C@@H](C)[C@@H](C[C@H](C)O)O3)[C@H](C)[C@@H](OC(=O)/C=C/[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@@H](C)C(O)[C@@H](C)C(=O)[C@@](C)(O)C(O)[C@@H](C)C\C=C\C=C1)[C@H]2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O18 compound treatment 592007.8431 -128000.0 -0.59 639357.7236 -72800.0 -0.39 -0.6904 -0.9788 3558879 ACon1_001572 CC(CO)C(=O)O[C@H]1C/C(=C/CC/C(=C/[C@H]2OC(=O)C(=C)[C@@H]21)/CO)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O19 compound treatment 569988.6792 -150000.0 -0.69 602241.1067 -110000.0 -0.58 -0.9014 -0.9964 3554106 ACon1_001573 CCC(C)(O)C(=O)O[C@@H]1[C@H]2[C@@H](C)[C@@H](O)[C@]3(O)OC[C@]42[C@H]3[C@@]5(C)[C@H](O)C(=O)C=C(C)[C@@H]5C[C@H]4OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O20 compound treatment 550746.4286 -169000.0 -0.78 542350.1946 -170000.0 -0.9 -1.1887 -0.9975 3559210 ACon1_001574 C[C@@]1(CO)CCC[C@@]2(C)[C@@H]3CC[C@@H]4C[C@]3(CC4=C)CC[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O21 compound treatment 497599.1903 -222000.0 -1.03 570460.9053 -142000.0 -0.75 -1.2566 -0.9883 3558433 ACon1_001575 CC1OC(OC2C(OC3OCC(O)C(O)C3O)C(OCCc4ccc(O)c(O)c4)OC(CO)C2OC(=O)/C=C/c5ccc(O)c(O)c5)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O22 compound treatment 566067.9245 -154000.0 -0.71 519513.0435 -193000.0 -1.02 -1.2244 -0.9842 3557365 ACon1_001576 CC(=O)O[C@@H]1C[C@@]2(C)[C@]3(CO3)[C@@H]1O[C@@H]4C=C(C)C(O)[C@H](O)[C@@]42C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O23 compound treatment 520211.5385 -200000.0 -0.92 500578.7402 -212000.0 -1.12 -1.445 -0.9952 3558906 ACon1_001577 CCC(C)C(=O)OC/C=C(\C)/CC[C@H]1C(=C)C(O)CC2[C@@](C)(COC(=O)C)CC(O)C[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 O24 compound treatment 595888.4758 -124000.0 -0.57 513153.5836 -199000.0 -1.06 -1.151 -0.9587 3557395 ACon1_001578 CC1(CO)CC(O)CC2(C)C1CCC3=C2COC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P01 compound treatment 637431.1927 -82600.0 -0.38 593261.3065 -119000.0 -0.63 -0.7151 -0.9708 1000475 ACon1_001579 O=c1ccc2cc3ccoc3cc2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P02 compound treatment 684324.8945 -35700.0 -0.16 664220.7792 -47900.0 -0.25 -0.2961 -0.9778 3615161 ACon1_001580 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(=O)O)[C@](C)(C5CC[C@]43C)C(=O)O)[C@@H]2C1)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P03 compound treatment 664632.8502 -55400.0 -0.26 625418.2692 -86700.0 -0.46 -0.5058 -0.9614 3553075 ACon1_001581 C[C@H]1[C@H](O)CCC2=CC(=O)C(=C[C@]12C)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P04 compound treatment 637282.4074 -82700.0 -0.38 572490.9091 -140000.0 -0.74 -0.7935 -0.9524 3615165 ACon1_001582 Cc1cc(O)c(C)c2Oc3c(C)c(O)c(O)c(C)c3OC(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P05 compound treatment 629510.5485 -90500.0 -0.42 681331.9149 -30800.0 -0.16 -0.4107 -0.9163 3615168 ACon1_001583 Oc1cccc2C(=O)Nc3ccccc3-c4nc5ccccc5c(=O)n4-c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P06 compound treatment 670241.8033 -49800.0 -0.23 626903.3613 -85200.0 -0.45 -0.482 -0.9506 3615170 ACon1_001584 CC1CC(OC=O)C2C(C)C(CCC2(C)C31CCC4(COC(=O)C4)O3)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P07 compound treatment 674036.5297 -46000.0 -0.21 622054.1872 -90100.0 -0.48 -0.4878 -0.9331 3615172 ACon1_001585 COC1CC(OC2C(C)OC(CC2OC)OC3C(C)OC(CC3OC)OC4C(C)OC(CC4OC)O[C@H]5CC[C@]6(C)C7CC(OC(=O)c8ccccc8)[C@]9(C)[C@@](O)(CC[C@]9(O)[C@]7(O)CC=C6C5)C(=O)C)OC(C)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P08 compound treatment 234903.6145 -485000.0 -2.24 318177.0833 -394000.0 -2.09 -3.0594 -0.9994 3615176 ACon1_001586 O[C@@H]1[C@@H](O)[C@H](Oc2c(O)c(c(O)cc2c3ccccc3)c4ccccc4)O[C@@H]([C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P09 compound treatment 516935.1852 -203000.0 -0.94 577429.2035 -135000.0 -0.71 -1.1674 -0.9911 3615180 ACon1_001587 Cc1cc2C(=O)c3ccccc3C(=O)c2cc1O[C@@H]4O[C@H](CO[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P10 compound treatment 659342.5606 -60700.0 -0.28 696587.7193 -15600.0 -0.08 -0.2562 -0.8783 3615183 ACon1_001588 CC(=O)[C@@]12C[C@@H](CC[C@@]2(C)CC[C@@H]1O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P11 mock treatment 630923.4234 -89100.0 -0.41 597296.4824 -115000.0 -0.61 -0.7212 -0.9816 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P12 mock treatment 626308.0808 -93700.0 -0.43 617721.9731 -94400.0 -0.5 -0.6597 -0.9973 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P13 compound treatment 557405.4054 -163000.0 -0.75 627451.0638 -84700.0 -0.45 -0.8479 -0.97 3615185 ACon1_001589 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)CO[C@@H](O[C@H]3[C@H](C)O[C@@H](O[C@@H]4[C@@H](O)[C@@H](O)CO[C@H]4OC(=O)[C@@]56CCC(C)(C)C[C@H]6C7=CCC8[C@@]9(C)C[C@H](O)[C@H](O[C@@H]%10O[C@@H]([C@@H](O)[C@H](O)[C@H]%10O)C(=O)O)[C@@](C)(CO)C9[C@H](O)C[C@@]8(C)[C@]7(C)C[C@H]5O)[C@H](O)[C@@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P14 compound treatment 562280.8989 -158000.0 -0.73 579178.8618 -133000.0 -0.71 -1.013 -0.9999 3615189 ACon1_001590 COc1cc(nc(/C=N/O)c1S(=O)C)c2ccccn2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P15 compound treatment 544472.2222 -176000.0 -0.81 635748.9712 -76400.0 -0.41 -0.8589 -0.9488 3557312 ACon1_001591 CC(O)CC1CCC(O1)C(C)C(=O)OC(C)CC2CCC(O2)C(C)C(=O)OC(C)CC3CCC(O3)C(C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P16 compound treatment 649670.5882 -70300.0 -0.32 560617.0213 -152000.0 -0.8 -0.7977 -0.9203 3615194 ACon1_001592 CC(C)(C=C)C12CC3N(C2Nc4ccccc41)C(=O)C(Cc5c[nH]cn5)NC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P17 compound treatment 441913.0435 -278000.0 -1.28 565462.8975 -147000.0 -0.78 -1.457 -0.9713 3558732 ACon1_001593 O[C@H]1[C@H](O)[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P18 compound treatment 517774.7748 -202000.0 -0.93 588739.7959 -123000.0 -0.65 -1.1223 -0.985 3615196 ACon1_001594 COC(=O)C1(CO)C/2CCN(C\C2=C/C)Cc3c1[nH]c4ccccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P19 compound treatment 463568.1818 -256000.0 -1.18 461542.1245 -251000.0 -1.33 -1.7761 -0.9983 3615200 ACon1_001595 C/C(=C\CCC(C)(O)C=C)/C(=O)OC1C2OC2(C)C3C(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)OC=CC13O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P20 compound treatment 428411.9601 -292000.0 -1.34 471083.9161 -241000.0 -1.28 -1.855 -0.9997 2096349 ACon1_001596 COc1cc2CCN(C)C3(Cc4ccc5OCOc5c4C3=O)c2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P21 compound treatment 380841.5493 -339000.0 -1.56 440064.6259 -272000.0 -1.44 -2.1264 -0.9992 1054272 ACon1_001597 COc1ccc(cc1)c2cc(=O)c3c(O)c(OC)c(O)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P22 compound treatment 444372.9373 -276000.0 -1.27 428717.7914 -283000.0 -1.5 -1.9618 -0.9965 1874510 ACon1_001598 CC1C2C(CC3C4CC=C5CC(O)CCC5(C)C4CCC23C)OC61CCC(C)CN6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P23 compound treatment 469625.0 -250000.0 -1.15 470876.3251 -241000.0 -1.28 -1.7213 -0.9987 3615206 ACon1_001599 CC1OC(O[C@H]2[C@@H](O)C[C@@]3(C)C(CC[C@]4(C)C3CC=C5[C@@H]6CC(C)(C)CC[C@@]6(CC[C@]54C)C(=O)OC7OC(C)C(OC8OCC(OC9OCC(O)C(OC%10OCC(O)C(O)C%10O)C9O)C(O)C8O)C(O)C7O)[C@]2(C)CO)C(O)C(OC%11OC(CO)C(O)C(O)C%11O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2294 P24 compound treatment 539861.7021 -180000.0 -0.83 498486.8914 -214000.0 -1.13 -1.3888 -0.9883 1707947 ACon1_001600 CN1CCc2cc3OCOc3cc2C1C4OC(=O)c5c6OCOc6ccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A01 compound treatment 682970.1493 -15200.0 -0.07 713854.8387 13300.0 0.07 4.0E-4 0.004 3615211 ACon1_001601 COc1cc2CCN(C)C3Cc4ccc(O)c(O)c4-c(c1OC)c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A02 compound treatment 669885.7143 -28300.0 -0.13 588511.7371 -112000.0 -0.59 -0.5124 -0.8423 3615213 ACon1_001602 CC1OC(Oc2cc(O)c(C3OC(C)C(O)C(O)C3O)c4oc(cc(=O)c24)c5ccc(O)cc5)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A03 compound treatment 854705.0 157000.0 0.72 678617.4863 -21900.0 -0.12 0.4283 0.5857 3484788 ACon1_001603 CCC(C)C1NC(=O)C2CCCN2C(=O)C(CC=C)OC(=O)CCNC(=O)C(C)N(C)C(=O)C(C(C)C)N(C)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A04 compound treatment 852695.6522 155000.0 0.71 550276.7857 -150000.0 -0.8 -0.0596 -0.0558 3615215 ACon1_001604 COc1cc(cc(OC)c1O)C(=O)OC[C@@]2(O)CO[C@H](OC3C(O)C(O)C(Oc4cc(OC)c(OC)c(OC)c4)OC3CO)[C@@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A05 compound treatment 847744.186 150000.0 0.69 722143.5407 21600.0 0.11 0.5688 0.8134 3557487 ACon1_001605 CC1(O)CC2(CC1CCC23)CC(=O)C4C(CO)(CCCC34C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A06 compound treatment 790921.0526 92800.0 0.43 791473.9583 90900.0 0.48 0.6435 0.9982 3615219 ACon1_001606 CCCCCC(=O)CC(O)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A07 compound treatment 805570.0935 107000.0 0.5 942101.2658 242000.0 1.28 1.2562 0.9145 3553900 ACon1_001607 CC1[C@H]2[C@@H](CC1=O)C(=C)C[C@@H](O)[C@@H]3[C@@H]2OC(=O)C3=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A08 compound treatment 770919.8113 72800.0 0.34 755381.2155 54800.0 0.29 0.4429 0.9975 3615221 ACon1_001608 CC1(CCCC2(C)C1C(O)CC3(CC4(O)CC=C32)C(=O)C4=C)C(=O)OC5OC(CO)C(O)C(O)C5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A09 compound treatment 816049.7512 118000.0 0.54 802085.7143 102000.0 0.54 0.7653 1.0 3615223 ACon1_001609 C[C@@]1(O)C[C@@H](O)C[C@]2(C)CC[C@H](CC12)C(=C)C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A10 compound treatment 677559.2417 -20600.0 -0.1 774313.1313 73800.0 0.39 0.2095 0.5203 3615227 ACon1_001610 C[C@@]12CCC[C@@]3(C)C2[C@@H](C[C@@]4(CO4)[C@]3(O)CCc5ccoc5)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A11 compound treatment 715354.8387 17200.0 0.08 770802.8846 70300.0 0.37 0.3196 0.8387 1088391 ACon1_001611 CC1=CC(=O)c2c(O)cccc2C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A12 compound treatment 746341.2322 48200.0 0.22 635051.2821 -65500.0 -0.35 -0.0885 -0.2147 3615231 ACon1_001612 COC(/C=C/C(OC(=O)C)C(C)OC(=O)C)C(O)C1CC=CC(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A13 mock treatment 620718.232 -77400.0 -0.36 795214.6597 94700.0 0.5 0.1025 0.1664 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A14 mock treatment 785722.2222 87600.0 0.4 672647.343 -27900.0 -0.15 0.1809 0.4207 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A15 compound treatment 650931.9149 -47200.0 -0.22 555728.1106 -145000.0 -0.77 -0.6971 -0.8732 3615235 ACon1_001613 OC1Cc2c(O)c3C(C(O)C(Oc3cc2OC1c4ccc(O)c(O)c4)c5ccc(O)c(O)c5)c6ccc(O)cc6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A16 compound treatment 836649.8054 138000.0 0.64 709569.0377 9030.0 0.05 0.4855 0.758 3615238 ACon1_001614 CC(C)/C=C/C=C(\C)/CC/C=C(\C)/CCOc1c(O)cc2C(=O)NCc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A17 compound treatment 870895.8333 173000.0 0.8 702943.8776 2410.0 0.01 0.5723 0.7183 3615241 ACon1_001615 C[C@@H]1O[C@@H](OC(=O)c2c(C)coc2C)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A18 compound treatment 884399.061 186000.0 0.86 827239.7959 127000.0 0.67 1.0825 0.9926 3615246 ACon1_001616 C[C@@H]1O[C@@H](OC2C(O)C(O)C(OC3C(O)COC(O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC=C7C8CC(C)(C)CC[C@@]8(CC[C@]76C)C(=O)OC9OC(CO)C(O)C(O)C9O)C4(C)C)C3O)OC2C(=O)O)[C@H](O)[C@H](OC%10OC(CO)C(O)C(O)C%10O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A19 compound treatment 732727.7487 34600.0 0.16 671704.3011 -28800.0 -0.15 0.0046 0.0207 3615250 ACon1_001617 OC1CCC(=O)c2c(O)cccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A20 compound treatment 713689.6552 15500.0 0.07 654227.027 -46300.0 -0.25 -0.1231 -0.481 3559151 ACon1_001618 CC(CCC1(O)OC2CC3C4CCC5CC(CCC5(C)C4CCC3(C)C2C1C)OC6OC(CO)C(O)C(O)C6OC7OC(CO)C(O)C(O)C7O)COC8OC(CO)C(O)C(O)C8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A21 compound treatment 786355.7692 88200.0 0.41 760875.0 60300.0 0.32 0.5139 0.993 3615252 ACon1_001619 OC(=O)CCCCCCC/C=C\CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A22 compound treatment 581790.4762 -116000.0 -0.54 704766.055 4230.0 0.02 -0.3636 -0.677 1018507 ACon1_001620 Oc1ccc(C=O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A23 compound treatment 547746.3235 -150000.0 -0.69 584981.4815 -116000.0 -0.61 -0.9239 -0.9981 3615257 ACon1_001621 CC(=O)OC(CCCCc1ccc(O)c(O)c1)CCc2ccc(O)c(O)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 A24 compound treatment 601057.6132 -97100.0 -0.45 561460.0 -139000.0 -0.74 -0.8383 -0.9714 3559182 ACon1_001622 COc1cc(cc(OC)c1O)C2OC[C@@H]3[C@H](OC[C@H]23)c4cc(OC)c(O)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B01 compound treatment 701994.7917 3830.0 0.02 703246.2312 2710.0 0.01 0.0226 0.9948 3615259 ACon1_001623 COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)[C@@H](OC3OC(CO)C(O)C(O)C3O)[C@H](C)O[C@H]2OCC4OC(Oc5c(oc6cc(O)cc(O)c6c5=O)c7ccc(O)cc7)C(O)C(O)C4O)cc(OC)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B02 compound treatment 741346.8468 43200.0 0.2 803726.087 103000.0 0.55 0.5278 0.9063 3615262 ACon1_001624 OCCCCCCCC=C(C(=O)O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B03 compound treatment 924066.0377 226000.0 1.04 912216.7488 212000.0 1.12 1.5305 0.9993 3615264 ACon1_001625 COC1CC(OC2CCC3(C)C(CCC4(O)C3CC(OC(=O)c5ccccc5)C6(C)C(O)(CCC64O)C(=O)C)C2)OC(C)C1OC7CC(OC)C(OC8OC(C)C(OC9OC(CO)C(O)C(O)C9O)C(OC)C8O)C(C)O7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B04 compound treatment 970428.5714 272000.0 1.26 911586.2069 211000.0 1.12 1.6794 0.9984 3615266 ACon1_001626 CN1C(=O)c2ccccc2-n3c(nc4ccccc4c3=O)[C@]51O[C@H]5c6ccccc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B05 compound treatment 40380.2817 -658000.0 -3.03 47880.597 -653000.0 -3.46 -4.5928 -0.9978 3615270 ACon1_001627 COc1c(Cc2ccccc2O)c(O)c(Cc3ccccc3O)c(O)c1C(=O)CCc4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B06 compound treatment 890074.8899 192000.0 0.89 848927.0833 148000.0 0.79 1.1823 0.9983 3615272 ACon1_001628 CCC(C)CC(C)/C=C\C1OC2=C(C(O)C1O)C(=O)OC2(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B07 compound treatment 924173.7089 226000.0 1.04 882641.3502 182000.0 0.97 1.42 0.9993 3615275 ACon1_001629 CC(=CCCC(C)(O)C(O)Cc1cc(cc(CC=C(C)C)c1O)C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B08 compound treatment 962880.0 265000.0 1.22 641389.7436 -59100.0 -0.31 0.6414 0.5089 3054974 ACon1_001630 COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]21 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B09 compound treatment 795395.7219 97200.0 0.45 757165.8031 56600.0 0.3 0.5294 0.981 3615278 ACon1_001631 CC(=O)c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(/C=C/C(C)(C)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B10 compound treatment 741704.8458 43500.0 0.2 741766.1692 41200.0 0.22 0.2966 0.9991 3559815 ACon1_001632 COc1cc(ccc1O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c3oc4cc(O)cc(O)c4c(=O)c3O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B11 compound treatment 769187.8173 71000.0 0.33 753818.5841 53300.0 0.28 0.4314 0.9973 3559060 ACon1_001633 COc1cc2OC[C@@H]3Oc4c5C[C@H](Oc5ccc4C(=O)[C@]3(O)c2cc1OC)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B12 compound treatment 721850.4673 23700.0 0.11 679657.6087 -20900.0 -0.11 -0.0011 -0.0069 3076873 ACon1_001634 COc1cc(O)c(CC=C(C)C)c(O)c1C(=O)/C=C/c2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B13 mock treatment 827415.8416 129000.0 0.6 869742.4242 169000.0 0.9 1.0561 0.9802 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B14 mock treatment 698887.0968 722.0 0.0 795573.6041 95000.0 0.5 0.3588 0.7118 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B15 compound treatment 723640.0 25500.0 0.12 678811.828 -21700.0 -0.12 0.0016 0.0097 3615283 ACon1_001635 COc1cc(oc(=O)c1C)C(C)C=C(C)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B16 compound treatment 668156.6265 -30000.0 -0.14 581508.982 -119000.0 -0.63 -0.5443 -0.8421 3615285 ACon1_001636 OC(=O)c1cc(O)c(O)c(O)c1c2c(O)c(O)c3oc(=O)c4cc(O)c(O)c5oc(=O)c2c3c45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B17 compound treatment 729068.7831 30900.0 0.14 675706.8063 -24800.0 -0.13 0.0076 0.0394 3615286 ACon1_001637 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](OC6OC(C(O)C(O)C6O)C(=O)O)C(CO)(CO)C5CC[C@]43C)[C@@H]2C1)C(=O)OC7OC(CO)C(OC8OC(CO)C(O)C(O)C8O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B18 compound treatment 685815.3153 -12400.0 -0.06 628846.5347 -71700.0 -0.38 -0.3091 -0.8041 3615290 ACon1_001638 C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@H]4O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)c(oc3c2)c7ccc(O)c(O)c7)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B19 compound treatment 843207.6923 145000.0 0.67 780681.2227 80100.0 0.43 0.7736 0.9761 3615295 ACon1_001639 COc1cc2c(cc1O)C(=O)CC3C(C)(C)C(=O)CCC32C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B20 compound treatment 654408.9069 -43800.0 -0.2 581406.1135 -119000.0 -0.63 -0.5895 -0.8887 3615297 ACon1_001640 CC1(CCO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CCC3C(=CCC4[C@@](C)(CCC[C@]34C)C(=O)O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B21 compound treatment 722219.3878 24100.0 0.11 750506.4935 50000.0 0.27 0.2658 0.9253 3615299 ACon1_001641 COC1(C)C(O)C(=O)C(=C(Oc2cc(C)cc(O)c2C)C1=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B22 compound treatment 638595.0704 -59600.0 -0.27 805687.8307 105000.0 0.56 0.2001 0.3219 3615301 ACon1_001642 COc1cc(/C=C/COC2OC(CO)C(O)C(O)C2O)cc3C(CO)C(Oc31)c4ccc(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B23 compound treatment 620245.7912 -77900.0 -0.36 727135.8025 26600.0 0.14 -0.1543 -0.3998 3615306 ACon1_001643 COc1cc2oc(cc(=O)c2c(OC)c1OC)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 B24 compound treatment 651046.875 -47100.0 -0.22 636325.5814 -64200.0 -0.34 -0.3945 -0.9764 3558267 ACon1_001644 C[C@@]12CC[C@@H](O)C(=C)C2C[C@@H](CC1)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C01 compound treatment 596296.8037 -102000.0 -0.47 638980.6763 -61600.0 -0.33 -0.563 -0.9842 3615308 ACon1_001645 COC(=O)[C@@H]1C[C@@]2(C=CC[N+]3([O-])CC[C@]45[C@H]23)C(C)[C@]51Nc6ccccc64 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C02 compound treatment 868082.6446 170000.0 0.78 744530.303 44000.0 0.23 0.7191 0.8795 3615312 ACon1_001646 OCC1OC(OCC2OC(OC(CCc3ccccc3)CC(=O)CCc4ccccc4)C(O)C(O)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C03 compound treatment 866085.7143 168000.0 0.77 871316.5138 171000.0 0.91 1.1881 0.997 3554647 ACon1_001647 COC(=O)C(=C)[C@]1(O[C@@]/23CC[C@@](C)(O)CC1=O)[C@H](C[C@@]3(C)OC(=O)\C2=C\C)OC(=O)C(=C)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C04 compound treatment 688733.6245 -9430.0 -0.04 681392.3445 -19100.0 -0.1 -0.1026 -0.9284 3615314 ACon1_001648 COc1cc(cc(OC)c1O)C(=O)OC[C@@]2(O)CO[C@H](OC3C(O)C(O)C(OC(C)/C=C/C4(O)C(C)CC(O)CC4(C)C)OC3CO)[C@@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C05 compound treatment 834645.0 136000.0 0.63 750423.8095 49900.0 0.26 0.6322 0.9259 3553387 ACon1_001649 CC(=O)OC1CC2C(C=C1C)C(C(CC2(C)O)OC(=O)/C(=C/CO)/CO)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C06 compound treatment 697649.7696 -516.0 0.0 763247.5248 62700.0 0.33 0.2335 0.702 3615318 ACon1_001650 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O)[C@@](C)(C5CC[C@]43C)C(=O)O)C2[C@H]1C)C(=O)OC6OC(COC7OC(CO)C(O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)C(O)C7O)C(O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C07 compound treatment 725128.2051 27000.0 0.12 689247.5248 -11300.0 -0.06 0.0456 0.3303 3558295 ACon1_001651 CC(C)c1cc2CCC3C(C)(C)C[C@H](O)C[C@]3(C)c2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C08 compound treatment 729678.5714 31500.0 0.15 805925.7642 105000.0 0.56 0.498 0.8623 3615325 ACon1_001652 CC1OC(OC2C(O)C(O)C(O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C6C7CC(C)(C)CC[C@@]7(CC[C@]65C)C(=O)OC8OC(CO)C(O)C(O)C8O)C3(C)C)OC2C(=O)O)C(OC9OCC(O)C(O)C9O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C09 compound treatment 886289.0995 188000.0 0.87 857706.6667 157000.0 0.83 1.2029 0.9998 3558212 ACon1_001653 C[C@@]1(O)CCC2[C@H](OC(=O)C2=C)[C@@H]3[C@H]1C[C@H](O)C3=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C10 compound treatment 660546.2963 -37600.0 -0.17 756458.5635 55900.0 0.3 0.0871 0.2534 3615328 ACon1_001654 CC1OC(OCC2OC(OCC3(C)C(O)CCC4(C)C3CCC5(C)C4CCC6C7=CC(C)(C)CCC7(CCC65C)C(=O)O)C(O)C(O)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C11 mock treatment 680450.0 -17700.0 -0.08 736989.6907 36500.0 0.19 0.0789 0.3761 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C12 mock treatment 834994.4134 137000.0 0.63 791894.7368 91400.0 0.48 0.7888 0.9915 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C13 compound treatment 803879.1667 106000.0 0.49 914730.5699 214000.0 1.14 1.1481 0.9286 3553489 ACon1_001655 CC(C)[C@@H](NC(=O)C)C(=O)O[C@H]1CCC(C)(C)[C@@H]2CCC3=C(COC3=O)[C@@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C14 compound treatment 62636.3636 -636000.0 -2.93 64000.0 -637000.0 -3.38 -4.4597 -0.9975 3615331 ACon1_001656 CCCCCCCCC/C=C/CCCCC(=O)C1C(=O)CCC(O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C15 mock treatment 737131.5789 39000.0 0.18 661219.8953 -39300.0 -0.21 -0.0204 -0.0741 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C16 mock treatment 709048.0349 10900.0 0.05 683877.9343 -16700.0 -0.09 -0.027 -0.2656 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C17 compound treatment 593656.0 -105000.0 -0.48 669515.8371 -31000.0 -0.16 -0.4571 -0.8976 3615336 ACon1_001657 OC(=O)C(OC(=O)/C=C/c1ccc(O)c(O)c1)C(OC(=O)/C=C/c2ccc(O)c(O)c2)C(OC(=O)/C=C/c3ccc(O)c(O)c3)C(OC(=O)/C=C/c4ccc(O)c(O)c4)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C18 compound treatment 728843.8819 30700.0 0.14 666621.6216 -33900.0 -0.18 -0.0272 -0.1187 3615339 ACon1_001658 CC(C)/C=C/C=C(\C)/CCC\C(=C\COc1c(O)cc2C(=O)NCc2c1O)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C19 compound treatment 106857.1429 -591000.0 -2.73 84121.9512 -616000.0 -3.27 -4.2401 -0.9959 3554116 ACon1_001659 CCC(C)[C@@H]1N(C)C(=O)[C@@H](CC(C)C)OC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](OC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](OC1=O)C(C)C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C20 compound treatment 704647.9592 6480.0 0.03 702735.7513 2200.0 0.01 0.0294 0.9158 3615343 ACon1_001660 C[C@H]1O[C@@H](O[C@H]2C[C@@H]3[C@@H](CC2(C)C)C4=CCC5[C@@]6(C)CC[C@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@@](C)(C=O)C6CC[C@@]5(C)[C@]4(C)CC3=O)[C@H](O)[C@@H](O)[C@@H]1O[C@@H]8O[C@@H]([C@@H](O)[C@H](O)[C@H]8O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C21 compound treatment 753440.9091 55300.0 0.25 686913.9344 -13600.0 -0.07 0.1292 0.4875 3558893 ACon1_001661 Oc1ccc(CCNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C22 compound treatment 680655.0 -17500.0 -0.08 758004.4843 57500.0 0.3 0.1584 0.5024 3559174 ACon1_001662 OC[C@H]1O[C@@H](Oc2cc(O)cc3OC(CC(=O)c23)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C23 compound treatment 738618.3575 40500.0 0.19 645744.5887 -54800.0 -0.29 -0.0736 -0.2131 3615348 ACon1_001663 OCC(=C)C(=O)O[C@H]1CC(=C)[C@@H]2C[C@H](O)C(=C)[C@@H]2[C@H]3OC(=O)C(CN4CCCC4C(=O)O)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 C24 compound treatment 788308.5938 90100.0 0.42 708177.686 7640.0 0.04 0.3226 0.7724 3559220 ACon1_001664 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)c(O)c5)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H]1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D01 compound treatment 839450.9804 141000.0 0.65 773569.3069 73000.0 0.39 0.7346 0.9692 3615352 ACon1_001665 C/C(=C\Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc3ccc(=O)oc13)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D02 compound treatment 767276.7857 69100.0 0.32 1003484.211 303000.0 1.61 1.3616 0.8312 3615355 ACon1_001666 O[C@@H]1CC(=O)c2cccc(O)c2[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D03 compound treatment 786226.087 88100.0 0.41 783780.9917 83200.0 0.44 0.5994 0.9991 3615359 ACon1_001667 OCCCCC/C=C\C/C=C\C(O)CC1CCC(CC(=O)O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D04 compound treatment 816898.3051 119000.0 0.55 582630.8411 -118000.0 -0.63 -0.055 -0.0662 3615363 ACon1_001668 COCC1OC(OC(C)(C)C2CCC3(C)C=C(CCC3O2)C4CCC5C4(C)CC(O)C6OC(CCC56C)C(C)(C)OC7OC(CO)C(O)C(O)C7NC(=O)C)C(NC(=O)C)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D05 compound treatment 685701.8868 -12500.0 -0.06 589626.4591 -111000.0 -0.59 -0.4566 -0.7725 3615365 ACon1_001669 Cc1cc(O)c2c(=O)c3c(cc(O)cc3oc2c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D06 compound treatment 131692.3077 -566000.0 -2.61 308664.5161 -392000.0 -2.08 -3.3169 -0.9936 3615368 ACon1_001670 CCC(C)C1NC(=O)C(CC(C)C)NC(=O)C(CC(=O)O)NC(=O)C(NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C(CCC(=O)N)NC(=O)CC(CCCCCCCCCC(C)C)OC1=O)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D07 compound treatment 721247.7477 23100.0 0.11 787915.0 87400.0 0.46 0.403 0.8475 3615370 ACon1_001671 CC(C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)COc2c3ccoc3cc4oc(=O)ccc24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D08 compound treatment 792954.3147 94800.0 0.44 761913.5135 61400.0 0.33 0.5393 0.9895 3554551 ACon1_001672 COC(=O)[C@]1(C)CC[C@@H](OC(=O)C)[C@@]2(C)[C@@H]3CC[C@@H]4C[C@]3([C@H](OC(=O)C)C4=C)[C@H](CC12)OC(=O)[C@]5(C)O[C@@H]5C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D09 compound treatment 784673.0038 86500.0 0.4 818610.8949 118000.0 0.63 0.7249 0.9763 3615375 ACon1_001673 ON1CCCCCNC(=O)CCC(=O)N(O)CCCCNC(=O)CCC(=O)N(O)CCCCNC(=O)CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D10 compound treatment 684503.8168 -13700.0 -0.06 697485.5769 -3050.0 -0.02 -0.056 -0.8608 3559785 ACon1_001674 COc1ccc(cc1)C2CC(=O)c3c(O)c(CC=C(C)C)c(O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D11 mock treatment 751157.3604 53000.0 0.24 892253.5211 192000.0 1.02 0.8918 0.8528 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D12 mock treatment 793416.6667 95300.0 0.44 677200.9804 -23300.0 -0.12 0.2231 0.4888 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D13 compound treatment 626392.9961 -71800.0 -0.33 686519.0476 -14000.0 -0.07 -0.2866 -0.8449 3559167 ACon1_001675 COc1cc(/C=C/CO)cc2[C@@H](CO)[C@H](Oc21)c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D14 compound treatment 662157.5758 -36000.0 -0.17 541402.0101 -159000.0 -0.84 -0.7143 -0.8303 3615378 ACon1_001676 CCCCCCc1cc(O)c(C)c(OC(=O)C)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D15 mock treatment 765123.6559 67000.0 0.31 778962.4413 78400.0 0.42 0.5125 0.9892 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D16 mock treatment 887959.3909 190000.0 0.88 765527.5229 65000.0 0.34 0.8627 0.917 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D17 compound treatment 788045.4545 89900.0 0.41 746518.8285 46000.0 0.24 0.4655 0.968 3615380 ACon1_001677 COc1cc(oc(=O)c1C)C(C)CC(C)(O)CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D18 compound treatment 886145.7286 188000.0 0.87 826137.931 126000.0 0.67 1.0841 0.9915 3615382 ACon1_001678 COC(=O)C[C@H]1C(C)(C)[C@H](OC(=O)C)[C@]2(O)CC3=C4CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D19 compound treatment 86800.0 -611000.0 -2.82 51036.3636 -650000.0 -3.44 -4.4296 -0.9951 3559250 ACon1_001679 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](OC6OC(C(O)C(O)C6O)C(=O)O)C(C)(C)C5CC[C@]43C)[C@@H]2C1)C(=O)OC7OC(CO)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D20 compound treatment 396870.9677 -301000.0 -1.39 60409.0909 -640000.0 -3.4 -3.3833 -0.9222 3615386 ACon1_001680 COc1ccc(/C=C/c2cc(OC)cc(O)c2CC=C(C)C)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D21 compound treatment 736444.9541 38300.0 0.18 752681.3725 52100.0 0.28 0.3204 0.9765 3615390 ACon1_001681 CC/C=C\CC/1C(=O)C=C\C1=C\CCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D22 compound treatment 316815.2174 -381000.0 -1.76 335758.6207 -365000.0 -1.93 -2.6116 -0.9989 3615393 ACon1_001682 CC1C2C(O)C(=O)C3(C)C(CCC4/C(=C(\CCC=C(C)C)/C(=O)O)/C(CC43C)OC(=O)C)C2(C)CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D23 compound treatment 637575.2212 -60600.0 -0.28 647220.5882 -53300.0 -0.28 -0.3975 -1.0 3559227 ACon1_001683 COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(COC(=O)c4ccc(O)c(OC)c4)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 D24 compound treatment 611655.9633 -86500.0 -0.4 677073.8916 -23500.0 -0.12 -0.3701 -0.8856 3615396 ACon1_001684 CCN1C[C@]2(C)CC[C@H](O)[C@]3([C@@H]4C[C@H]5[C@H](O)[C@@H]4[C@](O)(C[C@@H]5OC)C6[C@@H](OC)C32)[C@@H]61 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E01 mock treatment 718500.0 20300.0 0.09 671794.2857 -28700.0 -0.15 -0.0415 -0.2318 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E02 mock treatment 998948.3568 301000.0 1.39 804757.4257 104000.0 0.55 1.3717 0.9186 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E03 compound treatment 741435.8974 43300.0 0.2 730410.1124 29900.0 0.16 0.2531 0.9935 3557617 ACon1_001685 CC1CC[C@H](OC(=O)c2ccoc2)[C@@]3(C)[C@H](C[C@@H]4C[C@]13OC4(C)C)OC(=O)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E04 compound treatment 669206.0086 -29000.0 -0.13 814718.1818 114000.0 0.61 0.3338 0.5382 3615401 ACon1_001686 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCCc3ccc(O)c(O)c3)[C@H](O)[C@@H](OC(=O)/C=C/c4ccc(O)c(O)c4)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E05 compound treatment 784866.6667 86700.0 0.4 720513.834 20000.0 0.11 0.3577 0.8646 3557658 ACon1_001687 COc1c(oc2cc(O)cc(O)c2c1=O)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E06 compound treatment 704865.8537 6700.0 0.03 854579.9087 154000.0 0.82 0.5996 0.7333 3615406 ACon1_001688 CO[C@@H]1[C@@H](C)O[C@@H](OC2CC3C(=CC2(C)C=C)CCC4C(C)(C)C(CCC34C)O[C@@H]5O[C@@H](CO)[C@H](O)[C@H]5O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E07 compound treatment 882932.0388 185000.0 0.85 795950.2762 95400.0 0.51 0.9604 0.969 3552666 ACon1_001689 C[C@@H]1C[C@H]2OCC3=CCC[C@@H]([C@@]23CO)[C@]1(CC(O)c4ccoc4)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E08 compound treatment 748876.7123 50700.0 0.23 759375.5869 58800.0 0.31 0.386 0.9899 3615410 ACon1_001690 COC1OC(O)C(O)C21CC[C@@]3(O2)[C@H](C)C[C@H]4OC(=O)[C@@]5(C)CCC[C@]3(C)C45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E09 mock treatment 814778.7611 117000.0 0.54 901869.5652 201000.0 1.07 1.1354 0.9496 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E10 mock treatment 760644.8598 62500.0 0.29 779340.4255 78800.0 0.42 0.4993 0.9835 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E11 compound treatment 808505.4945 110000.0 0.51 735278.607 34700.0 0.18 0.4901 0.9056 3615414 ACon1_001691 CC(C)CCCC(C)(O)c1ccc(cc1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E12 compound treatment 788527.1739 90400.0 0.42 777004.4843 76500.0 0.41 0.5815 0.9999 3615416 ACon1_001692 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)CC[C@@]31O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E13 compound treatment 61409.0909 -637000.0 -2.94 88404.7619 -612000.0 -3.25 -4.3722 -0.9987 905 ACon1_001693 CO[C@@H]1[C@@H](OC(=O)N)[C@@H](O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E14 compound treatment 849889.4231 152000.0 0.7 747989.7959 47500.0 0.25 0.6727 0.9047 3615420 ACon1_001694 CC1CCC2(C)C(CC(O)C(O)C2(O)CO)C1(C)CCc3ccoc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E15 compound treatment 662380.531 -35800.0 -0.17 628542.0168 -72000.0 -0.38 -0.3867 -0.9296 3615422 ACon1_001695 OCC1OC(C(OC(=O)c2cc(O)c(O)c(O)c2)C(O)C1O)c3c(O)cc(O)c4c(=O)cc(oc34)c5ccccc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E16 compound treatment 746678.8618 48500.0 0.22 859195.7447 159000.0 0.84 0.7532 0.865 3615425 ACon1_001696 CCCCCC[C@H](O)/C=C/CC1=C(O)CC[C@H](O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E17 mock treatment 741487.3096 43300.0 0.2 744000.0 43500.0 0.23 0.3043 0.9975 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E18 mock treatment 760101.9417 61900.0 0.29 792027.933 91500.0 0.49 0.5451 0.9681 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E19 compound treatment 770725.6637 72600.0 0.33 702185.1852 1650.0 0.01 0.2428 0.7253 3558102 ACon1_001697 COc1ccc(cc1OC)[C@H]2OC[C@@H]3[C@H](OC[C@H]23)c4ccc(O)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E20 compound treatment 580122.093 -118000.0 -0.54 678212.5 -22300.0 -0.12 -0.4687 -0.8412 3558556 ACon1_001698 CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E21 compound treatment 732482.4121 34300.0 0.16 754324.4444 53800.0 0.29 0.3136 0.9613 3615429 ACon1_001699 OC(CCc1ccc(O)c(O)c1)CC(=O)CCc2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E22 compound treatment 762328.6385 64200.0 0.3 768066.6667 67500.0 0.36 0.4625 0.9955 3559178 ACon1_001700 CC1(CC(O)C2C=COC(OC3OC(CO)C(O)C(O)C3O)C21)OC(=O)/C=C/c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E23 compound treatment 792258.7719 94100.0 0.43 697593.9086 -2940.0 -0.02 0.2958 0.6812 3615432 ACon1_001701 CC(=O)NC(Cc1c[nH]c2cc(Cl)ccc12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 E24 compound treatment 720896.7136 22700.0 0.1 675895.5224 -24600.0 -0.13 -0.0183 -0.1092 3557371 ACon1_001702 COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)Oc3cc(C)c(C(=O)NC(C)C(=O)O)c(O)c3)c(O)c2)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F01 mock treatment 858647.0588 160000.0 0.74 718764.1026 18200.0 0.1 0.5917 0.7927 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F02 mock treatment 851131.8182 153000.0 0.71 877123.7624 177000.0 0.94 1.1611 0.9902 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F03 compound treatment 721287.5 23100.0 0.11 808591.623 108000.0 0.57 0.4807 0.8245 3615435 ACon1_001703 C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1CC(O)[C@@]2(C)C3CC[C@@H]4[C@]5(C[C@@]35CC(O)[C@]12C)CC[C@H](O[C@@H]6OC(CO)C(O)C(O)C6OC7OC(CO)C(O)C(O)C7O)C4(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F04 compound treatment 685088.2353 -13100.0 -0.06 674656.4103 -25900.0 -0.14 -0.1397 -0.9318 3615438 ACon1_001704 CC1OC(OC2C(O)C(O)C(CO)OC2Oc3c(oc4cc(OC5OC(C)C(O)C(O)C5O)cc(O)c4c3=O)c6ccc(O)c(O)c6)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F05 compound treatment 779125.5411 81000.0 0.37 863053.5714 163000.0 0.86 0.8735 0.9299 3615441 ACon1_001705 COC1CC(OC2CCC3(C)C(CCC4(O)C3CC(OC(=O)c5ccccc5)C6(C)C(O)(CCC64O)C(C)OC(=O)C)C2)OC(C)C1OC7CC(OC)C(OC8OC(C)C(OC9OC(CO)C(O)C(O)C9O)C(OC)C8O)C(C)O7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F06 compound treatment 841188.0342 143000.0 0.66 732265.4867 31700.0 0.17 0.5854 0.86 3554104 ACon1_001706 CCC(C)(NC(=O)C)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NC(CCC(=O)N)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F07 compound treatment 768587.3786 70400.0 0.32 712097.2222 11600.0 0.06 0.273 0.826 3615443 ACon1_001707 COc1cc(O)c2c(=O)oc(/C=C/C(=O)O)cc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F08 compound treatment 786656.3877 88500.0 0.41 819334.8416 119000.0 0.63 0.7341 0.9779 3559796 ACon1_001708 CC(=O)OC1CCC2(C)C(CC[C@@H]3[C@@H]2CCC4(C)C(CCC34O)C5=CC(=O)OC5)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F09 mock treatment 863151.2195 165000.0 0.76 778547.619 78000.0 0.41 0.8306 0.959 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F10 mock treatment 688650.2732 -9520.0 -0.04 702715.5556 2180.0 0.01 -0.0229 -0.5037 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F11 compound treatment 668092.7835 -30100.0 -0.14 685475.5556 -15100.0 -0.08 -0.1546 -0.9657 3615449 ACon1_001709 C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1CC[C@@]2(C)C3CC[C@@H]4[C@]5(C[C@@]35CC(O)[C@]12C)CC[C@H](OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)C4(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F12 compound treatment 530616.6008 -168000.0 -0.77 502295.3586 -198000.0 -1.05 -1.2899 -0.9885 3557871 ACon1_001710 OC(=O)[C@]1(C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](OC(=O)/C=C/c3ccc(O)c(O)c3)[C@@H](C1)OC(=O)/C=C/c4ccc(O)c(O)c4)OC(=O)/C=C/c5ccc(O)c(O)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F13 compound treatment 672295.3586 -25900.0 -0.12 754409.5238 53900.0 0.29 0.1177 0.3801 3553379 ACon1_001711 CC(=O)OC[C@]1(C)[C@H](CC[C@@]2(C)[C@H]1C[C@H](OC(=O)C)[C@@]3(C)Oc4cc(oc(=O)c4[C@H](O)[C@H]23)c5cccnc5)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F14 compound treatment 668062.2407 -30100.0 -0.14 717748.6034 17200.0 0.09 -0.0336 -0.2023 3615454 ACon1_001712 CC1CCC2C(C)(C)CCCC2(C)C1(O)C/C=C(\CCOC(=O)C)/C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F15 compound treatment 723080.5687 24900.0 0.11 671726.1411 -28800.0 -0.15 -0.0268 -0.1402 3615457 ACon1_001713 CC1CC(=O)C2=C(CCC3(O)C(O)c4c(O)cccc4C(=O)C23)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F16 compound treatment 770705.8824 72500.0 0.33 779321.267 78800.0 0.42 0.532 0.9939 3615460 ACon1_001714 OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(=O)cc(Oc5ccc(O)cc5)oc4c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F17 mock treatment 585495.7983 -113000.0 -0.52 672167.5676 -28400.0 -0.15 -0.4738 -0.8759 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F18 mock treatment 645574.6606 -52600.0 -0.24 765647.0588 65100.0 0.35 0.0727 0.1723 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F19 compound treatment 564795.9184 -133000.0 -0.62 701128.6307 592.0 0.0 -0.4327 -0.7035 3559265 ACon1_001715 COC(=O)C[C@H]1[C@@]2(C)[C@H](O[C@@H]3C[C@H](C(=C32)C)c4ccoc4)[C@@H]5OC[C@@]6(C)C5[C@]1(C)[C@H](C[C@H]6OC(=O)C)OC(=O)/C(=C/C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F20 compound treatment 670377.9904 -27800.0 -0.13 670311.0048 -30200.0 -0.16 -0.204 -0.9938 3615464 ACon1_001716 OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](O)[C@@H](Cl)[C@@](O)(COC(=O)c4ccccc4)[C@H]32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F21 compound treatment 562236.3014 -136000.0 -0.63 607300.3802 -93200.0 -0.49 -0.7929 -0.9931 3615468 ACon1_001717 C[C@H](CC/C=C(\C)/C(=O)OC1OC(CO)C(O)C1O)[C@H]2CC(O)[C@@]3(C)C4CC[C@@H]5[C@]6(C[C@@]46CC(O)[C@]23C)CC[C@H](O[C@@H]7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O)C5(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F22 compound treatment 680925.6198 -17200.0 -0.08 635193.9655 -65300.0 -0.35 -0.3013 -0.8473 3615471 ACon1_001718 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1C=CC43OC(=O)C(=C4)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F23 compound treatment 553485.8491 -145000.0 -0.67 478792.1147 -222000.0 -1.18 -1.3034 -0.9639 3615473 ACon1_001719 CCCCCCCCC#CC#C/C=C/CCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 F24 compound treatment 578331.6062 -120000.0 -0.55 578906.5934 -122000.0 -0.65 -0.8469 -0.997 3615477 ACon1_001720 COc1cc(nc(/C=N/O)c1SC)c2ccccn2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G01 compound treatment 699495.3704 1330.0 0.01 613383.7209 -87200.0 -0.46 -0.3225 -0.6977 3615480 ACon1_001721 C/C=C/C#CC#C[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)\C=C\CCCO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G02 compound treatment 647299.5392 -50900.0 -0.23 658321.9512 -42200.0 -0.22 -0.3242 -0.9997 3615484 ACon1_001722 CC1OC(Oc2ccc(cc2)c3cc(=O)c4c(O)cc(OC5OC(CO)C(O)C(O)C5O)cc4o3)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G03 mock treatment 688000.0 -10200.0 -0.05 681119.403 -19400.0 -0.1 -0.106 -0.9365 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G04 mock treatment 698413.9535 248.0 0.0 773985.9813 73400.0 0.39 0.2763 0.7092 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G05 compound treatment 768907.8341 70700.0 0.33 713303.1674 12800.0 0.07 0.2786 0.8361 3552804 ACon1_001723 C[C@@H]1O[C@@H](Oc2ccc(cc2)c3coc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc(O)c4c3=O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G06 compound treatment 458801.6194 -239000.0 -1.1 526574.0741 -174000.0 -0.92 -1.433 -0.996 3615487 ACon1_001724 OCC1OC(C(OC(=O)c2cc(O)c(O)c(O)c2)C(OC(=O)c3cc(O)c(O)c(O)c3)C1O)c4c(O)cc(O)c(C(=O)c5ccc(O)cc5)c4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G07 compound treatment 224538.4615 -474000.0 -2.18 183155.1724 -517000.0 -2.74 -3.4849 -0.9936 3557601 ACon1_001725 CO[C@@H]1[C@H]2OC(=O)[C@@]3(CCCC(C)(C)C23)c4c(O)c(O)c(cc14)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G08 compound treatment 583553.8462 -115000.0 -0.53 631943.9655 -68600.0 -0.36 -0.631 -0.9834 3615490 ACon1_001726 CC1(CO)CC[C@@]2(COC34C=CC5[C@@]6(C)CC[C@H](OC7OCC(O)C(O)C7O)[C@@](C)(CO)C6CC[C@@]5(C)[C@]4(C)CC2O)C3C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G09 compound treatment 710233.0097 12100.0 0.06 686869.2308 -13700.0 -0.07 -0.0119 -0.1303 3559858 ACon1_001727 CCCCC[C@H](O)[C@H](O)/C=C/[C@@H](O)CCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G10 compound treatment 554568.7023 -144000.0 -0.66 682408.6538 -18100.0 -0.1 -0.5362 -0.8014 3615494 ACon1_001728 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](OC(=O)/C=C/c3ccc(O)cc3)[C@H](O)[C@H]2O)[C@H]4[C@@H]1[C@H](O)C[C@]4(C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G11 compound treatment 506085.9107 -192000.0 -0.89 542430.83 -158000.0 -0.84 -1.2193 -0.9996 3557471 ACon1_001729 COC(=O)c1cccc2oc3cc(C)cc(O)c3c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G12 compound treatment 624378.1818 -73800.0 -0.34 627267.5439 -73300.0 -0.39 -0.5154 -0.9978 3615499 ACon1_001730 C[C@H]1CCc2cccnc2C(=O)OC[C@]3(C)O[C@@]45[C@H](OC(=O)C)[C@H]3[C@@H](OC(=O)C)[C@@H](OC(=O)C)[C@]5(COC(=O)C)[C@@H](OC(=O)c6ccccc6)[C@@H](O)[C@H](OC1=O)[C@]4(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G13 compound treatment 695789.0909 -2380.0 -0.01 586273.913 -114000.0 -0.61 -0.4363 -0.7198 3615503 ACon1_001731 CCCCCCCCCCCCCCCC(=O)CCO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G14 compound treatment 527263.6364 -171000.0 -0.79 545954.7325 -155000.0 -0.82 -1.1371 -0.9998 3557525 ACon1_001732 CC1OC(OC2C(O)C(OCCc3ccc(O)c(O)c3)OC(CO)C2OC(=O)/C=C/c4ccc(O)c(O)c4)C(OC5OCC(O)C(O)C5O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G15 compound treatment 648937.799 -49200.0 -0.23 584850.9804 -116000.0 -0.61 -0.5944 -0.9085 3615506 ACon1_001733 Cc1ccc(c(O)c1)C(O)(CO)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G16 compound treatment 573103.4483 -125000.0 -0.58 518870.0787 -182000.0 -0.96 -1.0892 -0.9699 3615508 ACon1_001734 COc1cc(CCC(O)CC(O)CCc2ccc(O)c(O)c2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G17 compound treatment 548129.1513 -150000.0 -0.69 511064.8855 -189000.0 -1.0 -1.1999 -0.9834 3615509 ACon1_001735 COc1cccc2C(=O)c3c(C(O)c12)c(SCC(NC(=O)C)C(=O)O)cc4C(O)C(C)CC(=O)c43 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G18 compound treatment 535483.871 -163000.0 -0.75 592236.0 -108000.0 -0.57 -0.9367 -0.9913 3615511 ACon1_001736 CCC(C)C(NC(=O)C(C)(C)NC(=O)C(C)(CC)NC(=O)C(N)Cc1c[nH]c2ccccc12)C(=O)NC(=O)CCC(NC(=O)C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G19 mock treatment 647592.0398 -50600.0 -0.23 587341.2322 -113000.0 -0.6 -0.5895 -0.9152 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G20 mock treatment 577772.2772 -120000.0 -0.56 599853.5565 -101000.0 -0.53 -0.7702 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G21 compound treatment 562304.3478 -136000.0 -0.63 633578.9474 -67000.0 -0.36 -0.6942 -0.9638 2106469 ACon1_001737 COc1ccc2ccc(=O)oc2c1C(O)C(O)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G22 compound treatment 666693.0693 -31500.0 -0.15 598462.2222 -102000.0 -0.54 -0.4855 -0.8661 3615514 ACon1_001738 COC1=CC(=O)OC1C(O)C(O)C(OC(=O)C)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G23 compound treatment 527703.7037 -170000.0 -0.79 525806.867 -175000.0 -0.93 -1.2112 -0.9966 3615516 ACon1_001739 C[C@@H]1O[C@@H](Oc2ccc(cc2O)C3Oc4cc(O)cc(O)c4C(=O)C3O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 G24 compound treatment 593528.0374 -105000.0 -0.48 496019.6078 -205000.0 -1.08 -1.1083 -0.9335 3559198 ACon1_001740 C[C@H]1[C@@]2(O)[C@H](CC3C4CC=C5C[C@H](CC[C@]5(C)C4CC[C@@]32C)O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)O[C@@]91CCC(C)CO9 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H01 compound treatment 749519.0476 51400.0 0.24 726472.2222 25900.0 0.14 0.2647 0.9666 3615520 ACon1_001741 CC(=O)OC[C@]1(C)[C@@H](CC[C@@]2(C)C3CCC4CC3(CC4(O)CO)CC[C@H]12)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H02 compound treatment 892497.4619 194000.0 0.9 903891.7526 203000.0 1.08 1.3964 0.9958 3615525 ACon1_001742 COC(=O)[C@H](O)[C@H]1C(C)(C)[C@H](OC(=O)C)[C@]2(O)CC3=C4CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H03 mock treatment 695107.1429 -3060.0 -0.01 738796.875 38300.0 0.2 0.1335 0.6564 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H04 mock treatment 736906.6667 38700.0 0.18 698073.6842 -2460.0 -0.01 0.1171 0.6537 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H05 compound treatment 633369.5652 -64800.0 -0.3 634951.1111 -65600.0 -0.35 -0.4573 -0.9971 3615530 ACon1_001743 COc1c(O)cc2c(=O)oc3c(OC)c(O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)cc5c(=O)oc1c2c53 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H06 compound treatment 666968.6099 -31200.0 -0.14 686114.5374 -14400.0 -0.08 -0.1558 -0.9563 3552916 ACon1_001744 C[C@H](/C=C/C=C(\C)/C(=O)N[C@H]1[C@@H](C)[C@@H](C)OC1=O)[C@H]2CC[C@@]3(C)[C@@H]4CCC5[C@]6(C[C@@]46CC[C@]23C)CC[C@H](O[C@@H]7O[C@H](CO)[C@@H](O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@H](O)[C@H]7O[C@@H]9O[C@H](CO[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)[C@@H](O)[C@H](O)[C@H]9O[C@@H]%11O[C@@H](C)[C@H](O)[C@@H](O)[C@H]%11O)C5(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H07 compound treatment 700313.6364 2150.0 0.01 635004.7619 -65500.0 -0.35 -0.2388 -0.6867 2060370 ACon1_001745 COc1cc2OCOc2cc1c3coc4c5C=CC(C)(C)Oc5c(OC)cc4c3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H08 compound treatment 633832.5581 -64300.0 -0.3 688689.7959 -11800.0 -0.06 -0.2542 -0.8383 3559797 ACon1_001746 CO[C@H]1C[C@H](OC2CCC3(C)[C@@H](CCC4C3CCC5(C)C(CC(OC(=O)C)C45O)C6=CC(=O)OC6)C2)O[C@@H](C)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H09 compound treatment 654857.7982 -43300.0 -0.2 687886.9565 -12600.0 -0.07 -0.1887 -0.8955 3615536 ACon1_001747 CC1OC(O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3CC=C5[C@@H]6CC(C)(C)C[C@@H](O)[C@]6(C)CC[C@]54C)[C@@]2(C)CO)C(OC7OC(C(O)C(O)C7OC8OCC(O)C(O)C8O)C(=O)O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H10 compound treatment 677147.9821 -21000.0 -0.1 647284.5528 -53300.0 -0.28 -0.2683 -0.8983 3559799 ACon1_001748 C[C@@H]1O[C@@H](OC2CCC3(C)[C@@H](CCC4C3CCC5(C)C(CCC45O)C6=CC(=O)OC6)C2)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H11 compound treatment 527918.8034 -170000.0 -0.79 527357.4879 -173000.0 -0.92 -1.2047 -0.9969 3055308 ACon1_001749 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H](C)[C@@H](O)C[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H12 compound treatment 559739.3939 -138000.0 -0.64 705311.0236 4770.0 0.03 -0.4335 -0.6785 3615541 ACon1_001750 CCCC1=CC(=O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H13 compound treatment 570192.1397 -128000.0 -0.59 612658.3333 -87900.0 -0.47 -0.7469 -0.9932 3558466 ACon1_001751 O[C@H]1Cc2c(O)cc(O)cc2O[C@H]1c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H14 compound treatment 616535.545 -81600.0 -0.38 522082.1918 -178000.0 -0.95 -0.9355 -0.9184 3615544 ACon1_001752 C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@](C)(C23)[C@]41CCC5(COC(O)C5)O4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H15 compound treatment 630473.43 -67700.0 -0.31 551774.0741 -149000.0 -0.79 -0.7787 -0.9177 3615548 ACon1_001753 COc1ccc(CO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(=O)C)c3cc(C)oc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H16 compound treatment 584536.3985 -114000.0 -0.52 546393.9394 -154000.0 -0.82 -0.9486 -0.9769 3615551 ACon1_001754 COc1cc2C[C@@H]3[C@H](COC3=O)[C@@H](OC(=O)C)c4cc5OCOc5cc4-c2c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H17 compound treatment 560336.5385 -138000.0 -0.64 554346.8468 -146000.0 -0.78 -0.9977 -0.9951 3615554 ACon1_001755 CC1OC(OCC2OC(O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CCC6=C5CC[C@]7(CCC(C)(C)CC67)C(=O)OC8OC(CO)C(O)C(O)C8O)C3(C)C)C(O)C(O)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H18 compound treatment 503798.4496 -194000.0 -0.9 476464.135 -224000.0 -1.19 -1.4742 -0.9903 3615558 ACon1_001756 C[C@@H]1O[C@H]2Oc3c(oc4cc(O)c(c(O)c4c3=O)-c5cc(/C=C/C(=O)OC[C@H]6O[C@@H](O[C@H]([C@H]1O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]6O)ccc5O)c7ccc(O)c(O)c7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H19 mock treatment 525367.0412 -173000.0 -0.8 534827.3092 -166000.0 -0.88 -1.185 -0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H20 mock treatment 492703.3898 -205000.0 -0.95 574059.2593 -126000.0 -0.67 -1.1443 -0.9857 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H21 compound treatment 613858.8235 -84300.0 -0.39 688486.7257 -12000.0 -0.06 -0.3201 -0.8124 3615562 ACon1_001757 CC1CCC2C(C)(C=O)C(O)CCC2(C)C1CC/C(=C\C(=O)O)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H22 compound treatment 597321.7822 -101000.0 -0.47 501229.7735 -199000.0 -1.06 -1.0763 -0.932 3558771 ACon1_001758 CC1CC[C@@]2(CC[C@]3(C(=O)O)C(=CCC4[C@@]5(C)CC[C@H](OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CC[C@]43C)C2C1C)C(=O)OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H23 compound treatment 507163.1579 -191000.0 -0.88 488397.3064 -212000.0 -1.13 -1.4185 -0.9927 3615567 ACon1_001759 COc1ccc2c3[C@H](OCC=C(C)C)[C@]4(O)N([C@H]5CC(C)(C)OO[C@H](C=C(C)C)n(c53)c2c1)C(=O)[C@@H]6CCCN6C4=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 H24 compound treatment 560464.1148 -138000.0 -0.64 551236.4532 -149000.0 -0.79 -1.009 -0.994 1055133 ACon1_001760 COc1ccc2C(OC(=O)c2c1OC)C3N(C)CCc4cc5OCOc5c(OC)c34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I01 compound treatment 607942.7313 -90200.0 -0.42 636250.0 -64300.0 -0.34 -0.5353 -0.9951 3615574 ACon1_001761 CNC1CCC23CC34CCC5(C)C(C(C)N(C)C(=O)C)C(O)CC5(C)C4CCC2C1=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I02 compound treatment 753796.3801 55600.0 0.26 710342.8571 9810.0 0.05 0.2182 0.8335 3615576 ACon1_001762 C[C@@H]1O[C@@H](OC(=O)[C@@]23CCC(C)(C)CC3C4=CCC5[C@@]6(C)C[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@](C)(CO)C6CC[C@@]5(C)[C@]4(C)C[C@H]2O)[C@@H](O[C@@H]8OC[C@@H](O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O[C@@H]%10OC[C@@H](O)[C@@H](O)[C@@H]%10O)[C@@H]9O)[C@H](O)[C@H]8O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I03 compound treatment 938894.0092 241000.0 1.11 681461.1111 -19100.0 -0.1 0.7135 0.64 3555361 ACon1_001763 COCC1C(=O)O[C@H]2C[C@@]3(C)OC(=O)/C(=C/C)/[C@]43CC[C@@](C)(O)CC(=O)[C@]12O4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I04 compound treatment 769879.3103 71700.0 0.33 642512.6904 -58000.0 -0.31 0.0162 0.0359 3615580 ACon1_001764 CC1(C)C[C@H]2C3=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)CC[C@]2(CC1O)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I05 mock treatment 731330.5785 33200.0 0.15 682323.8095 -18200.0 -0.1 0.0398 0.2202 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I06 mock treatment 696227.9793 -1940.0 -0.01 678437.7682 -22100.0 -0.12 -0.0892 -0.7588 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I07 compound treatment 459122.3629 -239000.0 -1.1 440017.2414 -261000.0 -1.38 -1.7566 -0.9937 3615585 ACon1_001765 O[C@@H]1[C@@H](COC(=O)/C=C/c2ccc(O)cc2)O[C@@H](Oc3cc(O)c4C(=O)CC(Oc4c3)c5ccc(O)cc5)[C@H](O)[C@H]1OC(=O)/C=C/c6ccc(O)cc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I08 compound treatment 665582.7338 -32600.0 -0.15 584509.8814 -116000.0 -0.62 -0.5414 -0.8547 3615588 ACon1_001766 C[C@H]1[C@H](O)C=CC2=CC(=O)[C@@](O)(C[C@]12C)C(=C)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I09 compound treatment 790025.4777 91900.0 0.42 603639.2405 -96900.0 -0.51 -0.0639 -0.0959 3554244 ACon1_001767 CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I10 compound treatment 741020.4082 42900.0 0.2 725879.845 25300.0 0.13 0.2348 0.9824 3615592 ACon1_001768 C[C@H]1CCc2ccncc2C(=O)OC[C@]3(C)O[C@@]45[C@H](OC(=O)C)[C@H]3[C@@H](OC(=O)C)[C@@H](OC(=O)C)[C@]5(COC(=O)C)[C@@H](OC(=O)C)[C@@H](O)[C@H](O)[C@]4(C)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I11 compound treatment 518739.6226 -179000.0 -0.83 594725.2747 -106000.0 -0.56 -0.9819 -0.9821 3555007 ACon1_001769 COc1cc(OC)c2c(O)c3C(=O)CC(C)(O)Oc3cc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I12 compound treatment 700438.7755 2270.0 0.01 613345.3815 -87200.0 -0.46 -0.3196 -0.6909 3615597 ACon1_001770 COC1OC(=O)C(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C43CO4)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I13 compound treatment 604301.6529 -93900.0 -0.43 703962.1622 3430.0 0.02 -0.2932 -0.6768 3615600 ACon1_001771 COc1ccc(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I14 compound treatment 521129.2517 -177000.0 -0.82 534763.8889 -166000.0 -0.88 -1.199 -0.9993 3615602 ACon1_001772 COc1cc(O)c-2c(CCc3cc(O)c(OC)cc32)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I15 compound treatment 501893.1034 -196000.0 -0.91 486529.2096 -214000.0 -1.14 -1.4427 -0.9937 3615604 ACon1_001773 O[C@@H]1[C@@H](Oc2c([C@H]3C[C@@H](Oc4cc(O)ccc34)c5ccc(O)c(O)c5)c(O)cc(O)c2C1=O)c6ccc(O)c(O)c6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I16 compound treatment 617505.0 -80700.0 -0.37 710525.2525 9990.0 0.05 -0.2256 -0.6003 3615608 ACon1_001774 CC1(C)C2CC[C@]3(C[C@H]4CC[C@H]3[C@@]52CC[C@@]1(O)OC5)CC4(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I17 compound treatment 671930.0412 -26200.0 -0.12 634288.2883 -66200.0 -0.35 -0.334 -0.8988 3615612 ACon1_001775 OC[C@H]1O[C@@H](Oc2ccc(C(=O)CCc3ccc(O)cc3)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I18 compound treatment 550273.4375 -148000.0 -0.68 557673.8351 -143000.0 -0.76 -1.0181 -0.9986 3558031 ACon1_001776 COc1ccc(/C=C/C(=O)OC2C(C)OC(OC3C4OC4(CO)C5C3C=COC5OC6OC(CO)C(O)C(O)C6O)C(O)C2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I19 compound treatment 676887.5 -21300.0 -0.1 791354.1667 90800.0 0.48 0.2712 0.5517 3554120 ACon1_001777 CCC(C)[C@@H]1N(C)C(=O)[C@H](OC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](OC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](OC1=O)C(C)C)C(C)C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I20 compound treatment 658618.6047 -39500.0 -0.18 707566.6667 7030.0 0.04 -0.1026 -0.5511 3559162 ACon1_001778 Oc1ccc(cc1)[C@H]2[C@H]([C@@H]3[C@H](c4ccc(O)cc4)c5ccc(O)cc5OC3=O)C(=O)Oc6cc(O)ccc26 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I21 mock treatment 642724.1379 -55400.0 -0.26 641396.2264 -59100.0 -0.31 -0.4026 -0.9949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I22 mock treatment 829561.6438 131000.0 0.61 613676.2295 -86900.0 -0.46 0.1027 0.1349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I23 compound treatment 695694.2149 -2470.0 -0.01 689783.27 -10800.0 -0.06 -0.0484 -0.832 3615618 ACon1_001779 COc1cc(CCC(=O)O)oc(=O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 I24 compound treatment 47859.6491 -650000.0 -3.0 51745.098 -649000.0 -3.44 -4.5539 -0.9977 3615620 ACon1_001780 CC(C)C(=C)CCC(C)[C@H]1CC=C2C3=C([C@@H](O)[C@H](OC(=O)C)[C@]12C)[C@@]4(C)C[C@@H](O)[C@H](O)C(C)(C)C4CC3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J01 compound treatment 676505.4348 -21700.0 -0.1 832995.2153 132000.0 0.7 0.4262 0.6005 3615624 ACon1_001781 CC(=CCc1c(O)ccc2cc(O)c(=O)oc12)COC3OC(CO)C(O)C(O)C3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J02 compound treatment 868775.2294 171000.0 0.79 619073.6434 -81500.0 -0.43 0.2508 0.2794 3615625 ACon1_001782 CC1OC(OC2C(O)C(OC3CCC4(C)C(CCC5(C)C4CC=C6C7CC(C)(C)CCC7(CCC65C)C(=O)OC8OC(CO)C(OC9OCC(OC%10OCC(O)C(O)C%10O)C(O)C9O)C(O)C8O)C3(C)C)OC(C2O)C(=O)O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J03 compound treatment 979004.4053 281000.0 1.3 733746.114 33200.0 0.18 1.0403 0.7959 3615627 ACon1_001783 CC1(CO)CC(O)[C@@]2(CCC34CC4(C=CC5[C@@]6(C)C[C@@H](O)[C@H](O)C(CO)(CO)C6CC[C@]53C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J04 compound treatment 716695.0673 18500.0 0.09 425265.0602 -275000.0 -1.46 -0.972 -0.6646 3558573 ACon1_001784 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@@]45CCC(C)(C)CC5C6=CCC7[C@@]8(C)CC[C@H](O)C(C)(C)C8CC[C@@]7(C)[C@]6(C)CC4)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J05 mock treatment 943348.0392 245000.0 1.13 787857.1429 87300.0 0.46 1.127 0.9224 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J06 mock treatment 718178.2178 20000.0 0.09 804844.3396 104000.0 0.55 0.4565 0.8138 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J07 compound treatment 738333.3333 40200.0 0.19 687507.6142 -13000.0 -0.07 0.0821 0.4154 3615632 ACon1_001785 COc1cc(O)cc(C)c1C(=O)Oc2cc(C)c(C(=O)Oc3cc(C)c(C(=O)NC(C)C(=O)O)c(O)c3)c(OC)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J08 compound treatment 777492.126 79300.0 0.37 718327.8689 17800.0 0.09 0.3254 0.8613 3559809 ACon1_001786 CO[C@H]1[C@@H](O)[C@@H](C)O[C@@H](OC2CCC3(C)C(CC[C@@H]4[C@@H]3CCC5(C)C(C(O)CC45O)C6=CC(=O)OC6)C2)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J09 compound treatment 603118.1435 -95000.0 -0.44 695131.2741 -5410.0 -0.03 -0.3302 -0.7517 3557709 ACon1_001787 COc1cc(cc(OC)c1O)C2C(COC3OC(CO)C(O)C(O)C3O)C(CO)Cc4cc(OC)c(O)c(OC)c24 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J10 compound treatment 666203.8835 -32000.0 -0.15 703728.5714 3190.0 0.02 -0.0923 -0.6218 3559803 ACon1_001788 CC12CC[C@H]3C(CCC4(O)CC(O)CCC34O)C2(O)CCC1C5=CC(=O)OC5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J11 compound treatment 690269.7674 -7900.0 -0.04 592294.3925 -108000.0 -0.57 -0.4317 -0.7504 3559166 ACon1_001789 COc1cc2OCOc2cc1c3coc4c5C=CC(C)(C)Oc5ccc4c3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J12 compound treatment 720807.5117 22600.0 0.1 703933.61 3400.0 0.02 0.0866 0.8171 3615637 ACon1_001790 O[C@@H]1CO[C@@H](OC(CCc2ccc(O)cc2)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J13 compound treatment 82358.209 -616000.0 -2.84 104288.4615 -596000.0 -3.16 -4.2443 -0.9986 3557350 ACon1_001791 C[C@@H]1CC(=O)c2c(C1)ccc3C(=O)c4c(O)cccc4C(=O)c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J14 compound treatment 254445.6522 -444000.0 -2.05 423407.8947 -277000.0 -1.47 -2.4863 -0.9868 3615642 ACon1_001792 CC1(CCCC2(C)C3CCC(=C)C(C=C)C3CCC12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J15 compound treatment 632573.3333 -65600.0 -0.3 587156.0 -113000.0 -0.6 -0.6391 -0.9494 3615644 ACon1_001793 Cc1cc2c(CO)cc(SCC(O)C(=O)O)cc2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J16 compound treatment 479974.359 -218000.0 -1.01 566928.8889 -134000.0 -0.71 -1.2126 -0.9853 3615646 ACon1_001794 OCC1OC(Oc2c(O)cccc2COC(=O)C3(O)C=CCCC3=O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J17 compound treatment 480884.4765 -217000.0 -1.0 520201.7544 -180000.0 -0.96 -1.3849 -0.9997 3615649 ACon1_001795 OC(CNC(=O)/C=C/c1ccc(O)cc1)c2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J18 compound treatment 507877.7778 -190000.0 -0.88 487468.75 -213000.0 -1.13 -1.4196 -0.9922 3615653 ACon1_001796 C[C@@H]1O[C@H]2Oc3c(oc4cc(O)c(c(O)c4c3=O)-c5cc(/C=C/C(=O)OC[C@H]6O[C@@H](O[C@H]([C@H]1O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]6O)ccc5O)c7ccc(O)cc7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J19 compound treatment 635487.5 -62700.0 -0.29 500942.3729 -200000.0 -1.06 -0.953 -0.8684 3615657 ACon1_001797 COCC1OC(OC(C)(C)C(O)CCC2(C)C/C(=C/3\CCC4C3(C)CC(O)C5OC(CCC45C)C(C)(C)OC6OC(COC)C(O)C(O)C6NC(=O)C)/CCC2O)C(NC(=O)C)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J20 compound treatment 472164.0 -226000.0 -1.04 513862.1795 -187000.0 -0.99 -1.4371 -0.9997 3615662 ACon1_001798 CC1OC(Oc2cc(O)c3c(=O)cc(oc3c2C4OC(CO)C(O)C(O)C4O)c5ccc(O)cc5)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J21 mock treatment 490261.5894 -208000.0 -0.96 561218.3406 -139000.0 -0.74 -1.2005 -0.9917 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J22 mock treatment 598148.4375 -100000.0 -0.46 494788.3212 -206000.0 -1.09 -1.0978 -0.9266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J23 compound treatment 596826.3305 -101000.0 -0.47 580100.0 -120000.0 -0.64 -0.7822 -0.9882 3615664 ACon1_001799 CC(C)CC1NC(=O)C(CC(C)C)N(O[C@@H]2O[C@H](COC(=O)CCC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 J24 compound treatment 535433.1797 -163000.0 -0.75 537808.4291 -163000.0 -0.86 -1.141 -0.9976 3615667 ACon1_001800 COc1ccc2nccc(C(O)[C@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K01 compound treatment 677854.8387 -20300.0 -0.09 692162.6794 -8370.0 -0.04 -0.0976 -0.9419 3615669 ACon1_001801 CCN1CC2(COC)CCC(O)C3(C4CC5C(O)C4C(O)(CC5OC)C6C(OC)C32)C61 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K02 compound treatment 825930.5556 128000.0 0.59 688017.4672 -12500.0 -0.07 0.3697 0.6235 3615671 ACon1_001802 CC1=CCC(CC1)C(C)(C)O[C@@H]2O[C@H](CO[C@@H]3O[C@H](COC(=O)c4cc(O)c(O)c(O)c4)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K03 compound treatment 813154.4402 115000.0 0.53 786159.292 85600.0 0.45 0.6961 0.997 3558951 ACon1_001803 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)C5CC[C@]43C)[C@@H]2C1)C(=O)O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K04 compound treatment 793153.8462 95000.0 0.44 689818.1818 -10700.0 -0.06 0.2696 0.6102 3615676 ACon1_001804 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3ccc(CC=C)cc3O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K05 compound treatment 803290.6404 105000.0 0.48 952751.073 252000.0 1.34 1.2887 0.9057 3555002 ACon1_001805 COc1cc(oc(=O)c1)[C@H](Cc2ccccc2)NC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K06 compound treatment 666249.1103 -31900.0 -0.15 648648.7603 -51900.0 -0.28 -0.2987 -0.957 3615680 ACon1_001806 C/C(=C/CCC(CO)C1CCC2(C)C3CCC4C5(CC35CCC12C)CCC(OC6OC(CO)C(O)C(O)C6O)C4(C)C)/COC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K07 mock treatment 676821.8623 -21300.0 -0.1 820491.2281 120000.0 0.64 0.3803 0.5907 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K08 mock treatment 638988.5496 -59200.0 -0.27 686776.3713 -13800.0 -0.07 -0.2446 -0.8658 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K09 compound treatment 678165.9574 -20000.0 -0.09 668480.5195 -32100.0 -0.17 -0.1854 -0.9587 3553885 ACon1_001807 CC1(CC(=O)O)CCC2(O1)C(=CCC3C(C)(C)C(O)CCC32C)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K10 compound treatment 625780.5907 -72400.0 -0.33 663809.1286 -36700.0 -0.19 -0.3738 -0.9671 3615685 ACon1_001808 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@@H](C[C@]3(C)OC(=O)C)OC(=O)/C=C\c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K11 compound treatment 697907.8014 -258.0 0.0 824551.5695 124000.0 0.66 0.4643 0.7058 3558491 ACon1_001809 COc1cc(ccc1O)[C@H]2OC[C@@H]3[C@H](OC[C@H]23)c4ccc(O)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K12 compound treatment 616896.2963 -81300.0 -0.37 597496.2963 -103000.0 -0.55 -0.6515 -0.9831 3615689 ACon1_001810 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@@H](C[C@]3(C)O)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K13 compound treatment 611761.5894 -86400.0 -0.4 653142.8571 -47400.0 -0.25 -0.4595 -0.9753 3557476 ACon1_001811 OCC1OC(C(O)C(O)C1O)c2c(O)c(C3OCC(O)C(O)C3O)c4oc(cc(=O)c4c2O)c5ccc(O)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K14 compound treatment 533296.5779 -165000.0 -0.76 544942.6523 -156000.0 -0.83 -1.1212 -0.9992 3615693 ACon1_001812 OC[C@H]1O[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K15 mock treatment 602408.0717 -95800.0 -0.44 626086.1244 -74500.0 -0.39 -0.5915 -0.9984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K16 mock treatment 582635.1351 -116000.0 -0.53 622956.3107 -77600.0 -0.41 -0.6677 -0.9918 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K17 compound treatment 572700.3891 -125000.0 -0.58 592816.7939 -108000.0 -0.57 -0.8131 -1.0 3615697 ACon1_001813 CC(=CCc1cc(CC(N)C(=O)O)ccc1O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K18 compound treatment 576180.2721 -122000.0 -0.56 590773.1959 -110000.0 -0.58 -0.8094 -0.9999 3615699 ACon1_001814 Cc1cc2C(=O)c3cc(O)cc(O)c3C(=O)c2c(O)c1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K19 compound treatment 533637.7358 -165000.0 -0.76 508568.0272 -192000.0 -1.02 -1.2565 -0.9895 1012497 ACon1_001815 NC(Cc1c[nH]c2ccccc12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K20 compound treatment 560181.07 -138000.0 -0.64 515296.0289 -185000.0 -0.98 -1.1447 -0.9779 3558198 ACon1_001816 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](OC(=O)/C=C/c6ccc(O)c(O)c6)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K21 compound treatment 578238.5965 -120000.0 -0.55 689728.8136 -10800.0 -0.06 -0.4316 -0.7762 3615703 ACon1_001817 COC(CCc1ccc(O)c(O)c1)CC(=O)CCc2ccc(O)c(O)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K22 compound treatment 623650.1901 -74500.0 -0.34 732709.0909 32200.0 0.17 -0.1223 -0.3188 3615705 ACon1_001818 C/C=C/C=C/C(=O)O[C@@H]1C=C(CO)[C@](O)(CO)[C@@]2(C)CCCC(C)(C)[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K23 mock treatment 586882.3529 -111000.0 -0.51 652206.422 -48300.0 -0.26 -0.5441 -0.9486 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 K24 mock treatment 569072.0721 -129000.0 -0.6 693425.1208 -7110.0 -0.04 -0.4476 -0.7504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L01 compound treatment 901820.5128 204000.0 0.94 803323.3831 103000.0 0.55 1.0496 0.9665 3557532 ACon1_001819 C[C@@H](O)/C=C/[C@@]1(O)C(C)(C)C[C@@H](C[C@@]1(C)O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L02 compound treatment 775087.8049 76900.0 0.35 622086.5801 -78400.0 -0.42 -0.0434 -0.0794 3615710 ACon1_001820 COc1c(O)c2c(=O)c(O)c(oc2cc1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L03 compound treatment 111735.8491 -586000.0 -2.7 101380.0 -599000.0 -3.18 -4.1594 -0.9968 3615714 ACon1_001821 COc1cc(O)c(C(=O)CCc2ccccc2)c(O)c1Cc3ccccc3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L04 compound treatment 849205.4795 151000.0 0.7 854455.3571 154000.0 0.82 1.0698 0.9969 3615716 ACon1_001822 C[C@@]1([C@H](O)CC[C@]2(C)C3CCC(=C)[C@H](C=C)[C@@H]3CC[C@@]12O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L05 compound treatment 1070327.586 372000.0 1.72 976522.3881 276000.0 1.46 2.2487 0.9969 3615720 ACon1_001823 COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C3C1C(O)C=C3CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L06 compound treatment 269495.3271 -429000.0 -1.98 290846.1538 -410000.0 -2.17 -2.9344 -0.9989 3557431 ACon1_001824 CC(C)CCCCCCCCC/C=C/C(=O)NC1C(O)C(O)C(CC(O)C2OC(C(O)C2O)n3ccc(=O)[nH]c3=O)OC1OC4OC(CO)C(O)C(O)C4NC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L07 mock treatment 855488.3721 157000.0 0.73 818281.9149 118000.0 0.62 0.9546 0.9972 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L08 mock treatment 771305.6769 73100.0 0.34 857347.032 157000.0 0.83 0.8266 0.921 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L09 compound treatment 811390.3509 113000.0 0.52 657643.1227 -42900.0 -0.23 0.2083 0.3658 3615722 ACon1_001825 COC1CC(OC2CCC3(C)C(CCC4(O)C3CC(O)C5(C)C(O)(CCC54O)C(=O)C)C2)OC(C)C1OC6CC(OC)C(OC7OC(C)C(O)C(OC)C7O)C(C)O6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L10 compound treatment 799329.3173 101000.0 0.47 767739.3162 67200.0 0.36 0.5819 0.9912 3559811 ACon1_001826 C[C@H]1O[C@H](C[C@H](OC(=O)C)[C@@H]1O)O[C@@H]2[C@@H](C)O[C@H](C[C@@H]2O)O[C@@H]3[C@@H](C)O[C@H](C[C@@H]3O)OC4CC(O)C5(C)C(CC[C@@H]6[C@@H]5CCC7(C)C(CCC67O)C8=CC(=O)OC8)C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L11 compound treatment 715700.7874 17500.0 0.08 811516.6052 111000.0 0.59 0.4734 0.7968 3615725 ACon1_001827 COC(=O)C(NC(=O)c1cccc(NC=O)c1O)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L12 compound treatment 704175.1152 6010.0 0.03 687839.5062 -12700.0 -0.07 -0.028 -0.3848 3615727 ACon1_001828 Cc1cc2C(=O)OC(c2c(O)c1)c3c(O)cccc3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L13 compound treatment 784601.6598 86400.0 0.4 660748.1203 -39800.0 -0.21 0.1326 0.2941 3557341 ACon1_001829 C[C@H]1[C@H]2[C@H](CC3[C@@H]4CC=C5C[C@H](CC[C@]5(C)C4CC[C@]23C)O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)O[C@@]91CC[C@@](C)(CO)O9 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L14 compound treatment 657213.3891 -41000.0 -0.19 642540.856 -58000.0 -0.31 -0.3511 -0.9726 3615729 ACon1_001830 COC1CC(OC2C(C)OC(CC2OC)OC3C(C)OC(CC3OC)OC4C(C)OCC(OC5C(O)C(O[C@H]6CC[C@]7(C)C8CC(OC(=O)c9ccccc9)[C@]%10(C)[C@@](O)(CC[C@]%10(O)[C@]8(O)CC=C7C6)C(=O)C)OC(CO)C5OC%11OC(CO)C(O)C(O)C%11O)C4OC)OC(C)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L15 mock treatment 637241.3793 -60900.0 -0.28 592000.0 -109000.0 -0.58 -0.6057 -0.9456 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L16 mock treatment 585617.5115 -113000.0 -0.52 629449.7817 -71100.0 -0.38 -0.6336 -0.9877 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L17 compound treatment 629141.6309 -69000.0 -0.32 598176.2115 -102000.0 -0.54 -0.609 -0.9676 3559248 ACon1_001831 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](CO)O[C@H]2OC(=O)[C@@]34CCC(C)(C)C[C@H]4C5=CCC6[C@@]7(C)C[C@H](O)[C@H](O[C@@H]8O[C@@H]([C@@H](O)[C@H](O)[C@H]8O)C(=O)O)[C@@](C)(CO)C7[C@H](O)C[C@@]6(C)[C@]5(C)C[C@H]3O)[C@H](O)[C@H](O)[C@H]1O[C@@H]9OC[C@@H](O)[C@H](O[C@H]%10OC[C@](O)(CO)[C@H]%10O)[C@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L18 compound treatment 687138.9961 -11000.0 -0.05 648414.3426 -52100.0 -0.28 -0.2314 -0.8234 3615734 ACon1_001832 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(COC(=O)c6cc(O)c(O)c(O)c6)C5[C@H](O)C[C@]43C)[C@@H]2C1)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L19 compound treatment 747790.6977 49600.0 0.23 615468.0851 -85100.0 -0.45 -0.1572 -0.3108 3615738 ACon1_001833 C/C(=C\CC(C)(C)CCC(=O)c1ccoc1)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L20 compound treatment 576051.1811 -122000.0 -0.56 574673.913 -126000.0 -0.67 -0.8703 -0.9964 3615742 ACon1_001834 OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](O)[C@@H]4O[C@]4(COC(=O)c5ccccc5)[C@H]32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L21 compound treatment 458742.6901 -239000.0 -1.1 477712.9032 -223000.0 -1.18 -1.6164 -0.9994 3559153 ACon1_001835 CC/C=C\C[C@H]1[C@@H](CCCCCCCC(=O)O)C=CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L22 compound treatment 468076.6129 -230000.0 -1.06 425542.7632 -275000.0 -1.46 -1.7817 -0.9878 3615746 ACon1_001836 Oc1ccc2C3Oc4cc5OCOc5cc4C3COc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L23 mock treatment 539287.5817 -159000.0 -0.73 588880.9524 -112000.0 -0.59 -0.9369 -0.9944 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 L24 mock treatment 575708.1545 -122000.0 -0.56 556390.7563 -144000.0 -0.76 -0.9399 -0.9889 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M01 compound treatment 477230.7692 -221000.0 -1.02 474898.3957 -226000.0 -1.2 -1.5667 -0.9968 3615749 ACon1_001837 COc1ccc2[nH]c3C4CC/5C(CO)C(Cc3c2c1)N4C\C5=C\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M02 compound treatment 696947.7912 -1220.0 -0.01 677325.0 -23200.0 -0.12 -0.091 -0.7386 3615752 ACon1_001838 C[C@@H]1O[C@@H](OC(=O)[C@@]23CCC(C)(C)CC3C4=CCC5[C@@]6(C)C[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@](C)(CO)C6CC[C@@]5(C)[C@]4(C)C[C@H]2O)[C@@H](O[C@@H]8OC[C@@H](O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O[C@@H]%10OC[C@@H](O)[C@H](O)[C@H]%10O)[C@@H]9O)[C@H](O)[C@H]8O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M03 compound treatment 776318.7773 78200.0 0.36 791471.5447 90900.0 0.48 0.5959 0.9897 3557747 ACon1_001839 C/C(=C\C(=O)O)/CCC1C(C)(O)CCC2C(C)(CO)CCCC12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M04 compound treatment 831784.0376 134000.0 0.62 679790.795 -20700.0 -0.11 0.3579 0.5718 3615755 ACon1_001840 CCC(C)CCC(O)C1CC(CO)OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M05 compound treatment 800886.4629 103000.0 0.47 657324.0 -43200.0 -0.23 0.1729 0.3285 3554765 ACon1_001841 COc1c(O)c2c(CCC3C(C)(C)[C@@H]4CC[C@@]32C(=O)O4)cc1C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M06 compound treatment 699216.73 1050.0 0.0 712178.8618 11600.0 0.06 0.0471 0.7603 3615758 ACon1_001842 COc1ccc(/C=C/C(=O)O[C@H]2[C@H](C)O[C@@H](O[C@@H]3C=C(CO)[C@@H]4[C@H]3C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@@H]2O)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M07 compound treatment 644877.1331 -53300.0 -0.25 634283.6879 -66300.0 -0.35 -0.4222 -0.9847 812 ACon1_001843 COC1=CC(=O)C[C@@H](C)[C@@]21Oc3c(C2=O)c(OC)cc(OC)c3Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M08 compound treatment 667867.9245 -30300.0 -0.14 708605.9322 8070.0 0.04 -0.0685 -0.469 3615763 ACon1_001844 CCCCCC/C=C\[N+](=N[C@@H](COC)[C@H](C)O)[O-] 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M09 mock treatment 656018.7266 -42100.0 -0.19 616964.9123 -83600.0 -0.44 -0.4509 -0.9315 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M10 mock treatment 638242.6471 -59900.0 -0.28 656145.6311 -44400.0 -0.24 -0.3619 -0.9968 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M11 compound treatment 636227.4368 -61900.0 -0.29 704433.3333 3900.0 0.02 -0.1874 -0.6542 3615766 ACon1_001845 CCC/C=C/C=C/C1CC(O)C(O)C1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M12 compound treatment 610301.0753 -87900.0 -0.41 522071.4286 -178000.0 -0.95 -0.9558 -0.9283 3615770 ACon1_001846 CC1CC(=O)CC(C)(C)C1(O)/C=C/C(CO)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M13 mock treatment 573014.4928 -125000.0 -0.58 656601.5326 -43900.0 -0.23 -0.5729 -0.9204 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M14 mock treatment 595376.3441 -103000.0 -0.47 702869.863 2330.0 0.01 -0.3264 -0.6884 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M15 compound treatment 528143.8596 -170000.0 -0.78 586003.7037 -115000.0 -0.61 -0.984 -0.992 3615774 ACon1_001847 OC1Cc2c(OC1c3ccc(O)c(O)c3)cc(O)c4C(CC(Oc24)c5ccc(O)c(O)c5)c6ccc(O)c(O)c6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M16 compound treatment 640162.5442 -58000.0 -0.27 569704.5455 -131000.0 -0.69 -0.6798 -0.9141 3615776 ACon1_001848 COc1cc(CCC(O)CC(=O)CCc2ccc(O)cc2)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M17 compound treatment 645310.8108 -52900.0 -0.24 675057.7778 -25500.0 -0.14 -0.2679 -0.9613 3615778 ACon1_001849 COc1c(O)c(C(=O)CCc2ccccc2)c(OC)c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M18 compound treatment 614238.2813 -83900.0 -0.39 558780.3279 -142000.0 -0.75 -0.8053 -0.9523 3615780 ACon1_001850 CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC(O)C2(CC1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M19 compound treatment 548421.5686 -150000.0 -0.69 539761.2903 -161000.0 -0.85 -1.0913 -0.9945 3615782 ACon1_001851 CC(C)(C=C)[C@]12C[C@@H]3N([C@@H]2Nc4ccccc41)C(=O)c5ccccc5NC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M20 compound treatment 611530.0353 -86600.0 -0.4 663087.5912 -37400.0 -0.2 -0.423 -0.948 3615785 ACon1_001852 CC1=CC2OC3[C@H](O)C[C@@](C)([C@@]43CO4)[C@@]2(CO)CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M21 compound treatment 507605.2632 -191000.0 -0.88 580991.2281 -120000.0 -0.63 -1.0698 -0.9872 3615790 ACon1_001853 CC1C[C@]2(CC3C(C)(C)[C@@]4(C[C@]53CN2C1=O)C(=O)Nc6c4ccc7OC(C)(C)CC(=O)c67)C(=O)N5C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M22 compound treatment 599544.2177 -98600.0 -0.45 515307.947 -185000.0 -0.98 -1.0163 -0.9387 3557357 ACon1_001854 CC(C)[C@@H](OC(=O)C)c1nc2ccccc2c(=O)n1[C@@H]3C[C@]4(OC3=O)[C@H]5N(O)[C@@H](C)C(=O)N5c6ccccc64 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M23 compound treatment 426670.412 -271000.0 -1.25 454624.5614 -246000.0 -1.3 -1.8076 -0.9998 3559013 ACon1_001855 Oc1ccc(cc1)[C@@H]2Oc3cc(O)cc(O)c3C(=O)[C@H]2c4c(O)cc(O)c5c(=O)cc(oc45)c6ccc(O)cc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 M24 compound treatment 557562.5 -141000.0 -0.65 547955.2846 -153000.0 -0.81 -1.0307 -0.994 3559205 ACon1_001856 COc1cc(cc(OC)c1OC)[C@H]2OC[C@@H]3[C@@H](OC[C@H]23)c4cc(OC)c(OC)c(OC)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N01 compound treatment 812430.622 114000.0 0.53 771046.9484 70500.0 0.37 0.6371 0.9859 3615795 ACon1_001857 COC1CC(OC2CCC3(C)C(CCC4(O)C3CC(O)C5(C)C(O)(CCC54O)C(C)O)C2)OC(C)C1OC6CC(OC)C(OC7OC(C)C(O)C(OC)C7O)C(C)O6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N02 compound treatment 863697.3684 166000.0 0.76 801221.7391 101000.0 0.53 0.9174 0.9847 3615797 ACon1_001858 C[C@@H]1OC(=O)[C@]2(C(=C)[C@@]3(C)OC(=O)[C@@]12O)C4(C)CC[C@]5(C=CC(=O)OC5(C)C)C(=C4[C@H]3OC(=O)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N03 compound treatment 856010.0503 158000.0 0.73 762597.9381 62100.0 0.33 0.7475 0.9356 3615800 ACon1_001859 C/C=C/C1C2OC3=C(C(=O)OC3(C)O)C(=O)C1(C)C4CC(O)C(C)CC4C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N04 compound treatment 819069.1244 121000.0 0.56 839085.7143 139000.0 0.73 0.9139 0.9907 3615805 ACon1_001860 COc1cc(ccc1O)[C@@H](O)[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc3ccc(/C=C/CO)cc3OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N05 compound treatment 747979.4239 49800.0 0.23 659663.7931 -40900.0 -0.22 0.0091 0.029 3615808 ACon1_001861 C/C(=C\Cc1c(O)ccc2ccc(=O)oc12)/CO[C@@H]3O[C@H](COC(=O)CC(=O)OC[C@H]4O[C@@H](OC(C)(C)C5Cc6cc7cc(O)c(=O)oc7cc6O5)[C@H](O)[C@@H](O)[C@@H]4O)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N06 compound treatment 658313.5593 -39900.0 -0.18 699709.5238 -827.0 0.0 -0.1331 -0.7238 3557396 ACon1_001862 COC(=O)c1cc(C)cc(OC)c1C2=C(O)C(=O)c3c(O)cccc3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N07 compound treatment 644188.4058 -54000.0 -0.25 743067.6329 42500.0 0.23 -0.0165 -0.0491 3615812 ACon1_001863 COc1cc-2c(CCc3cc(O)c(O)cc32)c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N08 compound treatment 742108.6957 43900.0 0.2 801212.1212 101000.0 0.53 0.5209 0.912 3557452 ACon1_001864 C[C@@]12CCC3C(CC[C@@H]4C[C@H](O)CC[C@@]43C)C2CC[C@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N09 mock treatment 759562.5 61400.0 0.28 739061.2245 38500.0 0.2 0.3447 0.9872 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N10 mock treatment 802480.7692 104000.0 0.48 735351.7588 34800.0 0.18 0.4707 0.9135 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N11 compound treatment 705369.8113 7200.0 0.03 639700.8197 -60800.0 -0.32 -0.2047 -0.631 3615814 ACon1_001865 CC1CC(=O)C2=C(CCC34OC42C(=O)c5cccc(O)c5C3O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N12 compound treatment 724558.5586 26400.0 0.12 622527.4725 -78000.0 -0.41 -0.2065 -0.4788 3554299 ACon1_001866 CCCCCCCCCC[C@H](C(=O)O)[C@@](O)(CCC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N13 mock treatment 731959.276 33800.0 0.16 745466.6667 44900.0 0.24 0.2787 0.9788 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N14 mock treatment 616085.7143 -82100.0 -0.38 636189.9225 -64300.0 -0.34 -0.509 -0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N15 compound treatment 723642.5993 25500.0 0.12 706983.1224 6450.0 0.03 0.1073 0.8765 2121 ACon1_001867 Oc1ccc(cc1)c2oc3cc(O)cc(O)c3c(=O)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N16 compound treatment 695151.5152 -3010.0 -0.01 733188.6792 32700.0 0.17 0.1126 0.6483 3615816 ACon1_001868 CC(C1CC(O)C(C)(C)O1)C2CC[C@@]3(C)C4CC[C@H]5C(C)C(CC[C@]65C[C@@]46CC[C@]23C)OC7OC(COC(=O)C)C(OC8OC(CO)C(OC9OC(CO)C(O)C(O)C9O)C(OC%10OC(C)C(O)C(O)C%10O)C8O)C(OC(=O)C)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N17 compound treatment 631964.6018 -66200.0 -0.31 660337.3494 -40200.0 -0.21 -0.3666 -0.9846 3615822 ACon1_001869 CC12CC(OC(=O)C2CCC3(C)C1C4OC(=O)C3(O)C5OC54)c6ccoc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N18 compound treatment 560688.9764 -137000.0 -0.63 611187.5 -89300.0 -0.47 -0.7834 -0.9897 3615824 ACon1_001870 C/C(=C\Cc1c(O)cc2oc(C)cc(=O)c2c1O)/CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N19 compound treatment 551445.122 -147000.0 -0.68 689155.7093 -11400.0 -0.06 -0.5211 -0.7671 3615829 ACon1_001871 COCC1OC(OC(C)(C)C2CCC3(C)C4CC/C(=C\5/CCC(O)C(C)(CCC(O)C(C)(C)O)C5)/C4(C)CC(O)C3O2)C(NC(=O)C)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N20 compound treatment 659171.7172 -39000.0 -0.18 585244.898 -115000.0 -0.61 -0.5596 -0.8779 3615833 ACon1_001872 CCCCCC1CC(CC(=O)O1)OC2OC(CO)C(O)C(O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N21 compound treatment 572460.2649 -126000.0 -0.58 589634.6749 -111000.0 -0.59 -0.8259 -1.0 3554654 ACon1_001873 COC(=O)C[C@H]1[C@@]2(C)[C@H](O[C@@H]3C[C@H](C(=C32)C)c4ccoc4)[C@H](O)C5[C@@](C)(C=CC(=O)[C@]15C)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N22 compound treatment 503795.6989 -194000.0 -0.9 607954.3568 -92600.0 -0.49 -0.9811 -0.9599 3558591 ACon1_001874 CC(=CCC[C@@](C)(O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N23 compound treatment 626770.3927 -71400.0 -0.33 602692.8839 -97800.0 -0.52 -0.5998 -0.9759 3615837 ACon1_001875 C[C@@H]1CCC2C(C)(C)[C@@H](CC[C@]2(C)[C@]31Cc4c(O3)c5CNC(=O)c5cc4O)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 N24 compound treatment 514656.9343 -184000.0 -0.85 569939.1304 -131000.0 -0.69 -1.0882 -0.9951 3615844 ACon1_001876 COC(=O)C12C(O)C34CC2N5C/C(=C/C)/C1CC5C4N(C)c6ccccc63 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O01 compound treatment 427326.3158 -271000.0 -1.25 356107.8431 -344000.0 -1.83 -2.175 -0.9828 3615850 ACon1_001877 COc1cc2CCNC3Cc4ccccc4-c(c1OC)c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O02 compound treatment 646013.1579 -52200.0 -0.24 544372.6236 -156000.0 -0.83 -0.7558 -0.8762 3615852 ACon1_001878 C[C@@H]1O[C@@H](OC2C(O)C(O)C(CO)OC2O[C@@H]3[C@@H](O)[C@H](O)[C@H](O[C@H]3O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC=C7C8CC(C)(C)C(O)C(O)[C@]8(C)CC[C@]76C)C4(C)C)C(=O)O)[C@H](O)[C@H](O)[C@H]1OC9OCC(O)C(O)C9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O03 compound treatment 654777.7778 -43400.0 -0.2 674326.2712 -26200.0 -0.14 -0.2398 -0.9842 3552644 ACon1_001879 C[C@@H]1C[C@]2(O[C@H](O)[C@@]3(C)O[C@H]32)O[C@H]4C[C@@]5(C)[C@@H]6CC[C@@H]7[C@]8(C[C@@]68C[C@@H](OC(=O)C)[C@]5(C)[C@H]41)CC[C@H](O[C@@H]9OC[C@@H](O)[C@H](O)[C@H]9O)C7(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O04 compound treatment 817817.8138 120000.0 0.55 749106.1947 48600.0 0.26 0.5723 0.9398 3615859 ACon1_001880 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)C5CC[C@]43C)[C@@H]2C1)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O05 compound treatment 795497.992 97300.0 0.45 753270.9163 52700.0 0.28 0.5152 0.9741 3558011 ACon1_001881 CC(=O)OC[C@]1(C)CC2[C@]3(CO[C@]42CCC5[C@@]6(C)CC[C@H](O[C@@H]7OC[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)[C@@](C)(CO)C6CC[C@@]5(C)[C@]4(C)C[C@H]3OC%10OCC(OC%11OC(CO)C(O)C(O)C%11O)C(O)C%10O)[C@@H](O)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O06 compound treatment 724139.0135 26000.0 0.12 726436.5482 25900.0 0.14 0.1818 0.9977 3615865 ACon1_001882 CC1C2CC3(CC(O)C4C(C)(CCCC4(C)C3(O)CC2)C(=O)OC5OC(CO)C(O)C(O)C5O)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O07 compound treatment 681462.1514 -16700.0 -0.08 614744.4934 -85800.0 -0.46 -0.3762 -0.8152 3554487 ACon1_001883 CN1C(Cc2ccccc2)C(=O)Nc3ccccc3C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O08 compound treatment 716326.4463 18200.0 0.08 693567.2269 -6970.0 -0.04 0.0331 0.3614 3615867 ACon1_001884 CC(=O)O[C@@H]1C[C@@]2(CO2)[C@](O)(CCc3ccoc3)[C@]4(CCC[C@@]5(C)C14)COC5=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O09 compound treatment 679003.6496 -19200.0 -0.09 625527.972 -75000.0 -0.4 -0.3438 -0.8436 3615872 ACon1_001885 COC(=O)c1cccc(OC(C)C(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O10 compound treatment 692276.9784 -5890.0 -0.03 739815.331 39300.0 0.21 0.1281 0.6098 3615878 ACon1_001886 CC1C(C)c2cccnc2C(=O)OC[C@]3(C)O[C@@]45[C@H](OC(=O)C)[C@H]3[C@@H](OC(=O)C)[C@@H](OC(=O)C)[C@]5(COC(=O)C)[C@@H](OC(=O)C)[C@@H](O)[C@H](OC1=O)[C@]4(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O11 mock treatment 651735.7724 -46400.0 -0.21 629777.2926 -70800.0 -0.38 -0.4168 -0.9646 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O12 mock treatment 631985.6459 -66200.0 -0.31 624399.0385 -76100.0 -0.4 -0.5014 -0.9905 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O13 compound treatment 605056.1224 -93100.0 -0.43 570773.4807 -130000.0 -0.69 -0.7903 -0.9742 3615884 ACon1_001887 CCCCCc1cc(OC)c(CC=C(C)C)c(O)c1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O14 compound treatment 594417.0404 -104000.0 -0.48 608620.8531 -91900.0 -0.49 -0.683 -1.0 3615887 ACon1_001888 CC(C)(O)C(O)Cc1cc(O)ccc1OC2OC(CO)C(O)C(O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O15 compound treatment 615150.9434 -83000.0 -0.38 576316.9811 -124000.0 -0.66 -0.7366 -0.9666 3558264 ACon1_001889 O[C@@H]1C[C@](C[C@@H](O)[C@H]1OC(=O)/C=C/c2ccc(O)c(O)c2)(OC(=O)/C=C/c3ccc(O)c(O)c3)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O16 compound treatment 662388.4615 -35800.0 -0.16 585793.9914 -115000.0 -0.61 -0.547 -0.8675 3615891 ACon1_001890 CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@@]2(C)C(C[C@@H](O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C5OC543)c6ccoc6)C1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O17 compound treatment 583685.1852 -114000.0 -0.53 591697.479 -109000.0 -0.58 -0.7815 -0.999 3615895 ACon1_001891 OC[C@H]1O[C@@H](OCc2ccccc2)[C@H](O[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O18 compound treatment 716696.9697 18500.0 0.09 623470.1195 -77100.0 -0.41 -0.2286 -0.5474 3615900 ACon1_001892 COC(=O)c1cc2cc(O)c(c(O)c2c(=O)o1)c3c(O)cc4cc(oc(=O)c4c3O)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O19 compound treatment 551833.3333 -146000.0 -0.67 577539.6825 -123000.0 -0.65 -0.9385 -0.9999 3615903 ACon1_001893 CC(=O)NC(CSC(CO)CCCCCCCCCC(=O)O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O20 compound treatment 590819.2308 -107000.0 -0.5 589149.1935 -111000.0 -0.59 -0.7678 -0.9961 3559173 ACon1_001894 COc1cc(OC)c(cc1OC)C(O)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O21 compound treatment 442309.9415 -256000.0 -1.18 527623.6934 -173000.0 -0.92 -1.4828 -0.9922 3615908 ACon1_001895 Cn/1c(=O)\c(=C\c2ccccc2)\n(C)c(=O)\c1=C\c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O22 compound treatment 487183.1502 -211000.0 -0.97 527311.2033 -173000.0 -0.92 -1.3377 -0.9996 3559164 ACon1_001896 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](CO)O[C@@H](OCCc3ccc(O)c(O)c3)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O23 compound treatment 556415.7303 -142000.0 -0.65 607370.3704 -93200.0 -0.49 -0.8117 -0.9905 3615916 ACon1_001897 CCC/C=C/C=C/C1CC(O)C(O)C(O)C1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 O24 compound treatment 526177.9359 -172000.0 -0.79 497314.6853 -203000.0 -1.08 -1.323 -0.9886 3557540 ACon1_001898 COc1cc(O[C@@H]2O[C@H](CO[C@H]3OC[C@](O)(CO)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P01 compound treatment 601975.1244 -96200.0 -0.44 661710.0 -38800.0 -0.21 -0.4593 -0.9391 3615923 ACon1_001899 C[C@H](CC/C=C(\C)/C(=O)OC1OC(CO)C(O)C(O)C1O)[C@H]2CC(O)[C@@]3(C)C4CC[C@@H]5[C@]6(C[C@@]46CC(O)[C@]23C)CC[C@H](O[C@@H]7OC(COC8OCC(O)C(O)C8O)C(O)C(O)C7O)C5(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P02 compound treatment 599618.5567 -98500.0 -0.45 642009.8522 -58500.0 -0.31 -0.5409 -0.9827 3615928 ACon1_001900 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O)[C@H]8O)C(C)(C)C5CC[C@]43C)[C@@H]2C1)C(=O)O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P03 compound treatment 749581.9672 51400.0 0.24 776742.7386 76200.0 0.4 0.4535 0.9677 3615934 ACon1_001901 CC1(C)C[C@H]2C3=CCC4[C@@]5(C)CC[C@H](OC6OC(C(O)C(O)C6OC7OC(CO)C(O)C(O)C7O)C(=O)O)[C@](C)(CO)C5CC[C@@]4(C)C3(C)CC[C@@]2(C)[C@H](OC8OCC(O)C(OC9OC(CO)C(O)C(O)C9O)C8O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P04 compound treatment 333033.557 -365000.0 -1.68 243182.4324 -457000.0 -2.43 -2.906 -0.9841 3615941 ACon1_001902 CCC(C)CCCCCCCCC1CC(=O)NC(CCC(=O)N)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)NC(CC(C)C)C(=O)NC(C(C)C)C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P05 compound treatment 605810.6996 -92400.0 -0.43 668781.5126 -31800.0 -0.17 -0.4203 -0.9176 3615944 ACon1_001903 COC1CC(OC2CCC3(C)C(CCC4(O)C3CC(OC(=O)c5ccccc5)C6(C)C(O)(CCC64O)C(=O)C)C2)OC(C)C1OC7CC(OC)C(OC8OC(C)C(OC9OC(CO)C(OC%10OC(CO)C(O)C(O)C%10O)C(O)C9O)C(OC)C8O)C(C)O7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P06 compound treatment 654737.7049 -43400.0 -0.2 565040.6091 -135000.0 -0.72 -0.6498 -0.871 3553131 ACon1_001904 C[C@H]1CC[C@@H]2[C@H]([C@@H](C)C=C[C@H]2C1)C(=O)c3c(O)c(cn(O)c3=O)[C@]4(O)CC[C@@H](O)[C@H]5O[C@H]54 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P07 compound treatment 610490.4762 -87700.0 -0.4 611102.8807 -89400.0 -0.47 -0.6213 -0.9968 3615949 ACon1_001905 COC1OC(OC)C(O)(CC[C@@]2(O)[C@H](C)C[C@@H](O)C3[C@@](C)(CO)CCC[C@]32C)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P08 compound treatment 606428.5714 -91700.0 -0.42 633755.8685 -66800.0 -0.35 -0.5496 -0.9961 3557451 ACon1_001906 C[C@@]12C[C@H](O)C3C(CC[C@@H]4C[C@H](O)CC[C@@]43C)C2CC[C@@H]1C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P09 compound treatment 149631.5789 -549000.0 -2.53 516191.6667 -184000.0 -0.98 -2.4801 -0.9145 3615955 ACon1_001907 CC(=CCc1c(O)c(CC=C(C)C)c2OC(CC(=O)c2c1O)c3ccc(O)cc3O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P10 compound treatment 395502.7933 -303000.0 -1.4 479578.125 -221000.0 -1.17 -1.8157 -0.9962 3559822 ACon1_001908 CC1OC(OC2CCC3(C)C(CCC4(C)C3CC=C5C6CC(C)(C)CCC6(CCC54C)C(=O)OC7OC(CO)C(OC8OCC(OC9OC(CO)C(O)C(O)C9O)C(OC%10OCC(O)C(O)C%10O)C8O)C(O)C7O)C2(C)C)C(O)C(O)C1OC%11OCC(O)C(O)C%11O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P11 mock treatment 695790.6977 -2370.0 -0.01 587236.1111 -113000.0 -0.6 -0.4327 -0.7199 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P12 mock treatment 618106.7961 -80100.0 -0.37 577517.2414 -123000.0 -0.65 -0.7224 -0.9636 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P13 compound treatment 596938.2716 -101000.0 -0.47 514643.7768 -186000.0 -0.99 -1.0273 -0.9417 3615961 ACon1_001909 COc1ccc(cc1O)C(C)C(=O)c2ccc(O)cc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P14 compound treatment 573536.7232 -125000.0 -0.57 587833.3333 -113000.0 -0.6 -0.8291 -0.9998 3615963 ACon1_001910 OCC(=C)C(=O)O[C@H]1C[C@]23O[C@@H]3CC/C(=C/[C@H]4OC(=O)C(=C)[C@@H]41)/CO[C@@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P15 compound treatment 515232.2835 -183000.0 -0.84 520248.927 -180000.0 -0.96 -1.2727 -0.998 3559257 ACon1_001911 OC1(OCC2C(OCC21O)c3ccc4OCOc4c3)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P16 compound treatment 519404.6693 -179000.0 -0.82 523453.4413 -177000.0 -0.94 -1.2471 -0.9979 3615970 ACon1_001912 CC1(C)C(CCC2(C)C3CC(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C(C)(C=C)C=C3CCC12)O[C@@H]5O[C@@H](CO)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P17 compound treatment 524750.0 -173000.0 -0.8 496066.1157 -204000.0 -1.08 -1.3324 -0.9888 2116652 ACon1_001913 Oc1ccc(CCNC(=O)/C=C/c2ccc(O)cc2)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P18 compound treatment 389066.4557 -309000.0 -1.43 475542.6357 -225000.0 -1.19 -1.8518 -0.9961 3615976 ACon1_001914 CC1OC(CC(O)C1O)c2cc3oc(cc(=O)c3c(O)c2O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P19 compound treatment 416727.5542 -281000.0 -1.3 491125.3823 -209000.0 -1.11 -1.7031 -0.997 3615980 ACon1_001915 CCC(C)C(OC1OC(C)C(O)C(O)C1O)C(C)C(=O)C(C)/C=C(\C)/CC(C)C(O)C(C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P20 compound treatment 431631.9218 -267000.0 -1.23 503952.5547 -197000.0 -1.04 -1.6064 -0.9966 3615986 ACon1_001916 C[C@@H]1O[C@@H](O[C@@H]2[C@H](O)[C@@H](O)[C@H](C)O[C@H]2O[C@H]3[C@H](O)[C@@H](NC(=O)C)[C@H](O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC=C7[C@@H]8CC(C)(C)CC[C@@]8(C(O)C[C@]76C)C(=O)OC9OCC(O)C(O)C9O)C4(C)C)O[C@@H]3COC%10OCC(O)C(OC%11OCC(O)C(O)C%11O)C%10O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P21 compound treatment 421197.1831 -277000.0 -1.28 451280.0 -249000.0 -1.32 -1.838 -0.9999 3615991 ACon1_001917 C/C=C/c1ccc(O)cc1C(=O)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P22 compound treatment 390384.375 -308000.0 -1.42 451096.6543 -249000.0 -1.32 -1.9392 -0.9994 3615996 ACon1_001918 CC1=C2CC(CCC2(C)CCC1=O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P23 compound treatment 475720.4969 -222000.0 -1.03 590249.1803 -110000.0 -0.58 -1.139 -0.9645 3559104 ACon1_001919 COC(=O)[C@H](O)[C@H]1C(C)(C)C(=O)C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CC[C@@H](C3=C)[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2295 P24 compound treatment 427455.8824 -271000.0 -1.25 398854.6713 -302000.0 -1.6 -2.0142 -0.9925 3558533 ACon1_001920 OC[C@H]1O[C@@H](OC2OC=C3[C@@H](C[C@H]4N(CCc5c4[nH]c6ccccc56)C3=O)[C@H]2C=C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A01 compound treatment 682325.4717 5090.0 0.02 693712.2642 32300.0 0.17 0.1377 0.7965 3616000 ACon1_001921 COC(=O)C12CC3CC(C(C)O)C2N(C3)CCc4c1[nH]c5cc(OC)ccc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A02 compound treatment 695298.5075 18100.0 0.08 680390.6977 19000.0 0.1 0.13 0.9956 3616002 ACon1_001922 C/C(=C\CC(C)(C)\C=C\Cc1ccoc1)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A03 compound treatment 707363.6364 30100.0 0.14 825759.6154 164000.0 0.87 0.7146 0.8096 3553562 ACon1_001923 CC(C)C1C(O)C2C(CCC(=O)C)C2(C)CC1OC(=O)/C=C/c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A04 compound treatment 818215.1394 141000.0 0.65 890175.0 229000.0 1.21 1.3177 0.9572 3616008 ACon1_001924 C[C@@H]1CCOC(=O)/C=C/C=C\C(=O)O[C@@H]2C[C@H]3O[C@@H]4C=C(CO)CC[C@]4(COC(=O)[C@H]1O)[C@]2(C)[C@@]53CO5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A05 compound treatment 1042697.917 365000.0 1.69 953376.2376 292000.0 1.55 2.2867 0.9991 3554100 ACon1_001925 CCC(=O)OC1C(C)CC2(OC(=O)C)C1C(OC(=O)C)C3(CO3)CCC4C(/C=C(\C)/C2=O)C4(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A06 compound treatment 570000.0 -107000.0 -0.49 738120.7729 76700.0 0.41 -0.062 -0.0969 3616012 ACon1_001926 COc1c(C2OCC(O)C(O)C2O)c(O)cc3oc(cc(=O)c13)c4ccc(OC5OC(C)C(O)C(O)C5O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A07 compound treatment 596556.1798 -80700.0 -0.37 653227.2727 -8190.0 -0.04 -0.2938 -0.7843 3616015 ACon1_001927 CCC/C=C/C(=O)O[C@H]1CC(C)(C)CC2[C@]34CCC5[C@@]6(C)CC[C@H](O[C@@H]7O[C@@H]([C@@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O)[C@H]8O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O[C@@H]%10OC[C@](O)(CO)[C@H]%10O)[C@H]7O[C@@H]%11O[C@H](CO)[C@H](O)[C@H](O)[C@H]%11O)C(=O)O)C(C)(C)C6CC[C@@]5(C)[C@]4(C)C[C@@H](OC(=O)C)[C@]21[C@H](O)O3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A08 compound treatment 668225.1309 -9010.0 -0.04 610923.0769 -50500.0 -0.27 -0.2188 -0.8072 3616020 ACon1_001928 C[C@@H]1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@H]4O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)c(oc3c2)c7ccc(O)cc7)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A09 compound treatment 680601.0101 3360.0 0.02 765715.0259 104000.0 0.55 0.4021 0.7266 3616025 ACon1_001929 CC1CC(=O)C2C34OC4(C(O)CC2(O)C1)C(O)c5c(O)cccc5C3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A10 compound treatment 613042.1053 -64200.0 -0.3 624813.4715 -36600.0 -0.19 -0.3466 -0.9791 3558789 ACon1_001930 OCC1OC(OC2C(O)C(O)C(CO)OC2OC3C(O)C(O)C(CO)OC3Oc4c(oc5cc(O)cc(O)c5c4=O)c6ccc(O)c(O)c6)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A11 compound treatment 658931.3725 -18300.0 -0.08 555786.0465 -106000.0 -0.56 -0.4559 -0.8046 3616030 ACon1_001931 OCC1OC(C(O)C(O)C1OC2OCC(O)(CO)C2O)c3c(O)cc4OC(C(C(=O)c4c3O)c5c(oc6cc(O)cc(O)c6c5=O)c7ccc(O)cc7)c8ccc(O)cc8 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A12 compound treatment 753728.2609 76500.0 0.35 704734.6939 43300.0 0.23 0.4119 0.9784 3616033 ACon1_001932 OCC1OC(C(O)C(O)C1O)c2c(O)cc3occc(=O)c3c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A13 mock treatment 680984.2932 3750.0 0.02 748724.1379 87300.0 0.46 0.3397 0.733 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A14 mock treatment 626622.9508 -50600.0 -0.23 654101.6043 -7320.0 -0.04 -0.1925 -0.8135 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A15 compound treatment 682810.6796 5570.0 0.03 707473.6842 46100.0 0.24 0.1909 0.7772 3616036 ACon1_001933 OC[C@H]1O[C@@H](Oc2ccc3c(=O)cc(oc3c2)c4ccc(O)cc4)[C@H](O[C@H]5OC[C@](O)(CO)[C@H]5O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A16 compound treatment 752128.3186 74900.0 0.35 855985.5072 195000.0 1.03 0.9739 0.895 3616041 ACon1_001934 CCN1C[C@]2(C)CC[C@H](OC)[C@]3([C@@H]4C[C@H]5[C@H](O)[C@@H]4[C@](O)(C[C@@H]5OC)[C@]6(O)[C@@H](OC)C32)[C@H]16 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A17 compound treatment 783878.7879 107000.0 0.49 765131.25 104000.0 0.55 0.7367 0.9984 3616047 ACon1_001935 C/C=C(/C)\C(=O)O[C@H]1CC(C)(C)C[C@H]2C3=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H]6O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)C(=O)O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@@]12CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A18 compound treatment 609258.3732 -68000.0 -0.31 693759.434 32300.0 0.17 -0.1004 -0.2809 3552637 ACon1_001936 C[C@@H]1C[C@@H]2O[C@H]2/C=C\C=C\C(=O)Cc3c(Cl)c(O)cc(O)c3C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A19 compound treatment 658975.6098 -18300.0 -0.08 763922.7273 103000.0 0.54 0.3249 0.5905 3616054 ACon1_001937 COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)Oc3cc(C)c(C(=O)NC(C)C(=O)O)c(O)c3)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4OC(=O)C)c2)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A20 compound treatment 689147.9592 11900.0 0.05 598355.5556 -63100.0 -0.33 -0.1977 -0.5832 3559850 ACon1_001938 OC[C@H]1O[C@@H](OC(=O)/C=C/c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A21 compound treatment 621481.2834 -55800.0 -0.26 556613.4021 -105000.0 -0.56 -0.5749 -0.9386 599 ACon1_001939 Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A22 compound treatment 549979.3388 -127000.0 -0.59 627350.2304 -34100.0 -0.18 -0.5428 -0.8839 3554279 ACon1_001940 CCCCCCC(C(=O)O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A23 compound treatment 641410.5691 -35800.0 -0.17 677741.9355 16300.0 0.09 -0.0556 -0.2981 3616064 ACon1_001941 COc1cc(oc(=O)c1C)/C(=C/C(C)(O)C(C)O)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 A24 compound treatment 611457.7114 -65800.0 -0.3 650784.689 -10600.0 -0.06 -0.2544 -0.8244 1099693 ACon1_001942 CC(C)(O)C(O)COc1c2occc2cc3ccc(=O)oc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B01 compound treatment 615682.6087 -61600.0 -0.28 577703.7037 -83700.0 -0.44 -0.5147 -0.9766 3498385 ACon1_001943 COC(=O)C1C(O)C=Cc2oc3cc(CO)cc(O)c3c(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B02 compound treatment 820090.9091 143000.0 0.66 932100.0 271000.0 1.44 1.481 0.9376 3554822 ACon1_001944 COc1cc(=O)oc(C(C)C(C)O)c1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B03 compound treatment 831028.5714 154000.0 0.71 954755.4585 293000.0 1.56 1.6017 0.9367 3616073 ACon1_001945 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)[C@@](C)(C5CC[C@]43C)C(=O)O)C2[C@]1(C)O)C(=O)OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B04 compound treatment 833648.7805 156000.0 0.72 758409.0909 97000.0 0.51 0.8738 0.9863 3559763 ACon1_001946 OC[C@H]1O[C@H](S/C(=N/OS(=O)(=O)O)/Cc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B05 compound treatment 695897.561 18700.0 0.09 806431.9249 145000.0 0.77 0.6047 0.7813 3616080 ACon1_001947 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)C)[C@H](OC(=O)/C=C/c6ccccc6)[C@H]1OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B06 compound treatment 794707.4236 117000.0 0.54 855485.8491 194000.0 1.03 1.1109 0.9551 3553933 ACon1_001948 CC1=CC(=O)C2=C(C)CCC3[C@H](OC(=O)C3=C)[C@@]12O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B07 compound treatment 788977.7778 112000.0 0.52 715626.0504 54200.0 0.29 0.5677 0.962 3616087 ACon1_001949 COC1CC(OC2CCC3(C)C(CCC4(O)C3CC(OC(=O)c5ccccc5)C6(C)C(O)(CCC64O)C(=O)C)C2)OC(C)C1OC7CC(OC)C(OC8OC(C)C(O)C(OC)C8O)C(C)O7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B08 compound treatment 739348.4848 62100.0 0.29 724371.9807 63000.0 0.33 0.4386 0.9971 3553383 ACon1_001950 CC(=O)OC[C@H]1O[C@@H](Oc2ccccc2COC(=O)C3(O)C=CCCC3=O)[C@H](OC(=O)C)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B09 compound treatment 738945.2055 61700.0 0.28 828386.9347 167000.0 0.89 0.8274 0.8895 3554520 ACon1_001951 CO[C@H]1C(O[C@@H]2C[C@H]3O[C@@H]([C@@H](O)[C@H](O)[C@]3(O)O[C@H]12)C(=O)OC)n4cnc5c(N)ncnc45 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B10 compound treatment 798497.7376 121000.0 0.56 811195.5556 150000.0 0.79 0.9572 0.9852 1011613 ACon1_001952 Oc1cc(=O)oc2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B11 compound treatment 224350.5155 -453000.0 -2.09 77833.3333 -584000.0 -3.1 -3.6656 -0.9817 2095401 ACon1_001953 CC(=CCCC1(C)Oc2c(C)cc3c4ccc(O)cc4[nH]c3c2C=C1)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B12 compound treatment 820569.1489 143000.0 0.66 767702.0202 106000.0 0.56 0.866 0.9969 3558299 ACon1_001954 OCCCc1ccc(O)c(O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B13 mock treatment 789380.9524 112000.0 0.52 706437.5 45000.0 0.24 0.5345 0.9384 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B14 mock treatment 752881.4433 75600.0 0.35 686078.9474 24700.0 0.13 0.3392 0.9103 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B15 compound treatment 689853.0806 12600.0 0.06 617463.7681 -44000.0 -0.23 -0.1237 -0.5149 1000142 ACon1_001955 CC1(C)[C@@H](O)CC[C@@]2(C)C1CC[C@]3(C)C2C(=O)C=C4[C@H]5C[C@](C)(CC[C@]5(C)CC[C@]43C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B16 compound treatment 651919.598 -25300.0 -0.12 679458.7156 18000.0 0.1 -0.0149 -0.0987 3011353 ACon1_001956 Oc1ccccc1C(=O)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B17 compound treatment 747897.1963 70700.0 0.33 718518.7166 57100.0 0.3 0.4446 0.9993 909 ACon1_001957 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B18 compound treatment 675751.1737 -1490.0 -0.01 753241.3793 91800.0 0.49 0.3395 0.6971 1020611 ACon1_001958 Oc1cccc2oc(cc(=O)c12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B19 compound treatment 662752.988 -14500.0 -0.07 634672.2689 -26700.0 -0.14 -0.1475 -0.941 3557567 ACon1_001959 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H](CO)C=C[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B20 compound treatment 753193.3962 76000.0 0.35 676685.9903 15300.0 0.08 0.3049 0.8482 3559544 ACon1_001960 C[C@H]1C[C@H](O)C[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B21 compound treatment 559633.7449 -118000.0 -0.54 652972.973 -8450.0 -0.04 -0.4152 -0.7629 3557523 ACon1_001961 C/C/1=C\CC[C@@]2(C)O[C@H]2[C@H]3OC(=O)C(=C)[C@@H]3CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B22 compound treatment 563034.3511 -114000.0 -0.53 656124.4019 -5290.0 -0.03 -0.3923 -0.7438 3177322 ACon1_001962 CC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@@]21C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B23 compound treatment 641464.135 -35800.0 -0.16 681725.8687 20300.0 0.11 -0.0405 -0.2055 3054971 ACon1_001963 O[C@@H]1C[C@](O)(C[C@@H](O)[C@@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 B24 compound treatment 644698.1132 -32500.0 -0.15 601938.8646 -59500.0 -0.32 -0.3292 -0.9423 3557449 ACon1_001964 C[C@@]12CCC3[C@@H](CCC4=CC(=O)CC[C@]34C)C2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C01 compound treatment 745725.1185 68500.0 0.32 611994.7644 -49400.0 -0.26 0.038 0.0925 3616105 ACon1_001965 COc1ccc2OC3CCN(C3C(=O)NC(Cc4ccccc4)C(=O)N/C=C\c1c2)C(=O)C(NC(=O)C(C)N(C)C)C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C02 compound treatment 692420.765 15200.0 0.07 707854.6256 46400.0 0.25 0.2237 0.8735 1034726 ACon1_001966 COc1ccc(cc1)c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C03 compound treatment 829368.1818 152000.0 0.7 728175.6098 66800.0 0.35 0.7465 0.9499 3557683 ACon1_001967 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O[C@@H]8OC[C@](O)(CO)[C@H]8O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C04 compound treatment 622743.8424 -54500.0 -0.25 497792.3497 -164000.0 -0.87 -0.7914 -0.8759 3616115 ACon1_001968 COc1cc(ccc1O)c2oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)c(O)c3c(=O)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C05 compound treatment 776601.0638 99400.0 0.46 760076.9231 98700.0 0.52 0.694 0.9978 3555406 ACon1_001969 CON1c2ccccc2[C@@]3(C=C(O)C(=O)N4/C(=C/c5cnc[nH]5)/C(=O)N[C@]143)C(C)(C)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C06 compound treatment 783915.0 107000.0 0.49 628927.8846 -32500.0 -0.17 0.226 0.4336 3616121 ACon1_001970 CCCCCC(CC(O)CC(=O)OC(CCCCC)CC(CC(=O)O)OC1OC(CO)C(O)C(O)C1O)OC2OC(CO)C(O)C(O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C07 compound treatment 615432.5843 -61800.0 -0.29 471950.1916 -189000.0 -1.0 -0.9121 -0.8732 3616123 ACon1_001971 C/C=C(/C)\C(=O)O[C@H]1[C@H](OC(=O)/C=C/c2ccccc2)[C@@]3([C@H](O)O[C@@]45CCC6[C@@]7(C)CC[C@H](O[C@@H]8O[C@@H]([C@@H](O)[C@H](O[C@@H]9O[C@H](CO)[C@H](O)[C@H](O)[C@H]9O[C@@H]%10O[C@@H](C)[C@H](O)[C@@H](O)[C@H]%10O[C@@H]%11OC[C@](O)(CO)[C@H]%11O)[C@H]8O[C@@H]%12O[C@H](CO)[C@H](O)[C@H](O)[C@H]%12O)C(=O)O)C(C)(C)C7CC[C@@]6(C)[C@]5(C)C[C@H]3O)C4CC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C08 compound treatment 67785.7143 -609000.0 -2.81 69512.1951 -592000.0 -3.14 -4.2073 -0.9985 3616129 ACon1_001972 CCCC(O)/C(=C/C1=C(C(=O)CC(CC(=O)O)OC(=O)N)C(=O)c2cccc(O)c2C1=O)/CC(C(=O)O)[N+](C)(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C09 compound treatment 729993.6306 52800.0 0.24 664246.9136 2830.0 0.02 0.1826 0.7493 3616135 ACon1_001973 O[C@H]1[C@@H](O)[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](Oc3ccc(C(=O)CCc4ccc(O)cc4)c(O)c3)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C10 compound treatment 789675.3927 112000.0 0.52 679170.7317 17800.0 0.09 0.4332 0.8221 1076495 ACon1_001974 CC1CCCCCC(=O)c2c(O)cc(O)cc2CC(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C11 mock treatment 754227.5132 77000.0 0.36 814009.8039 153000.0 0.81 0.8233 0.9316 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C12 mock treatment 720263.4409 43000.0 0.2 767393.2584 106000.0 0.56 0.5378 0.9022 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C13 compound treatment 699719.5767 22500.0 0.1 674851.4851 13400.0 0.07 0.1237 0.9832 3616143 ACon1_001975 C/C(=C/CCC(CO)C1CCC2(C)C3CCC4C5(CC35CCC12C)C(O)CC(OC6OC(CO)C(O)C(O)C6O)C4(C)C)/COC7OC(CO)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C14 compound treatment 670062.2711 -7180.0 -0.03 828795.3488 167000.0 0.89 0.6043 0.6803 3616150 ACon1_001976 CCCCCCC(=O)OC1OC(CO)C(O)C2OCC(COC12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C15 mock treatment 822887.8049 146000.0 0.67 739772.5118 78400.0 0.42 0.7688 0.9734 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C16 mock treatment 761322.1757 84100.0 0.39 826891.0891 165000.0 0.88 0.8948 0.9326 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C17 compound treatment 785521.9512 108000.0 0.5 548488.2629 -113000.0 -0.6 -0.0704 -0.0903 3616151 ACon1_001977 C/C=C(/C)\C(=O)O[C@H]1CC(C)(C)C[C@H]2C3=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H]6O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)C(=O)O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)[C@@H](OC(=O)C)[C@@H](O)[C@@]12COC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C18 compound treatment 671410.2564 -5830.0 -0.03 686168.6747 24800.0 0.13 0.0738 0.5509 3557642 ACon1_001978 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2O[C@H]3[C@H](O)[C@H](O[C@@H](O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC[C@@]78OC[C@]9(C8CC(C)(C)C[C@@H]9OC(=O)C)[C@H](O)C[C@]76C)C4(C)C)[C@@H]3O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)C(=O)O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C19 compound treatment 783207.9646 106000.0 0.49 621120.603 -40300.0 -0.21 0.1944 0.3645 1147 ACon1_001979 COc1c2ccoc2cc3oc(=O)ccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C20 compound treatment 703961.2069 26700.0 0.12 557943.9655 -103000.0 -0.55 -0.3009 -0.535 3558157 ACon1_001980 COc1cc(O)c2C(=O)[C@H](O)[C@H](Oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C21 compound treatment 758187.234 80900.0 0.37 758502.6455 97100.0 0.51 0.6281 0.9875 3616160 ACon1_001981 CC1OC(OC2C(O)C(O)C(C)OC2OC3C(O)C(O)C(CO)OC3OC4C(O)C(OC(OC5CCC6(C)C(CCC7(C)C6CCC89OCC%10(CCC(C)(C)CC%109)C(O)CC87C)C5(C)C)C4OC%11OC(CO)C(O)C(O)C%11O)C(=O)O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C22 compound treatment 671753.6946 -5480.0 -0.03 623194.4444 -38200.0 -0.2 -0.1612 -0.7892 3558367 ACon1_001982 C[C@@H]1C[C@H]2OC[C@@]3(C)CCC[C@](C)(C23)[C@@]1(O)CCc4ccoc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C23 compound treatment 753385.7868 76100.0 0.35 692004.6948 30600.0 0.16 0.363 0.9385 3616165 ACon1_001983 COc1ccc(/C=C/C(=O)O[C@@H]2[C@H](O)[C@@H](O)[C@H](C)O[C@H]2OC3C4O[C@]4(CO)[C@@H]5[C@H]3C=COC5O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 C24 compound treatment 728660.0 51400.0 0.24 816716.7382 155000.0 0.82 0.7501 0.8751 3557295 ACon1_001984 C/C=C/C1=CC(=O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D01 compound treatment 712367.6471 35100.0 0.16 770269.0583 109000.0 0.58 0.5228 0.8719 3616143 ACon1_001985 C/C(=C/CCC(CO)C1CCC2(C)C3CCC4C5(CC35CCC12C)C(O)CC(OC6OC(CO)C(O)C(O)C6O)C4(C)C)/COC7OC(CO)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D02 compound treatment 574151.6588 -103000.0 -0.48 550126.1682 -111000.0 -0.59 -0.7536 -0.9942 3559089 ACon1_001986 OC1[C@H](OC(=O)c2cc(O)c(O)c(O)c2)OC3COC(=O)c4cc(O)c(O)c(O)c4-c5c(O)c(O)c(O)cc5C(=O)O[C@@H]1[C@@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D03 compound treatment 702321.5859 25100.0 0.12 725055.5556 63600.0 0.34 0.3205 0.8982 3616174 ACon1_001987 OCC1OC(C(OC(=O)c2cc(O)c(O)c(O)c2)C(O)C1O)c3c(O)cc(O)c(C(=O)c4ccc(O)cc4)c3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D04 compound treatment 659175.6757 -18100.0 -0.08 652000.0 -9420.0 -0.05 -0.0942 -0.9701 3559657 ACon1_001988 COc1cc(O)c(C(=O)CCc2ccc(OC)c(OC)c2)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D05 compound treatment 658554.4554 -18700.0 -0.09 765115.8798 104000.0 0.55 0.328 0.5891 3616180 ACon1_001989 CC1C2C(CC3C4CC(O[C@@H]5O[C@H](C)[C@@H](O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@H](O)[C@H]5O)C7CC(O)CCC7(C)C4CCC23C)OC81OCC(C)CC8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D06 compound treatment 675130.4348 -2110.0 -0.01 780617.5115 119000.0 0.63 0.4402 0.6962 3559746 ACon1_001990 COc1cc2N3[C@H]4[C@H]5[C@H]6C[C@@H]7N(CC[C@@]74c2cc1OC)CC6=CCO[C@H]5CC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D07 compound treatment 747136.5639 69900.0 0.32 769144.0678 108000.0 0.57 0.632 0.9633 3553158 ACon1_001991 C[C@H]1OC(=O)[C@@]23C(=C)[C@]4(C)OC(=O)[C@@]31O[C@]5([C@@H]4O)C(=C)[C@@]6(CC[C@]25C)C=CC(=O)OC6(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D08 compound treatment 634868.1818 -42400.0 -0.2 620576.5766 -40800.0 -0.22 -0.2913 -0.9987 3559359 ACon1_001992 O[C@@H]1CO[C@@H](O[C@@H](CCc2ccc(O)c(O)c2)CC(=O)CCc3ccc(O)c(O)c3)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D09 compound treatment 50843.1373 -626000.0 -2.89 61800.0 -600000.0 -3.18 -4.2915 -0.9988 3616190 ACon1_001993 C/C=C/[C@H]1[C@@H](C=C(C)[C@H]2CC[C@H](C)C[C@H]12)C(=O)c3c(O)c(c[nH]c3=O)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D10 compound treatment 684075.0 6840.0 0.03 719876.7123 58500.0 0.31 0.2415 0.775 3554007 ACon1_001994 CC1CC2C=CC3COC(=O)C3(C)C2CC1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D11 mock treatment 759108.1081 81900.0 0.38 849377.3585 188000.0 1.0 0.9719 0.9117 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D12 mock treatment 824698.4925 147000.0 0.68 652626.3736 -8790.0 -0.05 0.4479 0.6571 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D13 compound treatment 818994.898 142000.0 0.65 634791.8367 -26600.0 -0.14 0.3624 0.5418 3559637 ACon1_001995 COC(=O)C12CCC(C)C(C)C2C3=CCC4C5(C)CCC(OC(=O)C)C(C)(C)C5CCC4(C)C3(C)CC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D14 compound treatment 674847.1616 -2390.0 -0.01 782978.8136 122000.0 0.64 0.4481 0.6949 3079231 ACon1_001996 CC1(C)O[C@H]2CC(=O)OC[C@@]23[C@H]1CC(=O)[C@]4(C)[C@@H]3CC[C@@]5(C)[C@@H](OC(=O)[C@H]6O[C@]654)c7ccoc7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D15 mock treatment 649704.0359 -27500.0 -0.13 710739.1304 49300.0 0.26 0.0952 0.3274 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D16 mock treatment 716041.6667 38800.0 0.18 809534.3137 148000.0 0.79 0.682 0.8465 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D17 compound treatment 379316.9014 -298000.0 -1.37 469469.2982 -192000.0 -1.02 -1.6914 -0.9891 2838 ACon1_001997 CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)CCC3=C)/CCC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D18 compound treatment 628825.3968 -48400.0 -0.22 697018.9573 35600.0 0.19 -0.0244 -0.0833 3559519 ACon1_001998 C[C@@H]1CC[C@]2(C)[C@H](CCC=C2C(=O)O)[C@@]1(C)CCc3ccoc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D19 compound treatment 649177.7778 -28100.0 -0.13 358339.8058 -303000.0 -1.61 -1.2282 -0.7616 1054601 ACon1_001999 Cc1cc2c3ccccc3[nH]c2c4C=CC(C)(C)Oc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D20 compound treatment 719433.8843 42200.0 0.19 704785.0467 43400.0 0.23 0.3002 0.9965 3559588 ACon1_002000 OC/C/1=C\[C@H]2OC(=O)C(=C)[C@@H]2[C@H](O)C/C(=C\CC1)/C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D21 compound treatment 632829.2683 -44400.0 -0.2 668829.0598 7410.0 0.04 -0.117 -0.5612 3559469 ACon1_002001 CC1(C)CC2C1[C@@H](O)C/C(=C/CCC2=C)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D22 compound treatment 682485.9813 5250.0 0.02 608898.7854 -52500.0 -0.28 -0.1799 -0.6433 3557446 ACon1_002002 C[C@@]12C[C@H](O)C3[C@@H](CC[C@H]4C[C@H](O)CC[C@@]43C)C2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D23 compound treatment 558162.5 -119000.0 -0.55 592752.2124 -68700.0 -0.36 -0.6458 -0.9801 3559627 ACon1_002003 CCCCCCCCC#CCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 D24 compound treatment 617270.8333 -60000.0 -0.28 595536.4583 -65900.0 -0.35 -0.4426 -0.9933 3557443 ACon1_002004 C[C@@]12C[C@H](O)C3[C@@H](CCC4=CC(=O)CC[C@]34C)C2CC[C@@H]1C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E01 mock treatment 648650.2463 -28600.0 -0.13 753862.069 92400.0 0.49 0.2535 0.4992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E02 mock treatment 686246.2312 9010.0 0.04 730309.3923 68900.0 0.37 0.2877 0.7825 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E03 compound treatment 729382.199 52100.0 0.24 652771.028 -8650.0 -0.05 0.1376 0.5621 3557620 ACon1_002005 COC(=O)C(=C)[C@]1(O[C@]2(C)CC1=O)[C@H](C[C@@]3(C)OC(=O)/C(=C/C)/[C@]3(O)CC2)OC(=O)C(=C)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E04 compound treatment 921381.1881 244000.0 1.13 861714.9123 200000.0 1.06 1.5473 0.9996 3616208 ACon1_002006 OCC1OC(OC2OC=C(C(CC(=O)O)C2C=C)C(=O)O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E05 compound treatment 730248.8263 53000.0 0.24 667180.3279 5760.0 0.03 0.1945 0.7894 3616212 ACon1_002007 OC1C(O)C(COC(=O)/C=C/c2ccc(O)cc2)OC(OC(=O)/C=C/c3ccc(O)c(O)c3)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E06 compound treatment 821057.2917 144000.0 0.66 662279.8354 861.0 0.0 0.4722 0.712 3558000 ACon1_002008 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)/C=C/c6ccccc6)[C@H](OC(=O)/C=C/c7ccccc7)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E07 compound treatment 805541.6667 128000.0 0.59 709839.779 48400.0 0.26 0.6 0.9302 3555029 ACon1_002009 COc1cc2cc(Oc3ccc4ccc(=O)oc4c3)c(=O)oc2cc1OC5OC(COC(=O)CC(C)(O)CC(=O)O)C(O)C(O)C5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E08 compound treatment 771838.3838 94600.0 0.44 645698.6301 -15700.0 -0.08 0.2495 0.5618 3616218 ACon1_002010 CC1OC(Oc2cc(O)c3c(=O)c(OC4OCC(O)C(O)C4O)c(oc3c2)c5ccc(O)cc5)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E09 mock treatment 790363.1841 113000.0 0.52 712892.8571 51500.0 0.27 0.5619 0.9544 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E10 mock treatment 746235.2941 69000.0 0.32 778041.0256 117000.0 0.62 0.6624 0.9522 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E11 compound treatment 718965.1163 41700.0 0.19 732246.2312 70800.0 0.38 0.4017 0.9517 3616221 ACon1_002011 COc1cc(/C=C/C(=O)OC[C@H]2O[C@@H](O[C@@H]3OC=C[C@H]4[C@H](O)[C@@H]5O[C@]5(CO)[C@H]43)[C@H](O)[C@@H](O)[C@@H]2O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E12 compound treatment 913797.9798 237000.0 1.09 809430.5556 148000.0 0.79 1.3265 0.987 3616227 ACon1_002012 C[C@@H]1CC[C@@]2(CC[C@]3(C(=O)O)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)C2[C@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E13 compound treatment 621572.2222 -55700.0 -0.26 648127.2727 -13300.0 -0.07 -0.2314 -0.8691 3616231 ACon1_002013 C/C(=C/CC[C@@H](CO)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)[C@@H](O)C[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C4(C)C)/CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E14 compound treatment 756995.4545 79800.0 0.37 731203.8835 69800.0 0.37 0.5218 1.0 3614428 ACon1_002014 COC(=O)c1c(C)cc2CC3(Oc2c(C)c1=O)C(C)CCC(C(C)(C)O)C3(C)CCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E15 compound treatment 695856.5401 18600.0 0.09 719195.3125 57800.0 0.31 0.2774 0.8717 3616237 ACon1_002015 CC(=O)O[C@@H]1[C@@H](O)[C@H](OC(=O)c2ccccc2)[C@@H](CO)O[C@H]1Oc3cc(O)cc(O)c3C(=O)c4cccc(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E16 compound treatment 744965.1741 67700.0 0.31 718450.2165 57000.0 0.3 0.4347 0.9999 3616246 ACon1_002016 CC1C2C(CC3C4CC=C5CC(CCC5(C)C4CCC23C)O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H](O)[C@H]6O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)OC91CCC(C)CN9 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E17 mock treatment 620441.8605 -56800.0 -0.26 636568.8889 -24800.0 -0.13 -0.2784 -0.9495 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E18 mock treatment 678250.0 1010.0 0.0 700967.7419 39500.0 0.21 0.1516 0.7227 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E19 compound treatment 739009.6154 61800.0 0.28 774138.8889 113000.0 0.6 0.6242 0.9425 3616250 ACon1_002017 COc1cc(cc(O)c1OC)c2cc(O)c(OC)c(OC)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E20 compound treatment 563984.6939 -113000.0 -0.52 564743.7186 -96700.0 -0.51 -0.7319 -1.0 3554291 ACon1_002018 CCCCCCCC(=O)OC1C(OC(=O)/C(=C/C)/C)C(=C2C3OC(=O)C(C)(O)C3(O)C(CC(C)(OC(=O)C)C12)OC(=O)CCC)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E21 compound treatment 729235.7414 52000.0 0.24 604553.7849 -56900.0 -0.3 -0.0437 -0.1134 3616255 ACon1_002019 CC[C@H]1C(=O)CC2C3CCC4C[C@@H](O)[C@]5(O)C[C@]4(CO5)C3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E22 compound treatment 860137.4408 183000.0 0.84 741039.4737 79600.0 0.42 0.895 0.9489 3558178 ACon1_002020 CC1(O)CCCC2(C)CCC(CC12)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E23 compound treatment 735137.7953 57900.0 0.27 649919.4915 -11500.0 -0.06 0.1457 0.5319 3558962 ACon1_002021 C[C@@H]1CC[C@@]2(CC[C@]3(C(=O)O)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H](C)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)C2[C@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 E24 compound treatment 200681.3187 -477000.0 -2.2 337923.913 -323000.0 -1.72 -2.7673 -0.9925 3616265 ACon1_002022 CC(C)c1cc(O)c(C)c(c1O)c2c(C)c(O)cc(C(C)C)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F01 mock treatment 711660.4651 34400.0 0.16 786280.1932 125000.0 0.66 0.5805 0.8525 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F02 mock treatment 872589.8618 195000.0 0.9 821128.0788 160000.0 0.85 1.236 0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F03 compound treatment 930185.3659 253000.0 1.17 800743.1694 139000.0 0.74 1.3474 0.9757 3616267 ACon1_002023 C[C@H]1O[C@@H](OC2CC3C(=CC2(C)C=C)CCC4C(C)(C)C(CCC34C)O[C@@H]5O[C@@H](CO)[C@H](O)[C@H]5O)[C@H](O)[C@@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F04 compound treatment 753281.25 76000.0 0.35 767889.5028 106000.0 0.56 0.6473 0.9737 3559767 ACon1_002024 COc1ccc(/C=C/C(=O)c2c(OC)cc(OC)c(CC=C(C)C)c2OC)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F05 compound treatment 838144.1048 161000.0 0.74 869062.8272 208000.0 1.1 1.3035 0.9815 3616273 ACon1_002025 C[C@H]1O[C@@H](OC(C)(CC/C=C(\C)/C(=O)O)C=C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F06 compound treatment 786567.1642 109000.0 0.5 728380.6818 67000.0 0.36 0.6077 0.9853 1020610 ACon1_002026 Oc1ccc2oc(cc(=O)c2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F07 compound treatment 812767.1958 136000.0 0.63 735588.8325 74200.0 0.39 0.7201 0.9751 3616280 ACon1_002027 CC(=CCCC(C)(O)C1Cc2cc(cc(CC=C(C)C)c2O1)C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F08 compound treatment 771218.9055 94000.0 0.43 635880.8511 -25500.0 -0.14 0.2107 0.464 3616283 ACon1_002028 CCCCOC(=O)C(N)CCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F09 mock treatment 810696.1326 133000.0 0.62 821165.8031 160000.0 0.85 1.0343 0.9877 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F10 mock treatment 649742.1053 -27500.0 -0.13 683291.3043 21900.0 0.12 -0.0076 -0.0444 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F11 compound treatment 752379.3103 75100.0 0.35 669157.6355 7740.0 0.04 0.2741 0.7854 3559302 ACon1_002029 CC(C1CCC2C3CC=C4CC(CC(O)C4(C)C3CCC12C)OC5OC(COC6OC(CO)C(O)C(O)C6O)C(O)C(O)C5O)C7CC(=C(C)C(=O)O7)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F12 compound treatment 784315.0 107000.0 0.49 779497.2678 118000.0 0.63 0.792 0.9931 3553842 ACon1_002030 CC1(C)[C@@H]2CC[C@]3(C2)[C@H](CC[C@@H]3C1=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F13 compound treatment 688416.2437 11200.0 0.05 680990.4762 19600.0 0.1 0.1099 0.9478 3559459 ACon1_002031 CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F14 compound treatment 612503.9063 -64700.0 -0.3 621781.4815 -39600.0 -0.21 -0.3598 -0.9853 3558542 ACon1_002032 COc1cc(/C=C/CO)ccc1O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F15 compound treatment 796485.8491 119000.0 0.55 709305.6769 47900.0 0.25 0.5685 0.9384 3553373 ACon1_002033 CC(=O)OC[C@@]12CCC(=C[C@H]2O[C@@H]3[C@H](O)[C@@H](OC(=O)C)[C@@]1(C)[C@@]43CO4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F16 compound treatment 759528.3019 82300.0 0.38 601504.0984 -59900.0 -0.32 0.0436 0.0882 3559439 ACon1_002034 C/C=C(/C)\C(=O)OC1Cc2c(OC1(C)C)ccc3ccc(=O)oc23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F17 mock treatment 604051.3834 -73200.0 -0.34 601703.5398 -59700.0 -0.32 -0.4626 -0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F18 mock treatment 636922.7273 -40300.0 -0.19 600867.9245 -60600.0 -0.32 -0.3586 -0.9662 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F19 compound treatment 634187.5 -43100.0 -0.2 582203.252 -79200.0 -0.42 -0.4375 -0.9414 3559364 ACon1_002035 COc1cc2[nH]c3ccccc3c2cc1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F20 compound treatment 592579.7665 -84700.0 -0.39 603774.1935 -57600.0 -0.31 -0.4923 -0.9927 1308020 ACon1_002036 COc1ccc(cc1)c2cc(=O)c3ccccc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F21 compound treatment 622060.7287 -55200.0 -0.25 649400.0 -12000.0 -0.06 -0.225 -0.8577 1112402 ACon1_002037 COc1ccc2ccc(=O)oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F22 compound treatment 629257.9186 -48000.0 -0.22 557171.1712 -104000.0 -0.55 -0.5474 -0.9192 3557454 ACon1_002038 C[C@@]12CCC3[C@@H](CC[C@H]4CC(=O)CC[C@@]43C)C2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F23 compound treatment 568807.6923 -108000.0 -0.5 519316.9399 -142000.0 -0.75 -0.8865 -0.9801 3559628 ACon1_002039 CCCCCCCCC#CCCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 F24 compound treatment 577560.4396 -99700.0 -0.46 596330.3571 -65100.0 -0.35 -0.5692 -0.99 3557444 ACon1_002040 C[C@@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G01 compound treatment 659794.2584 -17400.0 -0.08 647794.4444 -13600.0 -0.07 -0.108 -0.9986 3616293 ACon1_002041 CCC1CN2CCC3(C2CC1/C(=C/OC)/C(=O)OC)C(=O)Nc4cccc(O)c43 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G02 compound treatment 588345.8333 -88900.0 -0.41 712726.087 51300.0 0.27 -0.0974 -0.198 3558908 ACon1_002042 CC1(C)CCC[C@@]2(C)C1CC(=O)c3cc(O)c(O)cc32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G03 mock treatment 685527.6382 8290.0 0.04 648914.5729 -12500.0 -0.07 -0.0199 -0.2595 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G04 mock treatment 648441.8605 -28800.0 -0.13 672719.5767 11300.0 0.06 -0.0515 -0.3536 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G05 compound treatment 585668.4783 -91600.0 -0.42 556224.8804 -105000.0 -0.56 -0.6931 -0.9906 3557720 ACon1_002043 COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@H]4O)[C@H](O)[C@H](O)[C@H]3O)c(oc2c1)c6ccc(O)c(O)c6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G06 compound treatment 617191.3876 -60000.0 -0.28 581239.2157 -80200.0 -0.43 -0.4965 -0.9784 3616299 ACon1_002044 COC(=O)Cc1c(oc2cc(C)cc(O)c2c1=O)C(=CC(=O)O)Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G07 compound treatment 615545.0 -61700.0 -0.28 596029.4118 -65400.0 -0.35 -0.4464 -0.9952 3616301 ACon1_002045 O[C@H]1[C@@H](O)[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](Oc3ccc(C(=O)/C=C/c4ccccc4)c(O)c3)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G08 compound treatment 583664.0316 -93600.0 -0.43 590258.9641 -71200.0 -0.38 -0.572 -0.9978 3616305 ACon1_002046 CC(C)(O)/C=C/C(=O)[C@](C)(O)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C=C(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G09 compound treatment 632425.1012 -44800.0 -0.21 668460.5809 7040.0 0.04 -0.1197 -0.5701 3553481 ACon1_002047 CC(C)(O)CCCC(C)(O)c1ccc(cc1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G10 compound treatment 590740.7407 -86500.0 -0.4 547902.9126 -114000.0 -0.6 -0.7078 -0.98 3616309 ACon1_002048 CC1OC(OC2C(O)C(O)C(OC(=O)[C@@]34CCC(C)(C)CC4C5=CCC6[C@@]7(C)CC[C@H](OC8OC(C)C(OC9OCC(O)(COC%10OCC(O)C(OC%11OCC(OC%12OCC(O)(CO)C%12O)C(O)C%11O)C%10O)C9O)C(O)C8O)C(C)(C)C7CC[C@@]6(C)[C@]5(C)CC3)OC2CO)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G11 compound treatment 541593.9086 -136000.0 -0.63 517234.8485 -144000.0 -0.76 -0.9831 -0.995 3558718 ACon1_002049 COc1cc(/C=C/c2cc(O)cc(O)c2)ccc1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G12 compound treatment 615638.6555 -61600.0 -0.28 589020.9205 -72400.0 -0.38 -0.4724 -0.989 3616313 ACon1_002050 CC1OC(OC2C(O)C(O)C(COC3OCC(O)C(O)C3O)OC2OC(=O)C45CCC(C)(C)CC5C6=CCC7C8(C)CCC(OC9OC(CO)C(OC%10OC(C(OC%11OCC(O)C(O)C%11O)C(O)C%10O)C(=O)O)C(O)C9O)C(C)(CO)C8CCC7(C)C6(C)CC4)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G13 compound treatment 630974.8954 -46300.0 -0.21 571735.8491 -89700.0 -0.48 -0.4872 -0.9346 3616315 ACon1_002051 C[C@@H]1C[C@@H](OC(=O)C)C2[C@]3(C)CCC[C@]2(COC3=O)[C@@]1(O)CCc4ccoc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G14 compound treatment 623932.6923 -53300.0 -0.25 541662.037 -120000.0 -0.64 -0.623 -0.9147 3616319 ACon1_002052 C/C=C\C(=C\[C@H](C)C(=O)C[C@H](O)CC1CC(=O)NC(=O)C1)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G15 compound treatment 598432.2344 -78800.0 -0.36 577073.6842 -84300.0 -0.45 -0.5733 -0.9947 3616320 ACon1_002053 C[C@@H]([C@H]1CC[C@](C)(O1)C=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G16 compound treatment 578789.4737 -98400.0 -0.45 521920.0 -139000.0 -0.74 -0.8442 -0.9725 3616324 ACon1_002054 CC1C2C(CC3C4CC=C5CC(CCC5(C)C4CCC23C)O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H](O)[C@H]6O)OC81CCC(C)CN8 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G17 compound treatment 525200.0 -152000.0 -0.7 555458.7629 -106000.0 -0.56 -0.8932 -0.994 3616327 ACon1_002055 COc1cc(CC(CO)C(CO)Cc2cc(OC)c(O)c(c2)c3cc(CC(CO)C(CO)Cc4ccc(O)c(OC)c4)cc(OC)c3O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G18 compound treatment 121425.5319 -556000.0 -2.56 92739.1304 -569000.0 -3.02 -3.9453 -0.9967 3553093 ACon1_002056 C[C@H]1[C@H]2[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@@]25[C@@H](/C=C/C[C@H](C)\C=C(/C)\[C@@H](O)C(=O)\C=C\C5=O)[C@@H]6O[C@@]61C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G19 mock treatment 552490.566 -125000.0 -0.58 604052.6316 -57400.0 -0.3 -0.6219 -0.9557 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G20 mock treatment 578156.7797 -99100.0 -0.46 551603.1746 -110000.0 -0.58 -0.735 -0.9928 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G21 compound treatment 620438.4615 -56800.0 -0.26 659080.7175 -2340.0 -0.01 -0.194 -0.7398 3616329 ACon1_002057 CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G22 compound treatment 583978.1659 -93300.0 -0.43 634425.4386 -27000.0 -0.14 -0.4054 -0.8943 3616332 ACon1_002058 OC1COC(OCC2OC(O[C@H](C#N)c3ccccc3)C(O)C(O)C2O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G23 compound treatment 551994.5355 -125000.0 -0.58 517393.0636 -144000.0 -0.76 -0.9486 -0.9905 3616337 ACon1_002059 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C)/C1CC(=O)OCC(O)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 G24 compound treatment 601161.6162 -76100.0 -0.35 586423.6453 -75000.0 -0.4 -0.5293 -0.998 3616341 ACon1_002060 COc1c(O)c(C(=O)/C=C\c2ccccc2)c(OC)c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H01 compound treatment 719660.0 42400.0 0.2 712108.2474 50700.0 0.27 0.3284 0.9878 3616345 ACon1_002061 CC1CCC2(C)C(CC(O)C(O)C32CO3)C1(C)CCC4=CC(O)OC4=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H02 compound treatment 605991.8367 -71200.0 -0.33 620151.0204 -41300.0 -0.22 -0.3871 -0.9805 3559239 ACon1_002062 O[C@@H]1[C@@H](COC(=O)c2cc(O)c(O)c(O)c2)O[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](O)[C@H]1OC(=O)c4cc(O)c(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H03 mock treatment 736287.8049 59000.0 0.27 684565.0224 23100.0 0.12 0.2794 0.9352 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H04 mock treatment 724532.7103 47300.0 0.22 777403.6697 116000.0 0.62 0.5892 0.9027 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H05 compound treatment 704275.1323 27000.0 0.12 775877.193 114000.0 0.61 0.5174 0.8349 3616347 ACon1_002063 CC(CC/C=C(\C)/C(=O)O)C1CC(O)C2(C)C3CCC4C5(CC35CC(O)C12C)CCC(OC6OCC(O)C(O)C6O)C4(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H06 compound treatment 578898.9899 -98300.0 -0.45 629130.4348 -32300.0 -0.17 -0.4418 -0.9113 450 ACon1_002064 COC(=O)[C@@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H07 compound treatment 702753.5545 25500.0 0.12 783258.7065 122000.0 0.65 0.5402 0.8223 3616351 ACon1_002065 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OC(=O)[C@@]34CCC(C)(C)CC4C5=CCC6[C@@]7(C)CC[C@H](OC8OC(CO)C(OC9OCC(O)C(O)C9O)C(O)C8O)C(C)(C)C7CC[C@@]6(C)[C@]5(C)CC3O)O[C@H]2CO)[C@H](O)[C@H](O)[C@H]1O[C@H]%10OC[C@](O)(CO)[C@H]%10O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H08 compound treatment 430059.322 -247000.0 -1.14 503370.1657 -158000.0 -0.84 -1.3988 -0.9886 3551814 ACon1_002066 CC(=CCc1c(O)c(CC=C(C)C)c2OC(CC(=O)c2c1O)c3ccc(O)cc3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H09 compound treatment 610759.1837 -66500.0 -0.31 707531.1203 46100.0 0.24 -0.0438 -0.1118 3553447 ACon1_002067 CC(C)(C1CC[C@@]2(C)O[C@](C)(CCC2[C@@]1(C)CC(=O)O)C=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H10 compound treatment 603263.3929 -74000.0 -0.34 679331.7073 17900.0 0.1 -0.174 -0.4915 3557584 ACon1_002068 C/C(=C\CO)/CC[C@H]1C(=C)CCC2[C@@](C)(CCC[C@]12C)C=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H11 compound treatment 548902.439 -128000.0 -0.59 560905.2133 -101000.0 -0.53 -0.7955 -0.9986 2321 ACon1_002069 COc1ccc2CC3N(CCc4cc(OC)c(OC)cc34)Cc2c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H12 compound treatment 532873.9837 -144000.0 -0.67 584122.549 -77300.0 -0.41 -0.7607 -0.9729 3553497 ACon1_002070 CC(C)[C@]1(O)CC[C@]2(C)CC=C(C)C[C@H](O)[C@@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H13 compound treatment 89476.1905 -588000.0 -2.71 69142.8571 -592000.0 -3.14 -4.138 -0.9973 3187885 ACon1_002071 CC[C@H]([C@H]1O[C@@](CC)(C[C@@H]1C)[C@H]2CC[C@](O)(CC)[C@H](C)O2)C(=O)[C@@H](C)[C@@H](O)[C@H](C)CCc3ccc(C)c(O)c3C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H14 compound treatment 484715.4472 -193000.0 -0.89 621565.0 -39900.0 -0.21 -0.7773 -0.8517 3559539 ACon1_002072 C[C@H]1CCC2OC32CC4(O)OC(=O)C(=C4[C@@H](OC(=O)C(=C)C)[C@]13C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H15 compound treatment 544598.7261 -133000.0 -0.61 525783.7838 -136000.0 -0.72 -0.9412 -0.9967 3616359 ACon1_002073 CC(CNC(=O)CC[C@]1(C)[C@@H](CC(=O)N)[C@H]2N=C1/C(=C/3\N=C(/C=C/4\N=C(/C(=C\5/[C@@H](CCC(=O)N)[C@](C)(CC(=O)N)[C@@]2(C)N5[Co+]C#N)/C)\[C@@](C)(CC(=O)N)[C@@H]4CCC(=O)N)\C(C)(C)[C@@H]3CCC(=O)N)/C)OP(=O)(O)O[C@@H]6[C@H](O)[C@@H](O[C@H]6CO)n7cnc8cc(C)c(C)cc78 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H16 compound treatment 490361.991 -187000.0 -0.86 537194.7566 -124000.0 -0.66 -1.0753 -0.9912 3559651 ACon1_002074 COc1ccc2C(=O)/C(=C(\O)/c3ccccc3)/Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H17 compound treatment 449099.0099 -228000.0 -1.05 448080.3213 -213000.0 -1.13 -1.5441 -0.9993 3557456 ACon1_002075 C[C@H](CCC(=O)O)[C@H]1CCC2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)C3C=C[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H18 compound treatment 504730.4348 -173000.0 -0.8 573277.2727 -88100.0 -0.47 -0.8931 -0.9679 3559549 ACon1_002076 C/C=C(/CO)\C(=O)O[C@@H]1CC[C@H]2C(=O)c3occ(C)c3C[C@]2(C)[C@H]1C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H19 mock treatment 533197.9167 -144000.0 -0.66 529452.381 -132000.0 -0.7 -0.9646 -0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H20 mock treatment 535479.798 -142000.0 -0.65 534643.4109 -127000.0 -0.67 -0.9377 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H21 compound treatment 493044.9438 -184000.0 -0.85 500018.3824 -161000.0 -0.86 -1.206 -1.0 3559433 ACon1_002077 CC#CCc1cc2ccccc2c(=O)o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H22 compound treatment 468884.9558 -208000.0 -0.96 522433.0357 -139000.0 -0.74 -1.2007 -0.9914 3557447 ACon1_002078 CC(=O)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H23 compound treatment 546413.1455 -131000.0 -0.6 563878.9238 -97500.0 -0.52 -0.7924 -0.9971 3063892 ACon1_002079 COc1cc2ccc(=O)oc2cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 H24 compound treatment 312193.1818 -365000.0 -1.68 364917.3554 -297000.0 -1.57 -2.3024 -0.9994 3559653 ACon1_002080 O/C(=C\C(=O)/C=C/c1ccc(O)cc1)/C=C/c2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I01 compound treatment 648456.4103 -28800.0 -0.13 619281.5534 -42100.0 -0.22 -0.2519 -0.969 3616365 ACon1_002081 C[C@]1(CN2C3C4C(O)[C@H]5C(O)C6[C@]73CC(=O)C1)C7[C@@H]2C[C@@]46CC5=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I02 compound treatment 635075.9494 -42200.0 -0.19 633516.2602 -27900.0 -0.15 -0.2421 -0.9909 3616368 ACon1_002082 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](OC6OC(C(O)C(O)C6O)C(=O)O)C(CO)(CO)C5CC[C@]43C)[C@@H]2C1)C(=O)OC7OC(CO)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I03 compound treatment 737038.7931 59800.0 0.28 676991.3043 15600.0 0.08 0.2534 0.8803 3558097 ACon1_002083 COc1cc(C[C@@H]2[C@@H](Cc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3)COC2=O)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I04 compound treatment 91187.5 -586000.0 -2.7 82109.0909 -579000.0 -3.07 -4.0838 -0.998 3559868 ACon1_002084 OC1C2NCCc3cc4OCOc4c(-c5ccccc15)c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I05 mock treatment 710304.5685 33100.0 0.15 696314.4105 34900.0 0.19 0.2387 0.9954 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I06 mock treatment 721015.3061 43800.0 0.2 627500.0 -33900.0 -0.18 0.0155 0.0575 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I07 compound treatment 71959.1837 -605000.0 -2.79 747633.5079 86200.0 0.46 -1.6504 -0.5835 3616375 ACon1_002085 CC(=CCC[C@@](C)(O)[C@H]1CC[C@]2(C)C1CC(O)C3[C@@]2(C)CCC4C(C)(C)[C@@H](O)C[C@@H](O)[C@@]43C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I08 compound treatment 659140.4959 -18100.0 -0.08 616813.0081 -44600.0 -0.24 -0.2263 -0.9021 3616379 ACon1_002086 CCC(C)C(O)C(C)(O)/C=C/C1=CC2=C(Cl)C(=O)C(C)(O)C(O)C2CO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I09 compound treatment 663844.9612 -13400.0 -0.06 652902.834 -8520.0 -0.05 -0.0756 -0.9882 3558841 ACon1_002087 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)C2[C@@H]1O)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I10 compound treatment 83547.1698 -594000.0 -2.74 93517.8571 -568000.0 -3.01 -4.0659 -0.9989 3616383 ACon1_002088 CCCCCC(=O)Cc1cc(O)c(O)c2Oc3c(CCCCC)c(C(=O)O)c(O)cc3OC(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I11 compound treatment 757211.1554 80000.0 0.37 576596.4912 -84800.0 -0.45 -0.0573 -0.0986 3616384 ACon1_002089 OCC12OC2C(O)C3C=COC(OC4OC(COC(=O)/C=C/c5ccccc5)C(O)C(O)C4O)C31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I12 compound treatment 748539.3701 71300.0 0.33 646084.4444 -15300.0 -0.08 0.175 0.5166 3616386 ACon1_002090 CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@@]3(C)[C@H](CCC4C3CC[C@]5(C)[C@@H](CC[C@]45O)C6=CC(=O)OC6)C2)O[C@@H](C)[C@@H]1O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I13 compound treatment 613905.2133 -63300.0 -0.29 572523.4043 -88900.0 -0.47 -0.5399 -0.9735 3616388 ACon1_002091 CC(=C)C(=O)O[C@H]1C[C@@]2(C)O[C@@H]2[C@H]3O[C@H]3C(=C)[C@@H](O)[C@H]4OC(=O)C(=C)[C@@H]41 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I14 compound treatment 582473.4513 -94800.0 -0.44 556945.6067 -104000.0 -0.55 -0.7008 -0.9931 3558106 ACon1_002092 OC[C@H]1O[C@@H](Oc2ccc3c(=O)c(coc3c2)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I15 compound treatment 636063.745 -41200.0 -0.19 589747.331 -71700.0 -0.38 -0.4031 -0.9486 3616390 ACon1_002093 CC(=O)O[C@@H]1[C@@H](O)[C@H](OC(=O)c2ccccc2)[C@@H](CO)O[C@H]1Oc3cc(O)cc(O)c3C(=O)c4cc(O)cc(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I16 compound treatment 643761.9048 -33500.0 -0.15 639678.7149 -21700.0 -0.12 -0.1907 -0.9897 959 ACon1_002094 COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I17 compound treatment 576887.1595 -100000.0 -0.46 619752.988 -41700.0 -0.22 -0.4835 -0.9428 3557761 ACon1_002095 OCC1OC(OCC2OC(NCCc3ccc(O)cc3)C(O)C(O)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I18 compound treatment 572359.8131 -105000.0 -0.48 607343.75 -54100.0 -0.29 -0.5448 -0.9689 3553773 ACon1_002096 CC/C=C\[C@H](O)[C@H](O)C1=C(C)C(=O)[C@@]2(O1)C(O)[C@](NC2=O)(OC)C(=O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I19 compound treatment 609922.0779 -67300.0 -0.31 523952.2059 -137000.0 -0.73 -0.7351 -0.9276 3616392 ACon1_002097 Cc1cc(O)c(O)c(c1)C(=O)C(=O)c2c(O)cc(O)cc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I20 compound treatment 507053.4351 -170000.0 -0.78 557297.1014 -104000.0 -0.55 -0.9455 -0.9852 3552073 ACon1_002098 C/C=C/C=C/C(=O)C1=C(O)C(=C(O)C(C)(O)C1=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I21 mock treatment 585029.2887 -92200.0 -0.43 586709.6774 -74700.0 -0.4 -0.5809 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I22 mock treatment 653017.316 -24200.0 -0.11 608455.0265 -53000.0 -0.28 -0.2776 -0.9183 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I23 compound treatment 642850.4673 -34400.0 -0.16 583176.1364 -78200.0 -0.41 -0.4056 -0.9129 3616393 ACon1_002099 C/C=C\1/C(CC(=O)OCCc2ccc(O)c(O)c2)C(=COC1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 I24 compound treatment 633867.5214 -43400.0 -0.2 551195.122 -110000.0 -0.58 -0.5548 -0.8979 3553755 ACon1_002100 CC(O)CC1CCC(O1)C(C)C(=O)OC(C)CC2CCC(O2)C(C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J01 compound treatment 776353.4483 99100.0 0.46 825379.5918 164000.0 0.87 0.9381 0.9549 3616395 ACon1_002101 Oc1ccc(cc1)[C@H]2[C@@H]([C@@H]3[C@H](c4ccc(O)cc4)c5c(O)cc(O)cc5OC3=O)C(=O)Oc6cc(O)cc(O)c26 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J02 compound treatment 616325.0 -60900.0 -0.28 601989.011 -59400.0 -0.32 -0.4215 -0.9983 3559240 ACon1_002102 O[C@H]1[C@H]2[C@H](CC(=O)O)C(=O)O[C@@H]3C(COC(=O)c4cc(O)c(O)c(O)c4)O[C@@H](OC(=O)c5cc(O)c(O)c(O)c5)C(OC(=O)c6cc(O)c(O)c(OC1=O)c26)[C@@H]3OC(=O)c7cc(O)c(O)c(O)c7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J03 compound treatment 705051.9481 27800.0 0.13 913577.8689 252000.0 1.34 1.0364 0.7714 3616397 ACon1_002103 COc1cc(cc2cc(oc12)c3ccc4OCOc4c3)C(O)CCOC5OC(CO)C(O)C(O)C5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J04 compound treatment 621380.4878 -55900.0 -0.26 761371.2871 100000.0 0.53 0.1927 0.327 3559759 ACon1_002104 CC[C@H]1CN2CC[C@H]1C[C@H]2[C@H](O)c3ccnc4ccc(OC)cc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J05 mock treatment 703374.3316 26100.0 0.12 682860.4651 21400.0 0.11 0.1656 0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J06 mock treatment 713882.0755 36600.0 0.17 715077.2727 53700.0 0.28 0.3207 0.969 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J07 compound treatment 771183.4862 93900.0 0.43 677057.6923 15600.0 0.08 0.365 0.8275 3616398 ACon1_002105 Cc1cc2c(CO)cc(O)cc2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J08 compound treatment 650914.5299 -26300.0 -0.12 754422.4138 93000.0 0.49 0.263 0.5177 1066 ACon1_002106 OC1OCC=C2OC(=O)C=C12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J09 compound treatment 756477.4775 79200.0 0.37 696763.0332 35300.0 0.19 0.391 0.9519 3555011 ACon1_002107 COC1CC(OC2CCC3(C)C(CCC4C3CCC5(C)C(C(CC45O)OC(=O)C)C6=CC(=O)OC6)C2)OC(C)C1OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J10 compound treatment 768320.197 91100.0 0.42 615113.6364 -46300.0 -0.25 0.1233 0.2535 3558451 ACon1_002108 CC1=C2CCC(C)(O)C=C2OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J11 compound treatment 642373.5849 -34900.0 -0.16 643411.215 -18000.0 -0.1 -0.1812 -0.9691 3559926 ACon1_002109 CC1CCC(=C)/C(=C\C=C/CC1(C)CCC2=CCOC2=O)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J12 compound treatment 676546.729 -691.0 0.0 651483.5681 -9940.0 -0.05 -0.0395 -0.7485 3559949 ACon1_002110 C/C=C(/C)\C(=O)OC(C)(C)C1Cc2cc3ccc(=O)oc3cc2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J13 compound treatment 563546.0526 -114000.0 -0.52 685974.359 24600.0 0.13 -0.2786 -0.5158 3553079 ACon1_002111 C[C@H]1[C@H]2[C@@H](CC1=O)C(=C)C[C@@H](OC(=O)/C(=C/CO)/COC(=O)/C(=C/CO)/C)C3[C@@H]2OC(=O)C3=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J14 compound treatment 498149.2537 -179000.0 -0.83 563656.3707 -97800.0 -0.52 -0.9507 -0.9748 3083213 ACon1_002112 C[C@@]1(CCC[C@@]2(C)[C@H]1CCc3ccc(O)cc32)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J15 compound treatment 571354.8387 -106000.0 -0.49 548637.5546 -113000.0 -0.6 -0.7683 -0.9949 3558672 ACon1_002113 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H](C/C=C/3\[C@H](O)COC3=O)C(=C)CC[C@H]12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J16 compound treatment 577822.4638 -99400.0 -0.46 611868.0 -49600.0 -0.26 -0.51 -0.9651 3559659 ACon1_002114 CC(=CCn1cnc(N)c2ncnc12)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J17 compound treatment 442973.3333 -234000.0 -1.08 484970.7113 -176000.0 -0.94 -1.4257 -0.9974 3141 ACon1_002115 CO[C@H]1[C@@H](C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)OC)OC(=O)/C=C/c6cc(OC)c(OC)c(OC)c6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J18 compound treatment 445208.0537 -232000.0 -1.07 500520.979 -161000.0 -0.85 -1.3601 -0.9937 2107849 ACon1_002116 C[C@@H]1CCC(=C)/C(=C\C=C/C[C@@]1(C)CCc2ccoc2)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J19 compound treatment 478189.5911 -199000.0 -0.92 518373.2057 -143000.0 -0.76 -1.1856 -0.9955 1054600 ACon1_002117 COc1cc(C=O)cc2c3ccccc3[nH]c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J20 compound treatment 539990.4762 -137000.0 -0.63 553208.9552 -108000.0 -0.57 -0.8534 -0.9988 1024517 ACon1_002118 COc1cc2CCNC(C)c2cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J21 mock treatment 503545.1389 -174000.0 -0.8 524408.3045 -137000.0 -0.73 -1.0803 -0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J22 mock treatment 536385.5932 -141000.0 -0.65 524177.8656 -137000.0 -0.73 -0.974 -0.9984 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J23 compound treatment 502906.25 -174000.0 -0.8 581680.1619 -79700.0 -0.42 -0.8675 -0.955 1528803 ACon1_002119 CC1(C)C2(C)CCC1(OC2=O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 J24 compound treatment 567304.7619 -110000.0 -0.51 535586.7159 -126000.0 -0.67 -0.8304 -0.9908 3559578 ACon1_002120 COC(=O)/C=C(/CC[C@@H]1C(=C)CC[C@@H]2C(C)(C)C[C@@H](O)C[C@@]12C)\COC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K01 compound treatment 664635.1351 -12600.0 -0.06 652533.9367 -8880.0 -0.05 -0.0744 -0.9946 3553784 ACon1_002121 CC[C@@H]1[C@@H](O)N2[C@H]3C[C@@]45C(O)C3C1CC2[C@@H]5N(C)c6ccccc64 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K02 compound treatment 736283.4225 59000.0 0.27 721698.9796 60300.0 0.32 0.4186 0.9968 3557326 ACon1_002122 CC[C@H](C)[C@H]1NC(=O)[C@@H]2C[C@@]3([C@@H](Nc4ccccc43)N2C1=O)C(C)(C)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K03 compound treatment 750533.8645 73300.0 0.34 738508.1967 77100.0 0.41 0.5281 0.9955 3558174 ACon1_002123 CC(O)CCC1=CCC2C(CC1C)OC(=O)C2=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K04 compound treatment 680975.3695 3740.0 0.02 562844.0 -98600.0 -0.52 -0.3575 -0.6834 3559931 ACon1_002124 CC(=O)NCCCN(CCCCN(CCCNC(=O)/C=C/c1ccc(O)cc1)C(=O)C)C(=O)/C=C/c2ccc(O)cc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K05 compound treatment 745843.318 68600.0 0.32 815195.5556 154000.0 0.82 0.8005 0.915 3552912 ACon1_002125 C[C@]12O[C@@H]2CC3C(C)(C)CCC[C@]3(C)[C@]41CC[C@](C)(CC(=O)O)O4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K06 compound treatment 710315.534 33100.0 0.15 665186.4407 3770.0 0.02 0.122 0.793 3616399 ACon1_002126 COc1c(C2OCC(OC(=O)C)C(OC(=O)C)C2OC(=O)C)c(O)cc3oc(cc(=O)c13)c4ccc(OC5OC(CO)C(O)C(O)C5O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K07 mock treatment 808789.1892 132000.0 0.61 678035.5556 16600.0 0.09 0.4913 0.8014 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K08 mock treatment 855587.0647 178000.0 0.82 633341.2322 -28100.0 -0.15 0.4763 0.5698 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K09 compound treatment 657801.7621 -19400.0 -0.09 671086.5052 9670.0 0.05 -0.0271 -0.2626 3616400 ACon1_002127 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7OC[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K10 compound treatment 746065.3266 68800.0 0.32 757004.5045 95600.0 0.51 0.5829 0.9746 3616402 ACon1_002128 CC1CC[C@@]2(CC[C@]3(C(=O)O)C(=CCC4[C@@]5(C)CC[C@H](OC6OC(C)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(C)(C)C5CC[C@]43C)C2C1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K11 compound treatment 654665.3386 -22600.0 -0.1 648396.8872 -13000.0 -0.07 -0.1224 -0.9801 3616404 ACon1_002129 CC(C)C1CCC(=C2CCC(=CC12)C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K12 compound treatment 711344.3983 34100.0 0.16 575863.1179 -85600.0 -0.45 -0.2097 -0.4365 3616405 ACon1_002130 C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(CO)[C@@H](CC[C@@H]4C3CC[C@]5(C)[C@H](CC[C@]45O)C6=CC(=O)OC6)C2)[C@H](O)[C@H](O)[C@@H]1O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K13 compound treatment 592992.4242 -84200.0 -0.39 761029.8013 99600.0 0.53 0.0989 0.1508 3616407 ACon1_002131 C[C@@H]1[C@@H](C)c2ncccc2C(=O)OC[C@]3(C)O[C@@]45[C@H](OC(=O)C)[C@H]3[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@]5(COC(=O)C)[C@@H](OC(=O)c6ccccc6)[C@@H](O)[C@H](OC1=O)[C@]4(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K14 compound treatment 550234.8485 -127000.0 -0.59 550813.7652 -111000.0 -0.59 -0.829 -1.0 3616409 ACon1_002132 CCN1C[C@]2(C)CC[C@H](O)[C@]3([C@@H]4C[C@H]5[C@H](O)[C@@H]4[C@](O)(C[C@@H]5OC)[C@]6(O)[C@@H](OC)C32)[C@H]16 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K15 mock treatment 617343.4783 -59900.0 -0.28 608220.9738 -53200.0 -0.28 -0.3948 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K16 mock treatment 580783.8983 -96500.0 -0.44 583120.0 -78300.0 -0.42 -0.6082 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K17 compound treatment 723176.2115 45900.0 0.21 634507.0423 -26900.0 -0.14 0.0489 0.1913 3616411 ACon1_002133 CC(CO)C(=O)O[C@H]1CC(C)(C=C)C([C@H]2OC(=O)C(=C)[C@@H]21)C(=C)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K18 compound treatment 534472.119 -143000.0 -0.66 547461.8474 -114000.0 -0.6 -0.8929 -0.9991 3616413 ACon1_002134 OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K19 compound treatment 573940.4389 -103000.0 -0.48 644324.0 -17100.0 -0.09 -0.401 -0.8268 3616414 ACon1_002135 CC(C)(O)/C=C/C1=CC(O)C(C)(O)CC1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K20 compound treatment 578017.0213 -99200.0 -0.46 616218.3406 -45200.0 -0.24 -0.4931 -0.9545 3557979 ACon1_002136 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C3C1CC(O)C3=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K21 compound treatment 554027.5591 -123000.0 -0.57 557809.3385 -104000.0 -0.55 -0.7904 -0.9999 1116462 ACon1_002137 Nc1c(O)cccc1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K22 compound treatment 617080.3571 -60200.0 -0.28 625623.7624 -35800.0 -0.19 -0.3304 -0.9829 3559068 ACon1_002138 COc1cc(cc(OC)c1OC)C2OC(C(C)C2C)c3cc(OC)c(OC)c(OC)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K23 mock treatment 607491.9355 -69700.0 -0.32 541893.3824 -120000.0 -0.63 -0.6757 -0.9505 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 K24 mock treatment 559396.6942 -118000.0 -0.54 557974.026 -103000.0 -0.55 -0.7722 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L01 compound treatment 842230.0 165000.0 0.76 752585.1528 91200.0 0.48 0.8799 0.9761 3615597 ACon1_002139 COC1OC(=O)C(CCC2(C)C(C)CCC3(C)C2CC(O)C(O)C43CO4)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L02 compound treatment 937586.8545 260000.0 1.2 863608.2949 202000.0 1.07 1.6073 0.9984 3557877 ACon1_002140 OC[C@H]1O[C@@H](OC(CCc2ccc(O)cc2)CC(=O)CCc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L03 compound treatment 726748.8987 49500.0 0.23 696903.8462 35500.0 0.19 0.2945 0.9954 3616416 ACon1_002141 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H](C)[C@@H](O)[C@@H](OC(=O)/C=C/c4ccc(O)c(O)c4)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L04 compound treatment 862095.8904 185000.0 0.85 871611.3744 210000.0 1.11 1.3911 0.9912 1091317 ACon1_002142 CC(C)CC(=O)CC1(C)CCC(O1)c2ccoc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L05 compound treatment 748278.607 71000.0 0.33 774760.2041 113000.0 0.6 0.6567 0.9593 3616418 ACon1_002143 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)/C=C/c6ccc(O)cc6)[C@H](OC(=O)C)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L06 compound treatment 60326.5306 -617000.0 -2.84 47829.7872 -614000.0 -3.25 -4.313 -0.9978 3552811 ACon1_002144 C[C@@H]1OC(CC[C@@H]1O)O[C@@]23C(=O)C[C@](C)(O)C[C@@]3(O)C=CC4=C2C(=O)c5ccc([C@H]6C[C@@H](O[C@H]7CC[C@H](O[C@H]8C[C@@H](O)[C@H](O)[C@@H](C)O8)[C@H](C)O7)[C@H](O)[C@@H](C)O6)c(O)c5C4=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L07 mock treatment 745224.4898 68000.0 0.31 726882.6087 65500.0 0.35 0.4672 0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L08 mock treatment 708307.6923 31100.0 0.14 712941.1765 51500.0 0.27 0.2946 0.9546 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L09 compound treatment 629438.7755 -47800.0 -0.22 610603.0151 -50800.0 -0.27 -0.3465 -0.995 3558762 ACon1_002145 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@](C)(O)[C@H](C[C@@]31O)OC(=O)/C=C/c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L10 compound treatment 687617.1875 10400.0 0.05 697224.3346 35800.0 0.19 0.1681 0.8585 3558525 ACon1_002146 COC(=O)CCCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L11 compound treatment 572806.1224 -104000.0 -0.48 606923.9544 -54500.0 -0.29 -0.5449 -0.9702 3558176 ACon1_002147 COc1cc(O)c2C(=O)[C@H](OC(=O)C)[C@H](Oc2c1)c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L12 compound treatment 749020.4082 71800.0 0.33 692790.0763 31400.0 0.17 0.3517 0.9494 3554563 ACon1_002148 COC(=O)[C@]12C(=O)C(C)C(=O)[C@]2(C)C(=C[C@@H]3[C@]1(C)CC[C@@H]4C(C)(C)[C@H](CC[C@]43CO)OC(=O)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L13 compound treatment 556587.9121 -121000.0 -0.56 595872.6115 -65500.0 -0.35 -0.6393 -0.9744 3559438 ACon1_002149 CC(C)CC(=O)OC1C(Oc2ccc3ccc(=O)oc3c12)C(C)(C)OC(=O)CC(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L14 compound treatment 668265.5602 -8970.0 -0.04 683330.5439 21900.0 0.12 0.0529 0.429 3559513 ACon1_002150 C[C@]1(C[C@]23CCC4[C@](C)(CO)CCC[C@@]4(C)C3CC1)C=C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L15 mock treatment 698782.3834 21500.0 0.1 646539.0625 -14900.0 -0.08 0.0144 0.1139 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L16 mock treatment 617341.2698 -59900.0 -0.28 599119.0476 -62300.0 -0.33 -0.429 -0.996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L17 compound treatment 515162.5442 -162000.0 -0.75 631694.3396 -29700.0 -0.16 -0.64 -0.8378 3173755 ACon1_002151 C[C@@]12CC(=O)C3C(CCC4=CC(=O)CC[C@]34C)C2CC[C@]1(O)C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L18 compound treatment 499527.4262 -178000.0 -0.82 681817.2757 20400.0 0.11 -0.503 -0.6085 3553165 ACon1_002152 CC#CC#C/C=C\1/OC2(OC=CC2OC(=O)C=C(C)C)C=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L19 compound treatment 482458.1498 -195000.0 -0.9 443706.6667 -218000.0 -1.15 -1.4517 -0.9923 3616420 ACon1_002153 COc1cc(O)c(O)c(OC)c1C(=O)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L20 compound treatment 565770.1149 -111000.0 -0.51 669476.9737 8060.0 0.04 -0.3333 -0.6461 3557450 ACon1_002154 C[C@@]12CCC3[C@@H](CCC4=CC(=O)CC[C@]34C)C2CC[C@@H]1C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L21 compound treatment 562185.7585 -115000.0 -0.53 500657.3705 -161000.0 -0.85 -0.9781 -0.9739 1023016 ACon1_002155 COc1ccc2ccc(=O)oc2c1CC=C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L22 compound treatment 462627.9863 -215000.0 -0.99 559026.087 -102000.0 -0.54 -1.0838 -0.9601 3557458 ACon1_002156 C[C@@]12CCC3[C@@H](CC[C@H]4C[C@H](O)CC[C@@]43C)C2CC[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L23 mock treatment 529930.4029 -147000.0 -0.68 577860.0 -83600.0 -0.44 -0.7937 -0.9786 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 L24 mock treatment 471692.029 -206000.0 -0.95 575456.0 -86000.0 -0.46 -0.9927 -0.9437 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M01 compound treatment 619876.1468 -57400.0 -0.26 589684.2105 -71700.0 -0.38 -0.4561 -0.9842 3555864 ACon1_002157 OC(=O)CCCCCCCC(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M02 compound treatment 607005.0505 -70200.0 -0.32 579463.0542 -82000.0 -0.43 -0.5364 -0.9895 3616422 ACon1_002158 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](OC6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)C5CC[C@]43C)[C@@H]2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M03 compound treatment 729971.1934 52700.0 0.24 621760.7843 -39700.0 -0.21 0.0232 0.0722 3557282 ACon1_002159 C[C@@H]1O[C@@H](Oc2ccc(cc2)c3coc4cc(O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)ccc4c3=O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M04 compound treatment 690453.9007 13200.0 0.06 720885.8447 59500.0 0.32 0.2661 0.8284 3553312 ACon1_002160 CC(=O)NC1CCCN(O)C(=O)/C=C(\C)/CCOC(=O)C(CCCN(O)C(=O)/C=C(\C)/CCOC(=O)C(CCCN(O)C(=O)/C=C(\C)/CCOC1=O)NC(=O)C)NC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M05 compound treatment 597660.793 -79600.0 -0.37 571967.2131 -89500.0 -0.47 -0.595 -0.9919 3553564 ACon1_002161 CC(C)c1cc2C(O)[C@H]3OC(=O)[C@@]4(CCCC(C)(C)C34)c2c(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M06 compound treatment 685848.1013 8610.0 0.04 557869.9187 -104000.0 -0.55 -0.3603 -0.6543 3616424 ACon1_002162 COc1ccc(cc1)c2cc(=O)c3c(O)c(OC)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M07 compound treatment 691682.4034 14400.0 0.07 664055.2995 2640.0 0.01 0.057 0.8373 3616426 ACon1_002163 CC1CC(=O)C2C(O)(C1)CC(O)C34OC4c5c(O)cccc5C(=O)C23O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M08 compound treatment 648324.8175 -28900.0 -0.13 656987.3418 -4430.0 -0.02 -0.1109 -0.8191 3616427 ACon1_002164 CC(=O)OC(C)(C)/C=C/C(=O)[C@](C)(O)[C@H]1C(O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C=C(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M09 mock treatment 746807.5117 69600.0 0.32 592681.8182 -68700.0 -0.36 -0.0309 -0.0637 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M10 mock treatment 687705.3942 10500.0 0.05 606635.9649 -54800.0 -0.29 -0.1713 -0.5817 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M11 compound treatment 537339.9209 -140000.0 -0.65 552652.968 -109000.0 -0.58 -0.8641 -0.9984 3616429 ACon1_002165 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H](C)[C@@H](O)[C@@H](OC(=O)/C=C/c4ccc(O)cc4)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M12 compound treatment 523886.2745 -153000.0 -0.71 489726.2774 -172000.0 -0.91 -1.144 -0.9922 3616431 ACon1_002166 COc1c(O)cc2oc(cc(=O)c2c1O)c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M13 mock treatment 641347.619 -35900.0 -0.17 567524.3902 -93900.0 -0.5 -0.4692 -0.894 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M14 mock treatment 669094.8905 -8140.0 -0.04 606580.0 -54800.0 -0.29 -0.2322 -0.7918 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M15 compound treatment 612031.25 -65200.0 -0.3 603167.2355 -58300.0 -0.31 -0.4311 -0.9999 3616433 ACon1_002167 CC1OC(OC2C(O)C(O)C(OC3CCC4(C)C(CCC5(C)C4CC=C6C7CC(C)(C)C(O)CC7(C(O)CC65C)C(=O)O)C3(C)C)OC2CO)C(O)C(OC8OCC(O)C(O)C8O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M16 compound treatment 602513.1086 -74700.0 -0.34 534889.7959 -127000.0 -0.67 -0.7182 -0.952 3616434 ACon1_002168 CC(C)[C@H](NC(=O)[C@H](C)N(C)C)C(=O)N1CC[C@@H]2Oc3ccc(/C=C\NC(=O)[C@H](Cc4ccccc4)NC(=O)C21)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M17 compound treatment 546336.6013 -131000.0 -0.6 586092.5926 -75300.0 -0.4 -0.7094 -0.9799 3616436 ACon1_002169 CC1(CO)CC(=O)CC2(C)C1CCC3=C2COC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M18 compound treatment 590828.4519 -86400.0 -0.4 616777.3723 -44600.0 -0.24 -0.4492 -0.9691 3554069 ACon1_002170 CC1CCC2C(C)(C)C(=O)CC[C@]2(C)C31Cc4c(O3)c5CN(C(CCC(=O)O)C(=O)O)C(=O)c5cc4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M19 compound treatment 541969.0265 -135000.0 -0.62 528056.338 -133000.0 -0.71 -0.9413 -0.998 3616437 ACon1_002171 CCCc1c(O)c2C(=O)c3c(O)cccc3C(=O)c2cc1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M20 compound treatment 603422.6804 -73800.0 -0.34 590974.0741 -70400.0 -0.37 -0.5049 -0.9989 3555795 ACon1_002172 O=C1NC2CCc3nc4ccccc4c(=O)n3C2=Nc5ccccc15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M21 compound treatment 614509.0253 -62700.0 -0.29 579638.0597 -81800.0 -0.43 -0.5113 -0.9806 3616438 ACon1_002173 O[C@H]1[C@H](O)[C@@H](COC(=O)c2ccc(O)cc2)O[C@@H](Oc3ccc(O)cc3)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M22 compound treatment 585955.102 -91300.0 -0.42 627382.3529 -34000.0 -0.18 -0.4253 -0.9286 3554747 ACon1_002174 COC1=CC(=O)CC(C)C21Oc3cc(OC)cc(OC)c3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M23 compound treatment 644857.1429 -32400.0 -0.15 541568.4647 -120000.0 -0.64 -0.5551 -0.8501 3554983 ACon1_002175 COc1cc(O)c2C(=O)O[C@@]3(C)C[C@H](O)[C@@H](O)C=C3c2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 M24 compound treatment 578880.1653 -98400.0 -0.45 524587.0445 -137000.0 -0.73 -0.8339 -0.9744 3616440 ACon1_002176 Oc1ccc(CCCCC(=O)CCc2ccc(O)c(O)c2)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N01 compound treatment 834013.6364 157000.0 0.72 775149.6063 114000.0 0.6 0.9378 0.9959 3616441 ACon1_002177 COc1ccc(/C=C/C(=O)O[C@H]2[C@H](C)O[C@@H](O[C@@H]3C=C(CO)[C@@H]4[C@H]3C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@@H]2O)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N02 compound treatment 405415.5844 -272000.0 -1.25 362821.4286 -299000.0 -1.58 -2.0063 -0.9933 3557494 ACon1_002178 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)cc5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N03 compound treatment 706004.3478 28800.0 0.13 630937.8238 -30500.0 -0.16 -0.0205 -0.0981 3616443 ACon1_002179 C[C@@H]1[C@H]2[C@@H](CC1=O)C(=C)C[C@H](OC(=O)C(=C)CO)[C@@H]3[C@@H]2OC(=O)C3=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N04 compound treatment 845300.9259 168000.0 0.78 569297.1429 -92100.0 -0.49 0.2025 0.2211 3553392 ACon1_002180 CC(=O)OCC#Cc1ccc(s1)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N05 compound treatment 859225.2964 182000.0 0.84 879431.2268 218000.0 1.16 1.4111 0.9876 3616445 ACon1_002181 C[C@@H]1CCOC(=O)/C=C/C=C\C(=O)O[C@@H]2C[C@H]3O[C@@H]4C=C(CC[C@]4(COC(=O)[C@H]1O)[C@]2(C)[C@@]53CO5)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N06 compound treatment 945819.0045 269000.0 1.24 728360.1533 66900.0 0.36 1.1269 0.8746 3559417 ACon1_002182 COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CC(=O)OC3)C(=CC[C@@H]12)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N07 compound treatment 839465.3465 162000.0 0.75 645884.9206 -15500.0 -0.08 0.4708 0.6255 3616447 ACon1_002183 CNc1ccccc1C(=O)OC2OC(C)C(O)C(O)C2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N08 compound treatment 732673.4694 55400.0 0.26 858228.0 197000.0 1.04 0.9189 0.855 3559635 ACon1_002184 CC(=CC(O)C/C(=C\CCC(C)(O)C=C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N09 mock treatment 809632.3529 132000.0 0.61 690272.7273 28900.0 0.15 0.5399 0.8578 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N10 mock treatment 725791.8552 48600.0 0.22 620920.0 -40500.0 -0.21 0.0064 0.0208 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N11 compound treatment 638644.7876 -38600.0 -0.18 575081.5603 -86300.0 -0.46 -0.4497 -0.9152 3616448 ACon1_002185 CCC[C@@H](O)[C@H](O)[C@@H]1CC(=CC(=O)O1)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N12 compound treatment 723123.8938 45900.0 0.21 514658.4362 -147000.0 -0.78 -0.4008 -0.4969 3558517 ACon1_002186 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N13 mock treatment 708885.3211 31600.0 0.15 615891.3043 -45500.0 -0.24 -0.0676 -0.2394 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N14 mock treatment 681741.9355 4500.0 0.02 641528.1385 -19900.0 -0.11 -0.0599 -0.5572 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N15 compound treatment 500588.7097 -177000.0 -0.81 370500.0 -291000.0 -1.54 -1.6671 -0.9554 3557442 ACon1_002187 CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N16 compound treatment 632976.6082 -44300.0 -0.2 612432.7485 -49000.0 -0.26 -0.3281 -0.9929 3552715 ACon1_002188 C[C@@H]1CCC2[C@@H](C)C(=O)OC3O[C@@]4(C)CCC1[C@@]23OO4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N17 compound treatment 637547.4138 -39700.0 -0.18 659869.3878 -1550.0 -0.01 -0.1352 -0.7381 3557445 ACon1_002189 CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N18 compound treatment 634421.0526 -42800.0 -0.2 533141.844 -128000.0 -0.68 -0.6207 -0.8762 3559502 ACon1_002190 COC(=O)[C@]1(C)CCC[C@@]2(C)C3CC[C@@H]4C[C@]3(CC4=C)CCC12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N19 compound treatment 499889.9676 -177000.0 -0.82 464295.3737 -197000.0 -1.05 -1.3176 -0.9926 3559390 ACon1_002191 Oc1ccc2C(=O)C(C(Oc2c1)c3ccc(O)c(O)c3)C4C(Oc5cc(O)ccc5C4=O)c6ccc(O)c(O)c6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N20 compound treatment 596989.6194 -80200.0 -0.37 503471.0145 -158000.0 -0.84 -0.8541 -0.9325 3559784 ACon1_002192 O=C1/C(=C/2\Nc3ccccc3C2=O)/Nc4ccccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N21 compound treatment 531851.4493 -145000.0 -0.67 711474.026 50100.0 0.27 -0.2864 -0.3971 1090111 ACon1_002193 CC(=C)C1Cc2cc(ccc2O1)C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N22 compound treatment 505459.2593 -172000.0 -0.79 575017.6056 -86400.0 -0.46 -0.8842 -0.9661 3557455 ACon1_002194 C[C@@]12CCC3[C@@H](CCC4=CC(=O)C=C[C@]34C)C2CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N23 compound treatment 632888.8889 -44300.0 -0.2 600262.7451 -61200.0 -0.32 -0.374 -0.9753 3553947 ACon1_002195 CC1=CCC[C@]2(C)CC[C@H](C[C@@H]12)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 N24 compound treatment 478575.0 -199000.0 -0.92 461536.8421 -200000.0 -1.06 -1.3975 -0.9974 1737132 ACon1_002196 COc1cc-2c(CC3N(C)CCc4cc(O)c(OC)c2c34)cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O01 compound treatment 594106.6667 -83100.0 -0.38 503646.8254 -158000.0 -0.84 -0.8628 -0.9374 3554295 ACon1_002197 CCCCCCCC1OC(=O)CCC(O)/C=C/C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O02 compound treatment 526031.1419 -151000.0 -0.7 608501.9608 -52900.0 -0.28 -0.6915 -0.92 3616449 ACon1_002198 CC1C(O)C=C2[C@@H](CC[C@@]3(O)[C@](C)([C@H](O)CC[C@]23C)C(=O)O)[C@H]1C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O03 compound treatment 647034.2205 -30200.0 -0.14 633780.0 -27600.0 -0.15 -0.2022 -0.9997 3558022 ACon1_002199 C/C/1=C\[C@H](O)C2[C@H](OC(=O)C2=C)/C=C(\CO)/CCC1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O04 compound treatment 770063.745 92800.0 0.43 738255.0607 76800.0 0.41 0.5909 0.9997 3616451 ACon1_002200 CC(=O)N(O)CCCCCNC(=O)CC(O)(CC(=O)NCCCCCN(O)C(=O)C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O05 compound treatment 730184.8341 52900.0 0.24 703968.3794 42500.0 0.23 0.3322 0.9992 3616452 ACon1_002201 CCC/C=C/C(=O)OC1C(O)C2(C(O)OC34CCC5C6(C)CCC(OC7OC(C(O)C(OC8OC(CO)C(O)C(O)C8OC9OC(C)C(O)C(O)C9OC%10OCC(O)C(O)C%10O)C7OC%11OC(CO)C(O)C(O)C%11O)C(=O)O)C(C)(C)C6CCC5(C)C4(C)CC2OC(=O)C)C3CC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O06 compound treatment 660018.6047 -17200.0 -0.08 645967.7419 -15500.0 -0.08 -0.1141 -0.9999 3616299 ACon1_002202 COC(=O)Cc1c(oc2cc(C)cc(O)c2c1=O)C(=CC(=O)O)Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O07 compound treatment 645465.7534 -31800.0 -0.15 702387.0968 41000.0 0.22 0.05 0.191 3616454 ACon1_002203 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(C5CC[C@]43C)C(=O)O)[C@@H]2[C@]1(C)O)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O08 compound treatment 662189.4273 -15000.0 -0.07 605577.2727 -55800.0 -0.3 -0.2585 -0.8498 3616455 ACon1_002204 OC[C@H]1O[C@@H](Oc2c(O)cccc2COC(=O)C3(O)C4C=CC(C5C4C=CC(=O)C5(O)C(=O)OCc6cccc(O)c6O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)C3=O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O09 compound treatment 600483.3948 -76800.0 -0.35 680652.1739 19200.0 0.1 -0.1782 -0.4836 3616458 ACon1_002205 COc1cc(O)c(C(=O)c2c(O)cc(C)cc2O)c(c1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O10 compound treatment 632500.0 -44700.0 -0.21 626010.4712 -35400.0 -0.19 -0.2787 -0.9989 1063449 ACon1_002206 COc1c(C)c(OCC=C(C)C)cc(CO)c1CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O11 mock treatment 616940.9091 -60300.0 -0.28 608842.3423 -52600.0 -0.28 -0.3938 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O12 mock treatment 631139.0135 -46100.0 -0.21 633734.5972 -27700.0 -0.15 -0.2542 -0.9837 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O13 compound treatment 645988.5057 -31200.0 -0.14 637069.2641 -24300.0 -0.13 -0.1932 -0.9985 3616460 ACon1_002207 C[C@H](CO)C1=C(O)C(=O)[C@@]2(C)C/C=C(\C)/CC/C=C(\C)/CC[C@H](O)\C(=C\C[C@H]12)\C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O14 compound treatment 582395.0617 -94800.0 -0.44 580866.3968 -80600.0 -0.43 -0.6114 -0.9999 3616463 ACon1_002208 OC[C@H]1O[C@@H](OC2OC=C3C(CC4N(CCc5c4[nH]c6ccccc56)C3=O)[C@H]2C=C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O15 compound treatment 586684.4106 -90600.0 -0.42 679255.144 17800.0 0.09 -0.2284 -0.5334 3616464 ACon1_002209 CC1OC(OC2C(O)C(O)C(OC3CCC4(C)C(CCC5(C)C4CC=C6C7CC(C)(C)C8CC7(C(O)CC65C)C(=O)O8)C3(C)C)OC2CO)C(O)C(OC9OCC(O)C(O)C9O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O16 compound treatment 554410.3774 -123000.0 -0.57 566647.0588 -94800.0 -0.5 -0.756 -0.9982 3616465 ACon1_002210 COC1OC2C(c3ccc4OCOc4c13)[N+](C)([O-])CCc5cc6OCOc6cc25 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O17 compound treatment 591367.0886 -85900.0 -0.4 620919.8312 -40500.0 -0.21 -0.4319 -0.9587 3616466 ACon1_002211 CCC(C)C(O)(CC(=O)OCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1)C(=O)OCc3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O18 compound treatment 497259.542 -180000.0 -0.83 465858.7786 -196000.0 -1.04 -1.3203 -0.9939 3616469 ACon1_002212 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1OC(=O)/C=C/c3ccc(O)c(O)c3)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O19 compound treatment 529850.6944 -147000.0 -0.68 572234.7826 -89200.0 -0.47 -0.8151 -0.9843 3616471 ACon1_002213 CC(C)CC1NC(=O)C2(O)C1C(C)C(=CC2/C=C(\C)/CCC(O)C(O)/C=C/C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O20 compound treatment 623454.2773 -53800.0 -0.25 514898.3607 -147000.0 -0.78 -0.7249 -0.8886 3554660 ACon1_002214 COC(=O)C1(Cc2ccc(O)c(CC3OC3(C)C)c2)OC(=O)C(=C1c4ccc(O)cc4)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O21 compound treatment 558103.6036 -119000.0 -0.55 493294.7368 -168000.0 -0.89 -1.019 -0.9729 3616474 ACon1_002215 C[C@H](CC/C=C(\C)/C(=O)OC1OC(CO)C(O)C(O)C1O)[C@H]2CC(OC3OCC(O)C(O)C3O)[C@@]4(C)C5CC[C@@H]6[C@]7(C[C@@]57CC(O)[C@]24C)CC[C@H](O[C@@H]8OC(CO)C(O)C(O)C8OC9OC(CO)C(O)C(O)C9O)C6(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O22 compound treatment 545821.5613 -131000.0 -0.61 514707.113 -147000.0 -0.78 -0.9788 -0.9924 3558516 ACon1_002216 COC(=O)C(C(O)c1ccc(O)c(OC)c1)C(CO)Cc2ccc(O)c(OC)c2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O23 compound treatment 334982.4561 -342000.0 -1.58 443107.6923 -218000.0 -1.16 -1.9348 -0.9884 3616477 ACon1_002217 COC1(C)C(O)C(=O)C(=C(Oc2cc(C)c(C(=O)NCCc3ccc(O)c(O)c3)c(O)c2C)C1O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 O24 compound treatment 481267.148 -196000.0 -0.9 495984.4961 -165000.0 -0.88 -1.2595 -0.9999 3616478 ACon1_002218 CC1CCC2(C)C(CC(O)C(O)C32CO3)C1(C)CCC4=CC(=O)OC4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P01 compound treatment 751054.1872 73800.0 0.34 599351.6949 -62100.0 -0.33 0.0079 0.0167 3616479 ACon1_002219 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@@H](C[C@]3(C)O)OC(=O)CCc4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P02 compound treatment 658461.2069 -18800.0 -0.09 632181.8182 -29200.0 -0.16 -0.1709 -0.9621 3559761 ACon1_002220 CS(=O)(=O)CCC/C(=N\OS(=O)(=O)O)/S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P03 compound treatment 597025.1046 -80200.0 -0.37 563534.2466 -97900.0 -0.52 -0.6287 -0.9862 3616481 ACon1_002221 COC(=O)C1=COC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H](C)[C@@H](OC(=O)/C=C/c4ccc(O)c(O)c4)[C@@H](O)[C@@H]31 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P04 compound treatment 660035.0 -17200.0 -0.08 718287.5536 56900.0 0.3 0.1572 0.504 3559446 ACon1_002222 COc1cc2OC(C)(C)C=Cc2cc1C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P05 compound treatment 654826.087 -22400.0 -0.1 558674.5098 -103000.0 -0.54 -0.4584 -0.8265 3558885 ACon1_002223 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](C=C)[C@@H]1C[C@@H]3N[C@@H](Cc4c3[nH]c5ccccc45)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P06 compound treatment 749020.2429 71800.0 0.33 632127.9621 -29300.0 -0.16 0.1242 0.3397 3558178 ACon1_002224 CC1(O)CCCC2(C)CCC(CC12)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P07 compound treatment 638223.301 -39000.0 -0.18 593561.9469 -67900.0 -0.36 -0.3817 -0.9487 3558887 ACon1_002225 C[C@@H]1CC[C@@]2(CC[C@]3(C(=O)O)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)[C@@H]2[C@H]1C)C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P08 compound treatment 682911.2903 5670.0 0.03 628165.0485 -33300.0 -0.18 -0.1062 -0.5957 3559717 ACon1_002226 CC1(C)CC(=O)c2ccc(O)cc2O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P09 compound treatment 617651.6393 -59600.0 -0.27 552665.2361 -109000.0 -0.58 -0.6022 -0.9425 3559894 ACon1_002227 CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CCC4[C@@]5(C)CCC(=O)C(C)(C)C5C(O)C[C@]43C)C12)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P10 compound treatment 649375.0 -27900.0 -0.13 536656.25 -125000.0 -0.66 -0.5588 -0.8289 3557753 ACon1_002228 CC(O)/C=C/C1(O)C(=CC(=O)CC1(C)C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P11 mock treatment 586188.3408 -91000.0 -0.42 547168.8312 -114000.0 -0.61 -0.7254 -0.9839 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P12 mock treatment 602645.3202 -74600.0 -0.34 596008.9686 -65400.0 -0.35 -0.4886 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P13 compound treatment 669622.0096 -7620.0 -0.04 540941.6058 -120000.0 -0.64 -0.4767 -0.7448 3552932 ACon1_002229 C[C@H](CCCC(C)(C(=O)O)C(=O)O)C1CCC2C3[C@H](O)CC4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P14 compound treatment 512904.5936 -164000.0 -0.76 498082.397 -163000.0 -0.87 -1.1485 -0.9978 3553129 ACon1_002230 C[C@H]1CC[C@@H]2[C@@H](OC(=O)C2=C)[C@@]3(C)[C@H]1C=CC3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P15 compound treatment 565334.8837 -112000.0 -0.52 492280.4878 -169000.0 -0.9 -0.9993 -0.9655 346 ACon1_002231 CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]4[C@@]5(CO[C@@H]5C[C@H](O)[C@@]4(C)C1=O)OC(=O)C)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c6ccccc6)c7ccccc7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P16 compound treatment 529446.3519 -148000.0 -0.68 534043.6508 -127000.0 -0.68 -0.9597 -1.0 3552697 ACon1_002232 C[C@@H]1CC[C@@H]2[C@@H]1[C@H]3[C@@H](CCC2(O)CO)C3(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P17 compound treatment 446232.7273 -231000.0 -1.07 427330.8271 -234000.0 -1.24 -1.6312 -0.9971 3557610 ACon1_002233 O[C@H]1[C@H](O)[C@@H](OC(=O)c2ccc(O)cc2)[C@H](Oc3ccc(O)cc3)O[C@@H]1COC(=O)CC(=O)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P18 compound treatment 476648.6486 -201000.0 -0.93 412846.5347 -249000.0 -1.32 -1.5864 -0.985 3559496 ACon1_002234 COC(=O)C[C@H](C)CC[C@H]1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P19 compound treatment 473294.1176 -204000.0 -0.94 415457.6803 -246000.0 -1.3 -1.5875 -0.9871 3554682 ACon1_002235 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H](C)[C@H](C[C@@H]31)OC(=O)C4=CO[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H]6[C@@H](C)[C@H](C[C@@H]64)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P20 compound treatment 480114.7541 -197000.0 -0.91 385323.4323 -276000.0 -1.46 -1.6783 -0.9737 3557448 ACon1_002236 C[C@@]12CCC3[C@@H](CCc4cc(O)ccc34)C2CC[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P21 compound treatment 479090.4977 -198000.0 -0.91 434687.9699 -227000.0 -1.2 -1.4965 -0.9908 3559463 ACon1_002237 C/C(=C\CCC(C)(O)C=C)/CCC(O)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P22 compound treatment 401902.1739 -275000.0 -1.27 380869.186 -281000.0 -1.49 -1.95 -0.9969 3557457 ACon1_002238 C[C@@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C2CC[C@@H]1C(=O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P23 compound treatment 338333.3333 -339000.0 -1.56 296534.2466 -365000.0 -1.94 -2.4736 -0.9944 3559434 ACon1_002239 CCCCCCCCCCCC=C=CCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2296 P24 compound treatment 436686.2745 -241000.0 -1.11 387510.8225 -274000.0 -1.45 -1.8117 -0.9911 3559647 ACon1_002240 COc1ccc2C(=O)/C(=C/c3ccccc3)/Oc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A01 compound treatment 623842.7948 -6250.0 -0.03 618227.7228 17000.0 0.09 0.0433 0.458 3552712 ACon1_002241 C[C@@H]1CCC/C=C/[C@H]2C[C@@H](O)C[C@@H]2[C@@H](O)/C=C/C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A02 compound treatment 683000.0 52900.0 0.24 701398.2684 100000.0 0.53 0.5482 0.9377 3559403 ACon1_002242 O=CNCCc1c[nH]c2ccccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A03 compound treatment 672900.0 42800.0 0.2 668968.9119 67700.0 0.36 0.3936 0.9602 1060832 ACon1_002243 OCC(Cc1ccccc1)NC(=O)c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A04 compound treatment 668192.1182 38100.0 0.18 565293.8389 -35900.0 -0.19 -0.0106 -0.0408 3555658 ACon1_002244 O=C(N[C@H](COC(=O)[C@H](Cc1ccccc1)NC(=O)c2ccccc2)Cc3ccccc3)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A05 compound treatment 874517.6991 244000.0 1.13 589626.2136 -11600.0 -0.06 0.7535 0.6675 3554875 ACon1_002245 COc1cc(ccc1O)[C@H]2[C@H]3COC4(O)[C@H]3C(=CC2C4=O)[C@H]5Oc6cc(O)cc(O)c6C(=O)[C@@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A06 compound treatment 570014.7059 -60100.0 -0.28 552677.4194 -48600.0 -0.26 -0.3781 -0.9993 1032994 ACon1_002246 O=C1CC(Oc2ccccc12)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A07 compound treatment 774056.1224 144000.0 0.66 626116.5919 24900.0 0.13 0.5627 0.8314 3559373 ACon1_002247 C/C=C(\C)/C(=O)O[C@@H]1[C@H](OC(=O)C)[C@@H](C)[C@](C)(CC(=O)c2ccoc2)C3CCC=C(C)[C@]13C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A08 compound treatment 610200.9346 -19900.0 -0.09 551967.033 -49300.0 -0.26 -0.2497 -0.9014 3557592 ACon1_002248 CC1(C)CCCC2(C)C(CCC(=C)C(O)CO)C(C)(O)CCC12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A09 compound treatment 725313.4328 95200.0 0.44 557188.1188 -44100.0 -0.23 0.1453 0.2921 3559707 ACon1_002249 COc1ccc2C=C(COc2c1)c3cc(O)c(O)cc3OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A10 compound treatment 719497.4619 89400.0 0.41 515350.0 -85900.0 -0.46 -0.0306 -0.0498 3559278 ACon1_002250 CC1=CC(=O)C[C@]2(C)CC[C@H](CC12)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A11 compound treatment 661776.2557 31700.0 0.15 657675.5319 56400.0 0.3 0.315 0.9456 3559492 ACon1_002251 C[C@@H]1CCC2C(=CC(=O)CC2(C)C)[C@@]1(C)CC/C(=C/CO)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A12 compound treatment 638904.5455 8810.0 0.04 569345.7447 -31900.0 -0.17 -0.0909 -0.5224 3616487 ACon1_002252 CC1OC(=O)CC2C(=CC3CC(C)(C)CC321)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A13 mock treatment 613853.9326 -16200.0 -0.07 703788.3598 103000.0 0.54 0.3316 0.604 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A14 mock treatment 653958.1152 23900.0 0.11 623338.0282 22100.0 0.12 0.1607 0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A15 compound treatment 754257.2816 124000.0 0.57 663815.6682 62600.0 0.33 0.6396 0.9664 3616488 ACon1_002253 CON1c2ccccc2[C@]3(C=C(OC)C(=O)N4/C(=C/c5cnc[nH]5)/C(=O)N[C@@]143)C(C)(C)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A16 compound treatment 644304.1475 14200.0 0.07 620534.3137 19300.0 0.1 0.1187 0.9768 1637425 ACon1_002254 Cc1cc(O)c(Cc2c(O)cc(C)oc2=O)c(=O)o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A17 compound treatment 688584.9057 58500.0 0.27 568105.2632 -33100.0 -0.18 0.0665 0.2064 3558320 ACon1_002255 COc1cc(/C=C/C(=O)NCCCCNC(=O)C)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A18 compound treatment 671785.7143 41700.0 0.19 641462.6168 40200.0 0.21 0.2868 0.9987 3553473 ACon1_002256 CC(C)(O)C1=CCC2(COC3C2)C1CCC3(O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A19 compound treatment 746566.5025 116000.0 0.54 605893.1624 4650.0 0.02 0.3973 0.7388 3558714 ACon1_002257 COc1cc(O)c2c(=O)c(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)c(oc2c1)c5ccc(O)cc5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A20 compound treatment 628720.8333 -1370.0 -0.01 579031.4961 -22200.0 -0.12 -0.0878 -0.7441 3616491 ACon1_002258 COc1cc(oc(=O)c1C)/C(=C/C(=C\C(=O)O)/C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A21 compound treatment 694072.7273 64000.0 0.3 614529.9539 13300.0 0.07 0.2585 0.852 3559881 ACon1_002259 CC(=CCc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c3C(=O)C[C@H](Oc13)c4ccc(O)cc4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A22 compound treatment 610407.0796 -19700.0 -0.09 532559.8706 -68700.0 -0.36 -0.3218 -0.8571 3616494 ACon1_002260 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](CO)O[C@@H](O[C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5C=C[C@@]78OC[C@@]9(CCC(C)(C)C[C@H]98)[C@@H](O)C[C@]76C)[C@]4(C)CO)[C@@H]3O[C@@H]%10O[C@@H](C)[C@H](O)[C@@H](O)[C@H]%10O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A23 compound treatment 653394.3089 23300.0 0.11 537879.8283 -63400.0 -0.34 -0.1617 -0.4582 3552806 ACon1_002261 C[C@@H]1O[C@@H](OCC2OC(O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC[C@@H]6C7[C@@](C)(O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)[C@@H](CC=C(C)C)O[C@@]7(O)[C@H](O)[C@]65C)C3(C)C)C(O)C(O)C2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 A24 compound treatment 690719.457 60600.0 0.28 589986.9565 -11300.0 -0.06 0.1555 0.5439 1062887 ACon1_002262 CC1C(=O)c2cc3OCOc3cc2CCN(C)Cc4c5OCOc5ccc14 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B01 compound treatment 670463.6364 40400.0 0.19 649816.0377 48600.0 0.26 0.3138 0.9873 1047225 ACon1_002263 COC1C(O)CC2CN3CCc4c([nH]c5cc(OC)ccc45)C3CC2C1C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B02 mock treatment 814369.6682 184000.0 0.85 713036.036 112000.0 0.59 1.0202 0.9845 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B03 compound treatment 774430.0 144000.0 0.67 662592.1053 61400.0 0.33 0.7008 0.9458 3559335 ACon1_002264 COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)/C(=C\C)/C1CC(=O)OCC(CO)C3CC(OC(=O)CC4\C(=C\C)\C(OC5OC(CO)C(O)C(O)C5O)OC=C4C(=O)OC)C(C)C3COC(=O)CC6\C(=C\C)\C(OC7OC(CO)C(O)C(O)C7O)OC=C6C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B04 mock treatment 751966.3462 122000.0 0.56 728004.386 127000.0 0.67 0.8728 0.996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B05 compound treatment 786272.3404 156000.0 0.72 708682.1705 107000.0 0.57 0.9122 0.9933 3616499 ACon1_002265 CO[C@@H]1[C@H](Oc2c(CC=C(C)C)c(O)c(CC=C(C)C)c(O)c2C1=O)c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B06 mock treatment 844351.7588 214000.0 0.99 672932.2034 71700.0 0.38 0.9676 0.9139 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B07 compound treatment 726792.6267 96700.0 0.45 753508.0 152000.0 0.81 0.8864 0.9608 3616501 ACon1_002266 O[C@H]1[C@@H](C[C@@](O)(C[C@H]1OC(=O)/C=C/c2ccc(O)cc2)C(=O)O)OC(=O)/C=C/c3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B08 mock treatment 846583.7321 216000.0 1.0 580062.8019 -21200.0 -0.11 0.6265 0.6236 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B09 compound treatment 685480.3493 55400.0 0.26 660344.186 59100.0 0.31 0.4023 0.9948 3616503 ACon1_002267 COC(=O)[C@]12O[C@@H]2[C@@H](C[C@H]3[C@]4(C)C[C@H](OC(=O)[C@H]4CC[C@]31C)c5ccoc5)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B10 mock treatment 751511.1111 121000.0 0.56 726947.1545 126000.0 0.67 0.8674 0.9962 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B11 compound treatment 740009.3897 110000.0 0.51 670871.4286 69600.0 0.37 0.6196 0.9879 3616506 ACon1_002268 OC1C(O)C2C(C(C1C=C2/C=C/C(=O)O)c3ccc(O)c(O)c3)C(=O)OC(Cc4ccc(O)c(O)c4)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B12 mock treatment 741136.8421 111000.0 0.51 754513.6364 153000.0 0.81 0.9369 0.9752 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B13 mock treatment 713396.9849 83300.0 0.38 697500.0 96300.0 0.51 0.6327 0.9902 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B14 mock treatment 675190.2439 45100.0 0.21 846142.2222 245000.0 1.3 1.0656 0.81 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B15 compound treatment 686879.5812 56800.0 0.26 613956.3319 12700.0 0.07 0.2329 0.8611 3558465 ACon1_002269 CC1OC(OC2C(O)C(O)C(CO)OC2Oc3c(oc4cc(OC5OC(C)C(O)C(O)C5O)cc(O)c4c3=O)c6ccc(O)cc6)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B16 mock treatment 643478.673 13400.0 0.06 658035.7143 56800.0 0.3 0.2567 0.8347 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B17 compound treatment 726364.0351 96300.0 0.44 662355.6338 61100.0 0.32 0.5431 0.9881 3555288 ACon1_002270 COc1ccc2CC3[C@@H]4C=C[C@H](O)[C@@H]5Oc1c2C54CCN3C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B18 mock treatment 623401.8692 -6690.0 -0.03 655438.4615 54200.0 0.29 0.1814 0.6276 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B19 compound treatment 688954.1667 58900.0 0.27 555382.4885 -45900.0 -0.24 0.0199 0.0547 3559140 ACon1_002271 C/C=C(/C)\C(=O)O[C@H]1CC(C)(C)C[C@H]2C3=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H]6O[C@@H]9O[C@@H](C)[C@H](O)[C@@H](O)[C@H]9O)C(=O)O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)[C@@H](O)[C@@H](O)[C@@]12CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B20 mock treatment 695905.8296 65800.0 0.3 587731.8182 -13500.0 -0.07 0.1639 0.5257 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B21 compound treatment 545172.7575 -84900.0 -0.39 505693.2153 -95500.0 -0.51 -0.6353 -0.9919 3559603 ACon1_002272 CC1(C)CCCC2C3(C)CCC(C)(CC3CCC21O)C(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B22 mock treatment 648676.0563 18600.0 0.09 523076.9231 -78200.0 -0.41 -0.2326 -0.5493 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B23 compound treatment 501054.7945 -129000.0 -0.6 625391.1111 24100.0 0.13 -0.3302 -0.5425 3558670 ACon1_002273 Oc1ccc2c(cc3NC(=O)c4cc5OCOc5c2c34)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 B24 mock treatment 668038.2775 37900.0 0.17 578121.2121 -23100.0 -0.12 0.037 0.1733 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C01 compound treatment 473910.8911 -156000.0 -0.72 516275.5556 -85000.0 -0.45 -0.828 -0.9745 3557715 ACon1_002274 OC[C@H]1O[C@@H](O[C@H](CCCCc2ccc(O)c(O)c2)CCc3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C02 compound treatment 246601.7699 -383000.0 -1.77 371695.6522 -230000.0 -1.22 -2.1114 -0.9834 3559945 ACon1_002275 OC[C@H]1O[C@@H](OC(C#N)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C03 compound treatment 522546.6667 -108000.0 -0.5 799275.3036 198000.0 1.05 0.392 0.3375 3558659 ACon1_002276 CC(C)(O)c1ccc2c(CCC3C(C)(CCCC32C)C(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C04 compound treatment 878868.5446 249000.0 1.15 672891.2134 71600.0 0.38 1.08 0.8936 3553732 ACon1_002277 CC(NC(=O)/C=C/C(=O)O)C(=O)NC(C(C)c1c[nH]c2ccccc12)C(=O)NC(Cc3c[nH]c4ccccc34)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C05 compound treatment 816860.9865 187000.0 0.86 717083.3333 116000.0 0.61 1.0435 0.9863 3553321 ACon1_002278 CC(=O)O[C@@H]/1C\C=C(/C)\C[C@@H](OC(=O)/C(=C/CO)/CO)C2[C@H](OC(=O)C2=C)/C=C1/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C06 compound treatment 768539.5349 138000.0 0.64 661238.6831 60000.0 0.32 0.6765 0.9483 3616509 ACon1_002279 CC1=C[C@H](O)[C@H]2C(C)(C)CCC[C@]2(C)[C@@]1(O)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C07 compound treatment 668219.8953 38100.0 0.18 660929.9065 59700.0 0.32 0.3482 0.9615 3554995 ACon1_002280 COc1cc(O)cc2cc3OC(C)(O)CC(=O)c3c(O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C08 compound treatment 799793.8596 170000.0 0.78 626267.5439 25000.0 0.13 0.6472 0.8154 3554703 ACon1_002281 COC(=O)c1cc(O)cc(O)c1C(=O)c2c(O)cc(C)cc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C09 compound treatment 876798.3193 247000.0 1.14 1109879.31 509000.0 2.7 2.7121 0.9263 3559543 ACon1_002282 C[C@]12C[C@H]3OC(=O)C(=C)[C@H]3CC2C(=C)CC[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C10 compound treatment 697931.3305 67800.0 0.31 593573.7705 -7670.0 -0.04 0.1925 0.61 2107842 ACon1_002283 C[C@H]1C[C@@]2(O)[C@H]([C@H]1OC(=O)c3ccccc3)[C@@H](OC(=O)COC(=O)C)[C@]4(C[C@@H]5[C@H](CC(C)(C)C5=O)[C@](C)(C4OC(=O)C)[C@H]2OC(=O)C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C11 mock treatment 801837.963 172000.0 0.79 610708.9202 9470.0 0.05 0.5955 0.7504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C12 mock treatment 650051.8868 20000.0 0.09 692822.314 91600.0 0.49 0.4086 0.8264 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C13 compound treatment 677903.3613 47800.0 0.22 584451.3274 -16800.0 -0.09 0.0929 0.3908 3554771 ACon1_002284 COc1c(O)ccc2C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c4cc(C)cc(O)c4C(=O)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C14 compound treatment 766290.6404 136000.0 0.63 565217.5732 -36000.0 -0.19 0.309 0.4707 3616510 ACon1_002285 CC1CC(=O)C2=C(O1)OC3(C)CCC4(O)C(C)(C)C=CC(=O)C4(C)C3C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C15 mock treatment 644033.9806 13900.0 0.06 690072.3982 88800.0 0.47 0.3786 0.7962 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C16 mock treatment 712246.9636 82200.0 0.38 653127.3585 51900.0 0.28 0.4625 0.9877 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C17 compound treatment 760594.4444 131000.0 0.6 650095.2381 48900.0 0.26 0.6088 0.9291 3558911 ACon1_002286 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5[C@H](O)C[C@]43C)[C@@H]2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C18 compound treatment 687807.8818 57700.0 0.27 636020.0 34800.0 0.18 0.3186 0.984 3559669 ACon1_002287 COC(=O)C1(C)CCCC(=C)C1CC/C(=C/CCC2=CC(=O)OC2)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C19 compound treatment 746336.0996 116000.0 0.54 690187.7729 88900.0 0.47 0.7126 0.998 3555826 ACon1_002288 OC(=O)C1OC(=O)C(CCCCCCCCC=C)C1(O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C20 compound treatment 583413.2653 -46700.0 -0.22 508452.8302 -92800.0 -0.49 -0.5002 -0.9312 3616511 ACon1_002289 COc1ccc(/C=C/C(=O)O[C@H]2[C@H](C)O[C@@H](O[C@@H]3C=C(CO)[C@@H]4[C@H]3C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@@H]2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C21 compound treatment 565222.5914 -64900.0 -0.3 584924.2424 -16300.0 -0.09 -0.2727 -0.8758 3616514 ACon1_002290 O[C@H]1[C@@H](C[C@@](O)(C[C@H]1OC(=O)/C=C/c2ccc(O)c(O)c2)C(=O)O)OC(=O)/C=C/c3ccc(O)c(O)c3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C22 compound treatment 807700.4831 178000.0 0.82 595084.0336 -6160.0 -0.03 0.5561 0.6784 3616517 ACon1_002291 COC(=O)CC1(C/C=C(\C)/CCC=C(C)C)CC(=O)CCC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C23 compound treatment 583496.0 -46600.0 -0.21 557698.1982 -43500.0 -0.23 -0.3153 -0.9994 3555607 ACon1_002292 O[C@@H]1Cc2c(O)cc3O[C@]4(Oc5cc(O)cc(O)c5[C@H]([C@H]4O)c3c2O[C@@H]1c6ccc(O)cc6)c7ccc(O)cc7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 C24 compound treatment 595148.4716 -34900.0 -0.16 607252.3364 6010.0 0.03 -0.0914 -0.5564 3069520 ACon1_002293 COc1ccc2CC3N(CCc4cc(OC)c(O)cc34)Cc2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D01 compound treatment 595626.7281 -34500.0 -0.16 734529.6804 133000.0 0.71 0.3875 0.5348 3616522 ACon1_002294 C[C@H]1O[C@@H](O[C@H]2CC[C@@]3(C)C(CC[C@]4(C)C3C=C[C@@]56OC[C@@]7(CCC(C)(C)C[C@H]76)[C@@H](O)C[C@]54C)[C@]2(C)CO)[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O[C@@H]9O[C@H](CO)[C@@H](O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)[C@H](O)[C@H]9O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D02 mock treatment 743306.9767 113000.0 0.52 627086.2944 25800.0 0.14 0.4661 0.8635 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D03 compound treatment 838912.4424 209000.0 0.96 733127.49 132000.0 0.7 1.1756 0.9877 3616525 ACon1_002295 OC[C@H]1O[C@@H](Oc2ccc3[C@@H]4Oc5cc6OCOc6cc5[C@@H]4COc3c2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D04 mock treatment 691827.907 61700.0 0.28 596355.7692 -4890.0 -0.03 0.183 0.6401 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D05 compound treatment 806359.0909 176000.0 0.81 669821.1382 68600.0 0.36 0.832 0.9343 3616527 ACon1_002296 COC(=O)C1=C[C@@H](C[C@H]2[C@]3(C)C[C@H](OC(=O)[C@H]3CC[C@]21C)c4ccoc4)O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D06 mock treatment 714081.7308 84000.0 0.39 749126.2136 148000.0 0.78 0.8285 0.9471 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D07 compound treatment 771082.2511 141000.0 0.65 768703.7037 167000.0 0.89 1.0878 0.9882 3616529 ACon1_002297 CC1OC(OC2C(O)COC(OC3C(O)C(C)OC(OC4C(OC(=O)C56CCC(C)(C)CC6C7=CCC8C9(C)CC(O)C(OC%10OC(C)C(O)C(OC%11OCC(O)C(OC%12OCC(OC%13OCC(O)(CO)C%13O)C(O)C%12O)C%11O)C%10O)C(C)(CO)C9CCC8(C)C7(C)CC5O)OC(C)C(O)C4OC%14OCC(O)C(O)C%14O)C3O)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D08 mock treatment 766780.7487 137000.0 0.63 709130.2326 108000.0 0.57 0.8504 0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D09 compound treatment 676447.2574 46400.0 0.21 700489.9598 99200.0 0.53 0.5234 0.9212 3616530 ACon1_002298 CC(C)(O)CCc1cc2[C@@H]3COc4cc(O)ccc4[C@@H]3Oc2cc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D10 mock treatment 726842.5532 96700.0 0.45 596511.9617 -4730.0 -0.03 0.2978 0.6663 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D11 mock treatment 690098.5915 60000.0 0.28 601354.9784 114.0 0.0 0.1961 0.7086 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D12 mock treatment 582376.6816 -47700.0 -0.22 625687.7828 24400.0 0.13 -0.0639 -0.2502 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D13 compound treatment 671160.6426 41100.0 0.19 553205.1282 -48000.0 -0.25 -0.0462 -0.1457 3616533 ACon1_002299 CC1(CO)C(OC2OCC(O)C(O)C2OC3OC(CO)C(O)C(O)C3O)C(O)CC4(C)C1CCC5(C)C4CC=C6C7CC(=C)CCC7(CCC65C)C(=O)OC8OC(CO)C(O)C(O)C8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D14 mock treatment 655588.5167 25500.0 0.12 592693.5484 -8550.0 -0.05 0.0511 0.4053 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D15 mock treatment 633098.7124 3000.0 0.01 620073.2759 18800.0 0.1 0.0804 0.7976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D16 mock treatment 647412.6984 17300.0 0.08 565563.0631 -35700.0 -0.19 -0.0773 -0.3765 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D17 compound treatment 757604.9383 128000.0 0.59 664361.5023 63100.0 0.33 0.6525 0.9643 3559611 ACon1_002300 C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2O[C@H]3[C@H](O)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O[C@H]5CC[C@@]6(C)C(CC[C@]7(C)C6CC[C@@]89OC[C@@]%10(CCC(C)(C)CC%109)[C@H](O)C[C@]87C)C5(C)C)O[C@@H]3C(=O)O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D18 mock treatment 673622.7273 43500.0 0.2 602893.8776 1650.0 0.01 0.1481 0.7373 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D19 compound treatment 567418.4397 -62700.0 -0.29 621326.087 20100.0 0.11 -0.1291 -0.4189 3559413 ACon1_002301 COC(=O)[C@H]1CC[C@H](OC(=O)C)[C@]2(C)CC[C@@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D20 mock treatment 729187.8173 99100.0 0.46 646806.0837 45600.0 0.24 0.494 0.9556 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D21 compound treatment 510389.0909 -120000.0 -0.55 619988.806 18700.0 0.1 -0.32 -0.5706 3559708 ACon1_002302 CC(OC(=O)/C=C(/C)\COC(=O)C)c1ccc(O)c(c1)C(=O)C=C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D22 mock treatment 633613.5266 3520.0 0.02 680017.2414 78800.0 0.42 0.3069 0.734 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D23 compound treatment 503349.2823 -127000.0 -0.58 448530.9278 -153000.0 -0.81 -0.986 -0.9872 3558805 ACon1_002303 CC1[C@@H]2CCC3(C)OC43C(O)C=C(C)C4[C@H]2OC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 D24 mock treatment 564795.8333 -65300.0 -0.3 538665.2174 -62600.0 -0.33 -0.4476 -0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E01 mock treatment 612366.1202 -17700.0 -0.08 709965.6863 109000.0 0.58 0.35 0.6009 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E02 mock treatment 665453.6082 35400.0 0.16 641432.8358 40200.0 0.21 0.266 0.9912 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E03 compound treatment 504288.7324 -126000.0 -0.58 496485.7143 -105000.0 -0.56 -0.8031 -0.9998 3616539 ACon1_002304 COc1cccc2C(=O)c3c(C(=O)c12)c(O)cc4CC(C)(O)CC(=O)c43 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E04 compound treatment 815375.6098 185000.0 0.85 707306.2201 106000.0 0.56 1.002 0.9794 3616542 ACon1_002305 CC(O)/C=C/C1(O)C(C)CC(O)CC1(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E05 compound treatment 729470.852 99400.0 0.46 623293.3333 22100.0 0.12 0.4068 0.86 1054502 ACon1_002306 COc1cc2n(C)c3ccccc3c(=O)c2c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E06 compound treatment 630618.2573 524.0 0.0 550911.0169 -50300.0 -0.27 -0.1871 -0.7007 3616546 ACon1_002307 CC1OC(OCC2(C)CCC3(CCC4(C)C(CCC5C6(C)CCC(O)C(C)(COC7OC(CO)C(O)C(O)C7O)C6CCC54C)C3=C2)C(=O)O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E07 compound treatment 826624.4541 197000.0 0.91 683835.6808 82600.0 0.44 0.9506 0.9444 3616548 ACon1_002308 CC(O)CC1CCC(O)C(C)C(=O)OC(CC(C)O)CCC(O)C(C)C(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E08 compound treatment 730156.25 100000.0 0.46 489469.3878 -112000.0 -0.59 -0.0929 -0.1237 3559871 ACon1_002309 C/C=C\1/CN2C3Cc4c([nH]c5ccc(O)cc45)C2(O)CC1C3CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E09 mock treatment 711259.2593 81200.0 0.37 701469.1358 100000.0 0.53 0.6406 0.9853 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E10 mock treatment 761879.4643 132000.0 0.61 632790.3226 31500.0 0.17 0.5481 0.8694 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E11 compound treatment 1091259.843 461000.0 2.13 1008427.35 407000.0 2.16 3.031 1.0 3559551 ACon1_002310 C[C@H]1C[C@H]2OC(=O)C(=C2CC/C(=C/CC1=O)/C)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E12 compound treatment 719407.4074 89300.0 0.41 631829.1815 30600.0 0.16 0.406 0.9171 3616552 ACon1_002311 CC1CCC2C(=CC3(O)CC(C)(C)CC123)C(=O)OC4OC(C)C(O)C(O)C4O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E13 compound treatment 683964.2857 53900.0 0.25 604927.9661 3690.0 0.02 0.1895 0.7604 3420076 ACon1_002312 CC1CC(C)C(=O)C(C1)C(O)CC2CC(=O)NC(=O)C2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E14 compound treatment 634732.4561 4640.0 0.02 567460.8696 -33800.0 -0.18 -0.1116 -0.6183 3559755 ACon1_002313 CC1(CCCC(C)(C)C2C3CCC21)C3CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E15 compound treatment 701843.75 71700.0 0.33 582297.7099 -18900.0 -0.1 0.1629 0.4711 3554678 ACon1_002314 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\C)/[C@@H]1CC(=O)OC[C@H]3O[C@@H](OCCc4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]3OC(=O)C[C@H]5\C(=C\C)\[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)OC=C5C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E16 compound treatment 604758.6207 -25300.0 -0.12 571677.7251 -29600.0 -0.16 -0.1935 -0.9895 3559326 ACon1_002315 CC(=CCC/C(=C/CC(O)/C(=C/Cc1cc(ccc1O)C(=O)O)/C)/C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E17 mock treatment 728349.5146 98300.0 0.45 637935.4839 36700.0 0.19 0.458 0.9288 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E18 mock treatment 730671.6418 101000.0 0.46 591690.3553 -9550.0 -0.05 0.2922 0.6262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E19 compound treatment 655256.3025 25200.0 0.12 589906.8966 -11300.0 -0.06 0.0395 0.3026 3553717 ACon1_002316 CC(CCCCC(O)C(CO)C(=O)OC(CCCCC(C)C/C(=C/C(=C/C(=O)O)/C)/C)C(CO)C(=O)O)C/C(=C/C(=C/C(=O)O)/C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E20 compound treatment 686728.0 56600.0 0.26 760200.0 159000.0 0.84 0.7808 0.8847 3616556 ACon1_002317 O=C(NCCCCNCCCNC(=O)/C=C/c1ccccc1)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E21 compound treatment 653103.4483 23000.0 0.11 592920.7048 -8320.0 -0.04 0.0438 0.3813 3554770 ACon1_002318 COc1c(O)cc2C(Oc3cc4C(O)C(C)OC(=O)c4c(O)c3OC)C(C)OC(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E22 compound treatment 692797.9275 62700.0 0.29 613004.3478 11800.0 0.06 0.2486 0.8403 3616560 ACon1_002319 O[C@@H]1[C@@H](COC(=O)/C=C/C2(O)C=CC(=O)C=C2)O[C@@H](Oc3ccc(O)cc3)[C@H](O)[C@H]1OC(=O)/C=C/C4(O)C=CC(=O)C=C4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E23 compound treatment 585658.5366 -44400.0 -0.2 616131.068 14900.0 0.08 -0.0891 -0.4055 1088382 ACon1_002320 CCC(C)C1NC(=O)C2CCCN2C(=O)C(CC(C)C)OC(=O)CCNC(=O)C(C)N(C)C(=O)C(C(C)C)N(C)C1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 E24 compound treatment 554911.7647 -75200.0 -0.35 464684.5638 -137000.0 -0.72 -0.7573 -0.9431 3616565 ACon1_002321 OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)cc5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F01 mock treatment 696678.0488 66600.0 0.31 656668.2927 55400.0 0.29 0.425 0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F02 mock treatment 691300.0 61200.0 0.28 684349.345 83100.0 0.44 0.5113 0.9768 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F03 compound treatment 861446.6019 231000.0 1.07 678175.1152 76900.0 0.41 1.043 0.913 3212153 ACon1_002322 OC[C@H]1O[C@@H](OCc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F04 mock treatment 770732.3232 141000.0 0.65 624300.0 23100.0 0.12 0.5451 0.8259 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F05 compound treatment 760451.8828 130000.0 0.6 693791.1647 92500.0 0.49 0.7722 0.9949 3616570 ACon1_002323 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]3[C@@H]4CN5CCc6c([nH]c7ccccc67)[C@]5(C[C@@H]31)O4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F06 mock treatment 841980.6763 212000.0 0.98 686189.3004 84900.0 0.45 1.0095 0.9382 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F07 compound treatment 717453.6585 87400.0 0.4 593024.0385 -8220.0 -0.04 0.2541 0.6269 3616572 ACon1_002324 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](COC3OCC(O)C(O)C3O)O[C@@H](Oc4cc(O)c5C(=O)CC(Oc5c4)c6ccc(O)cc6)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F08 mock treatment 744399.177 114000.0 0.53 646979.0795 45700.0 0.24 0.5443 0.938 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F09 mock treatment 768191.3043 138000.0 0.64 682050.8475 80800.0 0.43 0.7534 0.9814 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F10 mock treatment 739590.9091 109000.0 0.5 653411.2903 52200.0 0.28 0.5527 0.9599 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F11 compound treatment 713719.8276 83600.0 0.39 540559.0551 -60700.0 -0.32 0.0451 0.0898 3616576 ACon1_002325 CC(=CCc1cc2C(=O)C(O)C(Oc2c3C(O)C(O)C(C)(C)Oc13)c4ccc(O)cc4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F12 mock treatment 676941.7476 46800.0 0.22 666441.4414 65200.0 0.35 0.3973 0.9743 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F13 compound treatment 705808.6957 75700.0 0.35 599739.8374 -1500.0 -0.01 0.2413 0.6908 3616580 ACon1_002326 COc1cc(CC2COC(C2COC3OC(CO)C(O)C(O)C3O)c4ccc(O)c(OC)c4)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F14 mock treatment 581103.5857 -49000.0 -0.23 592982.3009 -8260.0 -0.04 -0.1907 -0.8288 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F15 compound treatment 649451.1278 19400.0 0.09 569991.8367 -31200.0 -0.17 -0.0541 -0.2873 2090754 ACon1_002327 COc1ccc(cc1O)C2CC(=O)c3c(O)cc(O)cc3O2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F16 mock treatment 614918.1818 -15200.0 -0.07 642963.4146 41700.0 0.22 0.107 0.461 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F17 mock treatment 668185.654 38100.0 0.18 551783.3333 -49500.0 -0.26 -0.0613 -0.1941 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F18 mock treatment 626319.5489 -3770.0 -0.02 572454.1985 -28800.0 -0.15 -0.1203 -0.7827 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F19 compound treatment 631923.3716 1830.0 0.01 542226.4957 -59000.0 -0.31 -0.2154 -0.6878 3559435 ACon1_002328 COc1c2occc2c(OCC(OC(=O)/C(=C\C)/C)C(C)(C)O)c3ccc(=O)oc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F20 mock treatment 583406.7797 -46700.0 -0.22 679419.5122 78200.0 0.41 0.141 0.3017 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F21 compound treatment 527944.664 -102000.0 -0.47 526956.0811 -74300.0 -0.39 -0.6117 -0.9961 3558554 ACon1_002329 CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O[C@H]7OC[C@](O)(CO)[C@H]7O)[C@H](O)[C@H]6O)C(=O)O)C(C)(C)C5CC[C@]43C)C2C1)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F22 mock treatment 568269.0763 -61800.0 -0.29 604120.6226 2880.0 0.02 -0.1908 -0.6683 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F23 compound treatment 533601.5038 -96500.0 -0.44 617355.3114 16100.0 0.09 -0.2542 -0.561 3616583 ACon1_002330 OC(=O)c1cc(O)c(O)c(O)c1Oc2cc3C(=O)OC[C@H]4O[C@@H](OC(=O)c5cc(O)c(O)c(O)c5)[C@H](OC(=O)c6cc(O)c(O)c(O)c6)[C@@H](OC(=O)c7cc(O)c(O)c(O)c7)[C@@H]4OC(=O)c8cc(O)c(O)c(O)c8-c3c(O)c2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 F24 mock treatment 549325.1232 -80800.0 -0.37 548746.888 -52500.0 -0.28 -0.4603 -0.9897 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G01 compound treatment 644600.9852 14500.0 0.07 549618.5567 -51600.0 -0.27 -0.1463 -0.5191 3557489 ACon1_002331 CC12CC3(CC2C1CC34)CC(O)C5C(C)(CO)CCCC45C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G02 compound treatment 612403.7559 -17700.0 -0.08 667004.0486 65800.0 0.35 0.189 0.5275 3557405 ACon1_002332 CCCC(O)C(O)C1CC(=CC(=O)O1)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G03 mock treatment 615129.7297 -15000.0 -0.07 569979.8387 -31300.0 -0.17 -0.166 -0.9245 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G04 mock treatment 631288.4615 1190.0 0.01 556294.3925 -44900.0 -0.24 -0.1647 -0.6906 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G05 compound treatment 609469.9454 -20600.0 -0.1 575785.3403 -25500.0 -0.14 -0.1627 -0.9853 3554767 ACon1_002333 COc1c(O)c2c(CCC3C(C)(C)CCC[C@@]32C(=O)O)cc1C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G06 compound treatment 665671.6418 35600.0 0.16 559795.5556 -41400.0 -0.22 -0.0394 -0.1437 3616588 ACon1_002334 COC(=O)c1cc(C)cc(O)c1C(=O)c2c(O)cccc2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G07 compound treatment 598904.5643 -31200.0 -0.14 548798.4496 -52400.0 -0.28 -0.2984 -0.9529 1034509 ACon1_002335 Cc1cc(=O)c2COc3cc(O)c(O)c(C(=O)O)c3-c2o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G08 compound treatment 633421.2766 3330.0 0.02 477748.9712 -123000.0 -0.66 -0.4523 -0.6904 3552648 ACon1_002336 C[C@@H]1C[C@H](O)/C=C/[C@H](O)[C@@H](O)CC(=O)O1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G09 compound treatment 618130.4348 -12000.0 -0.06 595700.0 -5540.0 -0.03 -0.0598 -0.9565 3557256 ACon1_002337 CC(=O)c1c(O)cc(O)cc1CC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G10 compound treatment 476575.7576 -154000.0 -0.71 381730.0 -220000.0 -1.16 -1.3239 -0.9716 3555790 ACon1_002338 O=C1NC(Cc2c[nH]c3ccccc23)C(=O)N4CCCC41 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G11 compound treatment 532395.6044 -97700.0 -0.45 495117.3184 -106000.0 -0.56 -0.7166 -0.9939 3616592 ACon1_002339 CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(CO)CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G12 compound treatment 458188.6792 -172000.0 -0.79 441951.2195 -159000.0 -0.84 -1.158 -0.9995 3616597 ACon1_002340 CCCC1(O)Cc2c(O1)c3c(O)cccc3cc2C(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G13 compound treatment 596921.6418 -33200.0 -0.15 502074.3494 -99200.0 -0.53 -0.4801 -0.8764 3558181 ACon1_002341 COc1cc(ccc1O)C2OCC3C(OC(=O)C23)c4ccc5OCOc5c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G14 compound treatment 521371.134 -109000.0 -0.5 503816.7939 -97400.0 -0.52 -0.7199 -0.9999 1029487 ACon1_002342 OCC(O)Cc1ccc2OCOc2c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G15 compound treatment 498088.2353 -132000.0 -0.61 467611.8143 -134000.0 -0.71 -0.9316 -0.9971 3553721 ACon1_002343 CC(CCCCCC(O)C(CO)C(=O)O)C/C(=C/C(=C/C(=O)O)/C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G16 compound treatment 519050.7614 -111000.0 -0.51 501849.0566 -99400.0 -0.53 -0.7349 -0.9999 3554667 ACon1_002344 COC(=O)C1(CO)C2Cc3c(C4CC1/C(=C\C)/CN42)n(C)c5ccccc35 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G17 compound treatment 571306.1224 -58800.0 -0.27 449388.0597 -152000.0 -0.81 -0.7612 -0.8957 3558054 ACon1_002345 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C(=C\CO)/[C@@H]1CC(=O)OCCc3ccc(O)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G18 compound treatment 561708.3333 -68400.0 -0.32 507156.6265 -94100.0 -0.5 -0.5759 -0.9755 3553083 ACon1_002346 C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5CC(CC[C@]5(C)[C@H]4CC[C@]23C)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@@H]6O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O)[C@H]8O)N9C[C@@H](C)CC[C@H]19 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G19 mock treatment 536577.9817 -93500.0 -0.43 527124.5136 -74100.0 -0.39 -0.5829 -0.9989 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G20 mock treatment 568188.4058 -61900.0 -0.29 486689.5161 -115000.0 -0.61 -0.6315 -0.9407 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G21 compound treatment 513927.6596 -116000.0 -0.54 591107.8431 -10100.0 -0.05 -0.4168 -0.7742 3557521 ACon1_002347 COc1cc(/C=C/C(=O)OC2C(O)C(O)C(OC3(CO)OC(CO)C(O)C3O)OC2COC(=O)c4cc(OC)c(OC)c(OC)c4)cc(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G22 compound treatment 496651.1628 -133000.0 -0.62 557687.5 -43600.0 -0.23 -0.5985 -0.9105 3557725 ACon1_002348 OC[C@H]1OC(Oc2cc(O)c3c(=O)c(O)c(oc3c2)c4ccc(O)cc4)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G23 compound treatment 542472.3404 -87600.0 -0.4 503905.2133 -97300.0 -0.52 -0.6508 -0.9927 3558206 ACon1_002349 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](O)[C@H]1OC(=O)/C=C/c6ccc(O)cc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 G24 compound treatment 461285.1563 -169000.0 -0.78 447038.1356 -154000.0 -0.82 -1.1288 -0.9997 1011276 ACon1_002350 COc1ccc2CC3N(C)CCc4cc5OCOc5c(c34)-c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H01 compound treatment 708583.7321 78500.0 0.36 652567.3077 51300.0 0.27 0.4484 0.9901 3616603 ACon1_002351 O[C@H]1[C@H](O)[C@@H](COC(=O)CC(=O)O)O[C@@H](Oc2ccc3[C@@H]4Oc5cc6OCOc6cc5[C@@H]4COc3c2)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H02 mock treatment 640217.1717 10100.0 0.05 618955.665 17700.0 0.09 0.0994 0.9479 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H03 mock treatment 708495.0495 78400.0 0.36 645880.9524 44600.0 0.24 0.4231 0.9789 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H04 mock treatment 597058.5774 -33000.0 -0.15 615925.7426 14700.0 0.08 -0.0527 -0.3077 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H05 compound treatment 696996.0 66900.0 0.31 672906.7797 71700.0 0.38 0.4869 0.9946 3616608 ACon1_002352 COC(=O)C1=CC(=C[C@H]2[C@]3(C)C[C@H](OC(=O)[C@H]3CC[C@]21C)c4ccoc4)O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H06 mock treatment 601800.0 -28300.0 -0.13 577556.6502 -23700.0 -0.13 -0.1811 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H07 compound treatment 622906.7797 -7190.0 -0.03 638133.6406 36900.0 0.2 0.1149 0.5791 3616611 ACon1_002353 CC(C)(CCO[C@@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C[C@@H]3C(=CC[C@]4(C(=O)O)C3=CCC5[C@@]6(C)CC[C@H](O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)C(C)(C)C6CC[C@]54C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H08 mock treatment 632557.7889 2460.0 0.01 574327.3543 -26900.0 -0.14 -0.0929 -0.6488 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H09 compound treatment 611000.0 -19100.0 -0.09 601461.5385 220.0 0.0 -0.0614 -0.6977 3616613 ACon1_002354 Oc1ccccc1Cc2c(O)cc(O)c3C(=O)C[C@@H](Oc23)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H10 mock treatment 656423.5808 26300.0 0.12 544488.6364 -56800.0 -0.3 -0.127 -0.3913 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H11 compound treatment 496858.1081 -133000.0 -0.61 576600.7067 -24600.0 -0.13 -0.5269 -0.8387 3558021 ACon1_002355 OCC1OC(C(O)C(O)C1O)c2c(O)cc(O)c3c(=O)cc(oc23)c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H12 mock treatment 595314.6067 -34800.0 -0.16 536852.459 -64400.0 -0.34 -0.3549 -0.9406 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H13 compound treatment 557457.2491 -72600.0 -0.33 479740.0 -122000.0 -0.64 -0.6926 -0.9535 3616618 ACon1_002356 CC(O)CCCc1cc(O)cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H14 mock treatment 506621.3992 -123000.0 -0.57 532564.1026 -68700.0 -0.36 -0.6602 -0.9767 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H15 compound treatment 489665.3846 -140000.0 -0.65 512037.1747 -89200.0 -0.47 -0.7925 -0.9881 3616621 ACon1_002357 CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)C5CC[C@]43C)C2[C@@H]1O)C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H16 mock treatment 475819.5122 -154000.0 -0.71 457936.1702 -143000.0 -0.76 -1.0405 -0.9995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H17 compound treatment 528636.7188 -101000.0 -0.47 603766.5505 2530.0 0.01 -0.3214 -0.6866 3559631 ACon1_002358 COc1ccc(OC)c(/C=C/C(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H18 mock treatment 468510.3448 -162000.0 -0.75 475218.8679 -126000.0 -0.67 -0.9996 -0.9985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H19 mock treatment 488667.9842 -141000.0 -0.65 509411.3208 -91800.0 -0.49 -0.8056 -0.9897 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H20 mock treatment 448345.1957 -182000.0 -0.84 467555.9441 -134000.0 -0.71 -1.0941 -0.9965 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H21 compound treatment 468145.9854 -162000.0 -0.75 383239.2857 -218000.0 -1.16 -1.3457 -0.9776 3559126 ACon1_002359 CO[C@]1(OC[C@@H]2[C@H](OC[C@@]21O)c3ccc4OCOc4c3)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H22 mock treatment 478186.8132 -152000.0 -0.7 515607.2874 -85600.0 -0.45 -0.8165 -0.978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H23 compound treatment 478251.2821 -152000.0 -0.7 481135.6784 -120000.0 -0.64 -0.9456 -0.9989 3558476 ACon1_002360 COc1cc(C[C@@H]2CO[C@H]([C@@H]2CO)c3ccc(O)c(OC)c3)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 H24 mock treatment 483058.5774 -147000.0 -0.68 493635.6275 -108000.0 -0.57 -0.883 -0.9963 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I01 compound treatment 671009.009 40900.0 0.19 533785.0877 -67500.0 -0.36 -0.1196 -0.2956 1086162 ACon1_002361 COc1c2ccoc2c(OC)c3oc(=O)ccc13 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I02 compound treatment 619393.9394 -10700.0 -0.05 691639.1304 90400.0 0.48 0.3041 0.631 3557472 ACon1_002362 COC1=CC(=O)CC(C)C21Oc3cc(OC)cc(O)c3C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I03 compound treatment 622011.236 -8080.0 -0.04 563145.3744 -38100.0 -0.2 -0.1692 -0.8237 3553181 ACon1_002363 CC(=C1CC[C@@]2(CO[C@@H]3C2)C1CC[C@]3(O)C(=O)O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I04 compound treatment 555216.6667 -74900.0 -0.35 549381.1881 -51900.0 -0.28 -0.4387 -0.9937 3616624 ACon1_002364 COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(NC(=O)C(C)NC(=O)/C=C/C(=O)O)C(C)c3c[nH]c4ccccc34 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I05 mock treatment 824120.7729 194000.0 0.89 710774.7748 110000.0 0.58 1.0435 0.9781 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I06 mock treatment 740171.7172 110000.0 0.51 644133.6406 42900.0 0.23 0.5198 0.9345 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I07 compound treatment 715371.7949 85300.0 0.39 623766.7984 22500.0 0.12 0.3626 0.8821 3616627 ACon1_002365 C[C@H]1[C@H](O)CCC2=C[C@@H](O)[C@@]3(O[C@@H]3[C@]12C)C(=C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I08 compound treatment 646368.1592 16300.0 0.08 629105.0228 27900.0 0.15 0.1576 0.9506 3557433 ACon1_002366 C[C@]1([C@H](O)CC(=O)c2coc3C(=O)c4c5CCC(=O)c5ccc41)c23 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I09 compound treatment 683082.3045 53000.0 0.24 634961.8644 33700.0 0.18 0.2993 0.9882 3554518 ACon1_002367 CO[C@H]1C(=O)Nc2ccc(CC=C(C)C)c(O)c2[C@]1(O)c3ccc(OC)cc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I10 compound treatment 661503.876 31400.0 0.14 491121.2121 -110000.0 -0.58 -0.3106 -0.5161 3616630 ACon1_002368 COc1cc2oc(C)cc(=O)c2c(O)c1CSCC(O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I11 compound treatment 516737.7622 -113000.0 -0.52 485691.7808 -116000.0 -0.61 -0.803 -0.9969 3558142 ACon1_002369 OC[C@H]1O[C@@H](O[C@H]2C[C@@H]3[C@@H]([C@H]4OC(=O)C(=C)[C@@H]4[C@H](O)CC3=C)C2=C)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I12 compound treatment 484952.1277 -145000.0 -0.67 462026.7857 -139000.0 -0.74 -0.9954 -0.9988 3616631 ACon1_002370 C/C=C/CCCCC(=O)C(C)C(=O)N1CCC=C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I13 compound treatment 734309.7015 104000.0 0.48 571697.9866 -29500.0 -0.16 0.229 0.4531 3554843 ACon1_002371 COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)Oc3cc(C)c(C(=O)NC(C)C(=O)O)c(O)c3)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4OC(=O)C)c2)c(OC)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I14 compound treatment 541534.5455 -88600.0 -0.41 611655.1724 10400.0 0.06 -0.2497 -0.606 1403 ACon1_002372 COC(=O)C1=CCCN(C)C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I15 compound treatment 587313.6531 -42800.0 -0.2 511528.0528 -89700.0 -0.48 -0.476 -0.924 3552057 ACon1_002373 C/C=C/C(O)C(C)CC(C)C(OC(=O)CCC(=O)O)C(C)/C=C/C=C/C=C(\C)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I16 compound treatment 634397.2603 4300.0 0.02 636620.8333 35400.0 0.19 0.1467 0.7775 3554656 ACon1_002374 COC(=O)C[C@H]1[C@@]2(C)[C@H](O[C@@H]3C[C@H](C(=C32)C)c4ccoc4)[C@H](OC(=O)C)C5[C@@](C)(C=CC(=O)[C@]15C)C(=O)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I17 compound treatment 642666.6667 12600.0 0.06 569541.5162 -31700.0 -0.17 -0.0779 -0.438 3551981 ACon1_002375 C/C(=C\CCC1(C)C2CCC(C2)C1(C)O)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I18 compound treatment 394811.9658 -235000.0 -1.09 407697.8022 -194000.0 -1.03 -1.4931 -0.9996 3616633 ACon1_002376 COc1cc(cc2OCOc21)C3OCC4C(OCC34)c5ccc(OC)c(OC)c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I19 compound treatment 570849.8168 -59200.0 -0.27 580689.1386 -20600.0 -0.11 -0.2703 -0.9188 3559399 ACon1_002377 OC[C@H]1O[C@@H](O[C@H](C#N)c2ccccc2)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I20 compound treatment 494082.4373 -136000.0 -0.63 619782.6087 18500.0 0.1 -0.374 -0.589 3616634 ACon1_002378 CC(CC(C)OC(=O)/C=C/c1ccc(O)cc1)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I21 mock treatment 546927.4809 -83200.0 -0.38 559032.7869 -42200.0 -0.22 -0.4295 -0.9671 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I22 mock treatment 635113.0435 5020.0 0.02 571771.8447 -29500.0 -0.16 -0.0942 -0.5959 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I23 compound treatment 681032.7103 50900.0 0.23 573230.4527 -28000.0 -0.15 0.0611 0.2196 3559277 ACon1_002379 CC(=O)C12CC(CCC2(C)CCC1O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 I24 compound treatment 618442.9224 -11700.0 -0.05 621363.2479 20100.0 0.11 0.0375 0.3136 3616636 ACon1_002380 OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](OC(=O)/C=C/C3(O)C=CC(=O)C=C3)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J01 compound treatment 861848.2143 232000.0 1.07 861567.9012 260000.0 1.38 1.7321 0.992 3616638 ACon1_002381 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCC3(C)Oc4cc5occ(c6ccc(O)cc6)c(=O)c5c(O)c4C=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J02 mock treatment 743782.6087 114000.0 0.52 731414.8472 130000.0 0.69 0.8589 0.9908 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J03 compound treatment 752658.9862 123000.0 0.57 624724.2798 23500.0 0.12 0.4877 0.8427 3616640 ACon1_002382 CC(=CCc1c(O)c(CC=C(C)C)c2OC(CC(=O)c2c1O)c3ccccc3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J04 mock treatment 834331.8182 204000.0 0.94 609185.3659 7940.0 0.04 0.6958 0.738 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J05 mock treatment 709539.823 79400.0 0.37 684285.0877 83000.0 0.44 0.5705 0.9958 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J06 mock treatment 636005.0761 5910.0 0.03 590092.1053 -11100.0 -0.06 -0.0225 -0.3462 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J07 compound treatment 672071.066 42000.0 0.19 496502.4631 -105000.0 -0.56 -0.2559 -0.4351 3616641 ACon1_002383 CC1(CO)C(CCC2(C)C1CCC3(C)C2CC=C4C5CC(=C)CCC5(CCC43C)C(=O)OC6OC(CO)C(O)C(O)C6OC7OCC(O)C(O)C7O)OC8OC(CO)C(O)C(O)C8O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J08 mock treatment 589239.6313 -40900.0 -0.19 683802.6316 82600.0 0.44 0.1764 0.3701 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J09 compound treatment 667430.1887 37300.0 0.17 711153.2847 110000.0 0.58 0.534 0.8784 3616643 ACon1_002384 COc1cc(cc2CC(Oc21)C(=C)C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J10 mock treatment 564848.8372 -65200.0 -0.3 653435.7977 52200.0 0.28 -0.017 -0.0416 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J11 compound treatment 557274.4361 -72800.0 -0.34 515752.1008 -85500.0 -0.45 -0.5581 -0.9891 3616644 ACon1_002385 CC(=CCc1cc2[C@@H]3COc4c(O)c(O)ccc4[C@@H]3Oc2cc1O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J12 mock treatment 619985.8491 -10100.0 -0.05 659193.2773 58000.0 0.31 0.1844 0.5931 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J13 compound treatment 648162.6016 18100.0 0.08 629575.7576 28300.0 0.15 0.1652 0.9613 3616646 ACon1_002386 O[C@@H]1[C@@H](O)[C@H](Oc2ccc(cc2)c3coc4cc(O)ccc4c3=O)O[C@@H]([C@H]1O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J14 mock treatment 509134.1991 -121000.0 -0.56 495750.0 -105000.0 -0.56 -0.7901 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J15 compound treatment 647460.3774 17400.0 0.08 638438.247 37200.0 0.2 0.1961 0.9211 3616648 ACon1_002387 C[C@@H]1O[C@@H](O[C@H]2[C@H](O)CO[C@@H](O[C@H]3[C@H](C)O[C@@H](O[C@@H]4[C@@H](O)[C@H](CO)O[C@H]4OC(=O)[C@@]56CCC(C)(C)C[C@H]6C7=CCC8[C@@]9(C)C[C@H](O)[C@H](O[C@@H]%10O[C@@H]([C@@H](O)[C@H](O)[C@H]%10O)C(=O)O)[C@@](C)(CO)C9[C@H](O)C[C@@]8(C)[C@]7(C)C[C@H]5O)[C@H](O)[C@@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J16 mock treatment 477629.3706 -152000.0 -0.7 483719.1489 -118000.0 -0.62 -0.9379 -0.9982 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J17 compound treatment 573334.4156 -56800.0 -0.26 491923.3333 -109000.0 -0.58 -0.5951 -0.9354 3557669 ACon1_002388 C[C@H]1[C@H]2[C@H](CC3[C@@H]4CC=C5C[C@H](O)C[C@@H](O)[C@]5(C)C4CC[C@]23C)O[C@]61OCC(=C)[C@H](O)[C@@H]6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J18 mock treatment 504815.331 -125000.0 -0.58 462388.6792 -139000.0 -0.74 -0.9293 -0.9928 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J19 compound treatment 435203.3898 -195000.0 -0.9 440037.1747 -161000.0 -0.86 -1.2401 -0.9997 3559791 ACon1_002389 COc1ccc(cc1)C(=O)O[C@H]2CC(=CC[C@@]3(C)[C@@H](O)C[C@@](O)(C(C)C)[C@H]23)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J20 mock treatment 479558.6207 -151000.0 -0.69 546691.4894 -54500.0 -0.29 -0.6955 -0.9247 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J21 mock treatment 533278.5714 -96800.0 -0.45 498696.7509 -103000.0 -0.54 -0.7003 -0.9952 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J22 mock treatment 523925.9259 -106000.0 -0.49 529732.3944 -71500.0 -0.38 -0.6144 -0.992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J23 mock treatment 580710.7843 -49400.0 -0.23 506431.0345 -94800.0 -0.5 -0.5166 -0.9358 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 J24 mock treatment 506409.2527 -124000.0 -0.57 467954.918 -133000.0 -0.71 -0.9032 -0.9943 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K01 compound treatment 681596.0 51500.0 0.24 698134.1463 96900.0 0.51 0.5313 0.9385 3554199 ACon1_002390 CCc1c(O)cc(O)c2C(=O)C[C@@H](C)Oc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K02 compound treatment 809524.8619 179000.0 0.83 733888.8889 133000.0 0.7 1.0826 0.9967 3559924 ACon1_002391 CC1CCC(=C)/C(=C\C=C/CC1(C)CCC2=CC(=O)OC2O)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K03 compound treatment 670844.7489 40800.0 0.19 647430.622 46200.0 0.24 0.3061 0.9914 3558269 ACon1_002392 C[C@@]1(O)CCC[C@]2(C)CC[C@H](C[C@@H]12)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K04 compound treatment 656980.695 26900.0 0.12 646309.8039 45100.0 0.24 0.2567 0.9533 3559641 ACon1_002393 O/C(=C\C(=O)/C=C/c1ccccc1)/C=C/c2ccccc2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K05 compound treatment 712562.7706 82500.0 0.38 622414.4144 21200.0 0.11 0.3483 0.8784 3554959 ACon1_002394 COc1cc(O)c(C(=O)C)c(CC(=O)O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K06 compound treatment 679025.2525 48900.0 0.23 606886.2559 5640.0 0.03 0.1807 0.794 3616650 ACon1_002395 COc1cc(oc(=O)c1C)/C(=C/C(C)O)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K07 mock treatment 741053.1401 111000.0 0.51 595325.7919 -5920.0 -0.03 0.3396 0.6625 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K08 mock treatment 663966.9811 33900.0 0.16 614407.4074 13200.0 0.07 0.1598 0.9341 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K09 compound treatment 625370.5584 -4720.0 -0.02 613465.6085 12200.0 0.06 0.0304 0.4451 3559867 ACon1_002396 COc1c(O)cc2CCNC3Cc4ccccc4-c1c32 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K10 compound treatment 493809.5238 -136000.0 -0.63 459300.4115 -142000.0 -0.75 -0.9768 -0.996 3616653 ACon1_002397 CC(CCO)/C=C(/C)\C=C\C1=CC2=CC(=O)C(C)(O)C(O)C2=CO1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K11 compound treatment 586558.3039 -43500.0 -0.2 439033.6538 -162000.0 -0.86 -0.7503 -0.8493 3558744 ACon1_002398 COc1cc(/C=C/CO)cc(OC)c1OC\C=C(/C)\CCC=C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K12 compound treatment 630319.5876 225.0 0.0 556237.069 -45000.0 -0.24 -0.1681 -0.704 3616654 ACon1_002399 CC1CCCC[C@@H]2[C@@H](CC(=O)O1)[C@@H](O)C=CC2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K13 compound treatment 667870.8134 37800.0 0.17 507968.8581 -93300.0 -0.49 -0.2266 -0.4321 3557992 ACon1_002400 C[C@@H]1C[C@H](OC(=O)C)[C@H](OC(=O)C)[C@@]2(COC(=O)C)[C@@H](C[C@@H]3[C@@H](OC(=O)C)[C@]12OC3(C)C)OC(=O)c4ccccc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K14 compound treatment 575078.8382 -55000.0 -0.25 509876.9231 -91400.0 -0.48 -0.5221 -0.9544 2732 ACon1_002401 Cc1cc(=O)oc2cc(O)ccc12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K15 mock treatment 658921.3974 28800.0 0.13 580124.4635 -21100.0 -0.11 0.0148 0.0852 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K16 mock treatment 555085.3659 -75000.0 -0.35 544739.4636 -56500.0 -0.3 -0.4565 -0.9974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K17 compound treatment 554939.1635 -75200.0 -0.35 550870.8487 -50400.0 -0.27 -0.434 -0.9917 3554976 ACon1_002402 COc1cc(O)c(Oc2cc(C)cc(O)c2C(=O)O)c(CO)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K18 compound treatment 521343.1734 -109000.0 -0.5 584677.2908 -16600.0 -0.09 -0.4168 -0.8185 3616656 ACon1_002403 COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@@H](C[C@]3(C)OC(=O)C)OC(=O)/C=C/c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K19 compound treatment 554415.0943 -75700.0 -0.35 454680.1242 -147000.0 -0.78 -0.7965 -0.9347 3559928 ACon1_002404 COC1OC(=O)C(=C1)CCC2(C)C/C=C\C=C(\C(=O)O)/C(=C)CCC2C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K20 compound treatment 370918.9189 -259000.0 -1.2 137840.0 -463000.0 -2.46 -2.5831 -0.9451 3558737 ACon1_002405 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4C(=O)CC(Oc4c3)c5ccc(O)cc5)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K21 compound treatment 541066.6667 -89000.0 -0.41 466079.3103 -135000.0 -0.72 -0.7972 -0.965 3557421 ACon1_002406 Cc1cc(O)cc(Oc2cc(C)cc(O)c2O)c1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K22 compound treatment 617283.5249 -12800.0 -0.06 489190.1408 -112000.0 -0.59 -0.462 -0.7736 3616657 ACon1_002407 CC1CCC2(CCC3(C(=O)O)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C)C(=O)OC6OC(CO)C(O)C(O)C6O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K23 mock treatment 574900.4739 -55200.0 -0.25 572123.2227 -29100.0 -0.15 -0.2892 -0.9713 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 K24 mock treatment 530947.1366 -99100.0 -0.46 472778.7234 -128000.0 -0.68 -0.8051 -0.9812 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L01 compound treatment 777530.8642 147000.0 0.68 660247.7876 59000.0 0.31 0.7021 0.938 3616659 ACon1_002408 C/C(=C\CCC(=C)C1(O)CCC(=CC1)C)/C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L02 mock treatment 712900.0 82800.0 0.38 680953.7815 79700.0 0.42 0.569 0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L03 compound treatment 625684.7291 -4410.0 -0.02 636104.4177 34900.0 0.18 0.1164 0.6256 3616661 ACon1_002409 OC(=O)C(Cc1ccc(O)c(O)c1)OC(=O)/C=C/c2ccc3O[C@@H]([C@@H](Oc3c2)C(=O)O)c4ccc(O)c(O)c4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L04 mock treatment 777382.2222 147000.0 0.68 891172.5664 290000.0 1.54 1.5677 0.9325 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L05 compound treatment 837176.7677 207000.0 0.95 669947.1154 68700.0 0.36 0.933 0.9127 3616663 ACon1_002410 COC(=O)C1CC(=O)C[C@@H]2[C@@]1(C)CC[C@@H]3C(=O)O[C@@H](C[C@]32C)c4ccoc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L06 mock treatment 727008.6957 96900.0 0.45 643567.8392 42300.0 0.22 0.4748 0.9493 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L07 mock treatment 848296.748 218000.0 1.01 644888.3495 43600.0 0.23 0.8752 0.8476 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L08 mock treatment 653814.8148 23700.0 0.11 710840.6375 110000.0 0.58 0.4884 0.8257 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L09 compound treatment 663856.6038 33800.0 0.16 650244.186 49000.0 0.26 0.2939 0.97 3616665 ACon1_002411 C/C(=C\CCC(C)(OC1OCC(O)C(O)C1OC(=O)\C(=C\CCC(C)(O)C=C)\C)C=C)/C(=O)OC2CC3(C(O)CC4(C)C(=CCC5C6(C)CCC(OC7OC(CO)C(OC8OC(CO)C(O)C(OC9OCC(O)C(O)C9O)C8O)C(O)C7O)C(C)(C)C6CCC54C)C3CC2(C)C)C(=O)OC%10OCC(OC%11OC(CO)C(O)C(OC%12OC(CO)C(OC%13OC(CO)C(O)C(O)C%13O)C(O)C%12O)C%11O)C(O)C%10O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L10 mock treatment 679782.4074 49700.0 0.23 661301.5267 60100.0 0.32 0.3873 0.9869 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L11 compound treatment 778504.2373 148000.0 0.68 645500.0 44300.0 0.23 0.6499 0.8983 3616667 ACon1_002412 CC1OC(OC2C(O)C(O)C(C)OC2OC3(C)CC(OC4OC(CO)C(O)C(OC(=O)C)C4O)C5C(CCC6C(C)(C)CCCC65C)O3)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L12 mock treatment 588882.3529 -41200.0 -0.19 591516.4319 -9730.0 -0.05 -0.1709 -0.8676 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L13 compound treatment 739075.7576 109000.0 0.5 749564.2023 148000.0 0.79 0.9117 0.9766 3558283 ACon1_002413 C[C@H]1[C@H]2[C@H](CC3C4C[C@@H](O)[C@H]5C[C@@H](O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]9O[C@H](CO)[C@@H](O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)[C@H](O)[C@H]9O)[C@H](O)[C@H]6O)[C@H](O)C[C@]5(C)C4CC[C@]23C)O[C@@]%111CCC(C)CO%11 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L14 mock treatment 542597.2222 -87500.0 -0.4 546375.0 -54900.0 -0.29 -0.4911 -0.9871 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L15 mock treatment 623332.0313 -6760.0 -0.03 563501.9608 -37700.0 -0.2 -0.1636 -0.8075 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L16 mock treatment 560312.253 -69800.0 -0.32 527208.2019 -74000.0 -0.39 -0.5052 -0.9951 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L17 compound treatment 546679.8561 -83400.0 -0.38 571242.1053 -30000.0 -0.16 -0.3845 -0.9237 3559686 ACon1_002414 COc1ccc(C[C@H]2COC(=O)[C@]2(O)Cc3ccc(O)c(OC)c3)cc1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L18 mock treatment 607076.3359 -23000.0 -0.11 527276.9953 -74000.0 -0.39 -0.3525 -0.8672 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L19 compound treatment 585792.0792 -44300.0 -0.2 461125.4355 -140000.0 -0.74 -0.67 -0.8692 3557479 ACon1_002415 CC(=CCc1c(O)cc(O)c2C(=O)CC(Oc12)c3ccc(O)c(O)c3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L20 mock treatment 580369.863 -49700.0 -0.23 566769.8745 -34500.0 -0.18 -0.2914 -0.9937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L21 compound treatment 552299.0354 -77800.0 -0.36 622240.8027 21000.0 0.11 -0.1749 -0.4657 3558013 ACon1_002416 CC(=O)O[C@H]1CC(C)(C)CC2[C@@]31CO[C@]42CCC5[C@@]6(C)CC[C@H](O[C@@H]7OC[C@H](O[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O[C@@H]9OC[C@@H](O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O)[C@H](O)[C@H]9O)[C@H](O)[C@H]7O[C@@H]%11O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%11O)[C@@](C)(CO)C6CC[C@@]5(C)[C@]4(C)C[C@H]3O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L22 mock treatment 584217.5439 -45900.0 -0.21 488720.4301 -113000.0 -0.6 -0.5716 -0.9027 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L23 mock treatment 522753.8462 -107000.0 -0.5 538713.7681 -62500.0 -0.33 -0.5845 -0.981 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 L24 mock treatment 531000.0 -99100.0 -0.46 514586.2069 -86700.0 -0.46 -0.6481 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M01 compound treatment 559833.3333 -70300.0 -0.32 545944.9541 -55300.0 -0.29 -0.4365 -0.9988 3557425 ACon1_002417 C/C=C(\C)/C(=O)OC1CCC(=O)OC1\C=C\C(O)C(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M02 compound treatment 563416.0 -66700.0 -0.31 534250.9091 -67000.0 -0.36 -0.4687 -0.9974 3557333 ACon1_002418 Cc1cc2cc(O)cc(O)c2c(=O)o1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M03 compound treatment 632504.2735 2410.0 0.01 676272.0 75000.0 0.4 0.2893 0.7266 3559679 ACon1_002419 COC(=O)[C@@H]1C[C@@H](O)C[C@]2(C)[C@@H]1CC[C@]3(C[C@H]4CC[C@H]32)[C@@H](O)C4=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M04 compound treatment 642246.4286 12200.0 0.06 624851.9856 23600.0 0.13 0.1282 0.9343 1110474 ACon1_002420 COc1ccc2c(=O)c(O)c(oc2c1)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M05 compound treatment 623689.9563 -6400.0 -0.03 589586.6142 -11700.0 -0.06 -0.0646 -0.9429 3553164 ACon1_002421 C1Oc2ccc(cc2O1)[C@H]3OC[C@@H]4[C@H](OC[C@H]34)c5ccc6OCOc6c5 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M06 compound treatment 682020.3252 51900.0 0.24 555490.4943 -45800.0 -0.24 -0.0023 -0.0066 3557719 ACon1_002422 CCCCC/C=C/C=C/C(O)CCCCCCCC(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M07 compound treatment 521604.7904 -108000.0 -0.5 628268.7747 27000.0 0.14 -0.2524 -0.485 3616668 ACon1_002423 CO[C@H]1C[C@H](C)[C@@H](OC)C2=CC(=O)C=C(NC(=O)/C(=C/C=C\[C@H](OC)[C@@H](OC(=O)N)/C(=C/[C@H](C)[C@H]1O)/C)/C)C2=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M08 compound treatment 574901.0601 -55200.0 -0.25 784720.4724 183000.0 0.97 0.5082 0.5052 3559706 ACon1_002424 COc1cc(O)c2c(=O)cc(oc2c1)c3cc(OC)c(OC)c(O)c3OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M09 mock treatment 599128.3019 -31000.0 -0.14 560800.0 -40400.0 -0.21 -0.2527 -0.9805 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M10 mock treatment 583593.1034 -46500.0 -0.21 550139.6226 -51100.0 -0.27 -0.3433 -0.9933 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M11 compound treatment 553122.3022 -77000.0 -0.35 457846.1538 -143000.0 -0.76 -0.7888 -0.9398 3558746 ACon1_002425 COc1cc(/C=C/CO)ccc1OC\C=C(/C)\CCC=C(C)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M12 compound treatment 545749.1409 -84300.0 -0.39 524196.0784 -77000.0 -0.41 -0.564 -0.9997 3616671 ACon1_002426 COc1c(O)cc2C(Oc3cc(C)oc(=O)c3)C(C)OC(=O)c2c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M13 mock treatment 557259.8425 -72800.0 -0.34 544560.5536 -56700.0 -0.3 -0.4501 -0.9985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M14 mock treatment 500531.9149 -130000.0 -0.6 506789.272 -94500.0 -0.5 -0.7767 -0.9962 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M15 compound treatment 461792.7273 -168000.0 -0.78 481636.3636 -120000.0 -0.63 -0.9974 -0.995 3554561 ACon1_002427 COC(=O)[C@]1(Cc2ccc(O)c(CC=C(C)C)c2)OC(=O)C(=C1c3ccc(O)cc3)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M16 compound treatment 566125.9843 -64000.0 -0.29 547495.3271 -53700.0 -0.29 -0.4102 -0.9999 3616673 ACon1_002428 COC(=O)[C@]1(O)[C@H](O)C(=O)C(=C1/C=C/C)Cl 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M17 compound treatment 508364.2612 -122000.0 -0.56 485028.9855 -116000.0 -0.62 -0.8328 -0.9989 3554697 ACon1_002429 COC(=O)c1c(O)cc(C)cc1Oc2c(O)cc(OC)cc2CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M18 compound treatment 508541.3793 -122000.0 -0.56 519896.5517 -81300.0 -0.43 -0.7015 -0.9916 3616676 ACon1_002430 COc1cc(O)cc(C)c1C(=O)OC2C(CO)OC(C2OC(=O)C)n3ccc(=O)[nH]c3=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M19 compound treatment 547996.7427 -82100.0 -0.38 488904.1534 -112000.0 -0.6 -0.689 -0.976 3616679 ACon1_002431 COC(CC(c1c(O)cc2cc(C)oc(=O)c2c1O)c3c(O)cc4cc(C)oc(=O)c4c3O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M20 compound treatment 608488.2813 -21600.0 -0.1 527618.705 -73600.0 -0.39 -0.3466 -0.86 3616682 ACon1_002432 OC[C@H]1O[C@@H](Oc2c(O)cccc2COC(=O)C3(O)C4C5C6C7C5C(C7C(O)(C(=O)OCc8cccc(O)c8O[C@@H]9O[C@H](CO)[C@@H](O)[C@H](O)[C@H]9O)C(=O)C64)C3=O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M21 compound treatment 560751.938 -69300.0 -0.32 593372.4696 -7870.0 -0.04 -0.2556 -0.7927 3552105 ACon1_002433 C/C=C/C1OC2=C(C(O)C1O)C(=O)OC2=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M22 compound treatment 560752.5424 -69300.0 -0.32 540566.9291 -60700.0 -0.32 -0.4537 -1.0 3616684 ACon1_002434 CC1CCC2(CCC3(C(=O)O)C(=CCC4C5(C)CCC(OC6OC(C)C(O)C(=O)C6O)C(C)(C)C5CCC43C)C2C1C)C(=O)OC7OC(CO)C(O)C(O)C7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M23 compound treatment 522170.9677 -108000.0 -0.5 500824.1042 -100000.0 -0.53 -0.7285 -0.9994 3559395 ACon1_002435 C/C=C\1/[C@H](CC(=O)OCCc2ccc(O)cc2)C(=CO[C@H]1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 M24 compound treatment 523832.636 -106000.0 -0.49 467428.5714 -134000.0 -0.71 -0.8484 -0.9836 3559231 ACon1_002436 C[C@@H]1O[C@@H](O[C@@H]2[C@@H]3O[C@]3(CO)[C@@H]4[C@H]2C=CO[C@H]4O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@H](OC(=O)/C=C/c6ccccc6)[C@H](OC(=O)C)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N01 compound treatment 821805.5556 192000.0 0.88 785412.0 184000.0 0.98 1.3159 0.9988 2090630 ACon1_002437 CC1OC(OCC2OC(Oc3c(oc4cc(O)cc(O)c4c3=O)c5ccc(O)cc5)C(OC6OC(C)C(O)C(O)C6O)C(O)C2O)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N02 mock treatment 756990.6103 127000.0 0.59 793974.8744 193000.0 1.02 1.1366 0.965 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N03 compound treatment 850079.4979 220000.0 1.01 705580.6452 104000.0 0.55 1.1087 0.9594 3616685 ACon1_002438 CC(=CCc1cc2C(=O)[C@H](O)[C@H](Oc2c(CC=C(C)C)c1O)c3ccc(O)cc3)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N04 mock treatment 779951.1111 150000.0 0.69 844852.1739 244000.0 1.29 1.4023 0.957 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N05 compound treatment 648639.1304 18500.0 0.09 597107.6923 -4130.0 -0.02 0.045 0.5094 3616688 ACon1_002439 C[C@]12C[C@H](OC(=O)[C@H]2CC[C@]3(C)[C@H]1CCC=C3C(=O)O)c4ccoc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N06 mock treatment 812371.179 182000.0 0.84 830070.1754 229000.0 1.21 1.4526 0.9839 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N07 compound treatment 704377.6978 74300.0 0.34 636275.1938 35000.0 0.19 0.3736 0.9587 3616690 ACon1_002440 COc1cc2C[C@H]3COC(=O)[C@@H]3Cc4cc5OCOc5cc4-c2c(OC)c1OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N08 mock treatment 731098.6547 101000.0 0.47 678618.6441 77400.0 0.41 0.6196 0.998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N09 mock treatment 696551.1111 66500.0 0.31 597634.4086 -3610.0 -0.02 0.2032 0.6617 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N10 mock treatment 708251.0823 78200.0 0.36 560460.6742 -40800.0 -0.22 0.1019 0.2425 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N11 compound treatment 717513.1086 87400.0 0.4 676386.3636 75100.0 0.4 0.5669 1.0 3616692 ACon1_002441 CO[C@@H]1[C@@H](O)[C@@H](O[C@H]2CC[C@]3(C)C4C[C@@H]5C(=C)[C@H](CC[C@]5(O)[C@@H]4CC[C@@H]3C2)C6=CC(=O)OC6)O[C@@H](C)[C@H]1O[C@@H]7O[C@H](CO[C@@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N12 mock treatment 621940.8867 -8150.0 -0.04 649877.193 48600.0 0.26 0.1558 0.5977 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N13 mock treatment 697916.2562 67800.0 0.31 596983.6735 -4260.0 -0.02 0.2052 0.6543 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N14 mock treatment 578980.916 -51100.0 -0.24 710576.9231 109000.0 0.58 0.2434 0.3888 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N15 compound treatment 669888.1119 39800.0 0.18 650564.9123 49300.0 0.26 0.3148 0.985 3616695 ACon1_002442 COc1cc2nc3occc3c(OC)c2cc1OCC(O)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N16 mock treatment 638504.2735 8410.0 0.04 567137.6812 -34100.0 -0.18 -0.1005 -0.5432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N17 compound treatment 541947.8827 -88100.0 -0.41 615967.7419 14700.0 0.08 -0.2322 -0.561 3559633 ACon1_002443 C/C(=C/CCC(C)(O)C=C)/CCC(=O)C(C)(C)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N18 mock treatment 698668.0328 68600.0 0.32 688070.3125 86800.0 0.46 0.5493 0.9832 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N19 compound treatment 548287.6712 -81800.0 -0.38 545297.3856 -55900.0 -0.3 -0.4766 -0.9929 3558393 ACon1_002444 CC(C)C1CCC(=CCCC2(C)OC2C1OC3OC(COC(=O)C)C(O)C(O)C3O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N20 mock treatment 505412.6984 -125000.0 -0.57 516107.5697 -85100.0 -0.45 -0.7259 -0.9928 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N21 compound treatment 593621.9512 -36500.0 -0.17 667075.0751 65800.0 0.35 0.128 0.3302 3558493 ACon1_002445 COc1cc(CC2COC(C2COC(=O)/C=C/c3ccc(O)cc3)c4ccc(O)c(OC)c4)ccc1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N22 mock treatment 531279.661 -98800.0 -0.46 482031.4961 -119000.0 -0.63 -0.7693 -0.9871 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N23 mock treatment 469643.3824 -160000.0 -0.74 622132.6165 20900.0 0.11 -0.4449 -0.5946 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 N24 mock treatment 485554.0541 -145000.0 -0.67 606274.9004 5030.0 0.03 -0.4525 -0.6782 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O01 compound treatment 640205.8824 10100.0 0.05 589123.8095 -12100.0 -0.06 -0.0125 -0.1571 3557529 ACon1_002446 COc1cc(OC)c2C(=O)CC(Oc2c1O)c3ccccc3 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O02 compound treatment 514811.7155 -115000.0 -0.53 494065.4206 -107000.0 -0.57 -0.7779 -0.9994 3559907 ACon1_002447 CC1(C2CC3CC21)C3(C)CCC(O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O03 compound treatment 677974.4898 47900.0 0.22 591312.7148 -9930.0 -0.05 0.1189 0.5238 3559525 ACon1_002448 O[C@]12CCC(=C)[C@@H]3CCC(=C)[C@@H]3[C@H]2OC(=O)C1=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O04 compound treatment 624019.1571 -6080.0 -0.03 601851.4056 610.0 0.0 -0.0175 -0.6213 3559658 ACon1_002449 COc1ccc(CCC(=O)c2ccc(OC)cc2O)cc1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O05 compound treatment 536971.6981 -93100.0 -0.43 528395.4373 -72800.0 -0.39 -0.5769 -0.9986 360 ACon1_002450 Oc1ccc(cc1)c2cc(=O)c3c(O)cc(O)cc3o2 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O06 compound treatment 608802.2814 -21300.0 -0.1 581386.2816 -19900.0 -0.11 -0.1439 -0.9994 3555974 ACon1_002451 OCCCCCCC(C(=O)O)C(=C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O07 compound treatment 664262.0968 34200.0 0.16 583218.9055 -18000.0 -0.1 0.0438 0.2378 3559619 ACon1_002452 OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](O)C=C(CO)[C@H]32)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O08 compound treatment 641695.279 11600.0 0.05 684587.3786 83300.0 0.44 0.3504 0.7869 3557500 ACon1_002453 C[C@H]1[C@H]2[C@H](OC1=O)/C=C(\C)/CC/C=C(\CO)/C[C@H]2O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O09 compound treatment 627679.0123 -2420.0 -0.01 576070.5882 -25200.0 -0.13 -0.1023 -0.7634 3553872 ACon1_002454 CC1(C)O[C@H]2CC(=O)OC[C@@]23[C@H]1CC(=O)[C@]4(C)[C@@H]3CC[C@@]5(C)[C@@H](OC(=O)C=C54)c6ccoc6 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O10 compound treatment 622259.9119 -7830.0 -0.04 547220.0 -54000.0 -0.29 -0.2282 -0.79 3616698 ACon1_002455 CC1CCC(O)C2C=CC(C)(O)C(C)(C12)C(=O)CCO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O11 mock treatment 625340.081 -4750.0 -0.02 600504.717 -737.0 0.0 -0.0183 -0.8202 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O12 mock treatment 628070.0935 -2020.0 -0.01 633194.5701 32000.0 0.17 0.1132 0.6671 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O13 compound treatment 562248.8263 -67800.0 -0.31 482303.5714 -119000.0 -0.63 -0.6673 -0.9477 3554856 ACon1_002456 COc1cc(C=C)cc2c(=O)oc3c(cc(OC)c4c(O)ccc([C@@H]5O[C@H](C)[C@H](O)[C@@H]([C@H]5O)N(C)C)c34)c12 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O14 compound treatment 625802.974 -4290.0 -0.02 493322.1477 -108000.0 -0.57 -0.4187 -0.7311 3559702 ACon1_002457 O[C@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O15 compound treatment 609433.79 -20700.0 -0.1 574636.3636 -26600.0 -0.14 -0.1672 -0.9817 3553713 ACon1_002458 CC(CCCCC(O)C(CO)C(=O)O)C/C(=C/C(=C/C(=O)O)/C)/C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O16 compound treatment 695201.4925 65100.0 0.3 568572.5806 -32700.0 -0.17 0.0898 0.259 3553071 ACon1_002459 C[C@H]1[C@H](O)CCC2=CC(=O)C(=C(C)C)C[C@]12CO 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O17 compound treatment 557626.9841 -72500.0 -0.33 529772.7273 -71500.0 -0.38 -0.5044 -0.998 3553691 ACon1_002460 CC(CC(=O)N)OC(=O)c1cc(Cl)cc(O)c1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O18 compound treatment 448389.6552 -182000.0 -0.84 373647.0588 -228000.0 -1.21 -1.4461 -0.9841 3616699 ACon1_002461 CC(=O)O[C@@]1(C)C[C@@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H]3[C@@H]1C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)OC=C3C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O19 compound treatment 552368.2171 -77700.0 -0.36 452425.9259 -149000.0 -0.79 -0.8116 -0.9362 3559916 ACon1_002462 CC(C)(O)CCc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c3C(=O)[C@H](O)[C@H](Oc13)c4ccc(O)cc4 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O20 compound treatment 509149.635 -121000.0 -0.56 552652.9851 -48600.0 -0.26 -0.5766 -0.9385 1017609 ACon1_002463 CC(=CCc1c(O)c2c(=O)c(coc2c3C=CC(C)(C)Oc13)c4ccc(O)cc4)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O21 compound treatment 477503.4014 -153000.0 -0.7 532893.4708 -68300.0 -0.36 -0.7539 -0.9524 3554292 ACon1_002464 CCCCCCCC(O)C(O)C1CC(=CC(=O)O1)OC 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O22 compound treatment 448586.6142 -182000.0 -0.84 450383.9286 -151000.0 -0.8 -1.1577 -0.9997 3558536 ACon1_002465 CC1OC(OC2CCC3(C)C(CCC4(C)C3CC=C5C6CC(C)(C)CCC6(CCC54C(=O)O)C(=O)OC7OC(CO)C(O)C(O)C7O)C2(C)C)C(O)C(O)C1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O23 compound treatment 524683.5938 -105000.0 -0.49 508837.3016 -92400.0 -0.49 -0.6903 -1.0 3616706 ACon1_002466 CC1CC(=O)c2cc(O)c(O)cc2C1 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 O24 compound treatment 532463.4146 -97600.0 -0.45 461350.1805 -140000.0 -0.74 -0.843 -0.9713 3615046 ACon1_002467 COC1OC2C(N(C)CCc3cc4OCOc4cc23)c5ccc6OCOc6c15 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P01 compound treatment 608931.0345 -21200.0 -0.1 678924.2424 77700.0 0.41 0.2223 0.5251 3616709 ACon1_002468 C[C@@]1(CCC2C(=CCC3[C@@](C)(CCC[C@]23C)C(=O)O)C1)C=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P02 mock treatment 571785.7143 -58300.0 -0.27 620838.565 19600.0 0.1 -0.1166 -0.4046 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P03 compound treatment 522991.4894 -107000.0 -0.49 575004.0486 -26200.0 -0.14 -0.4477 -0.8724 3616713 ACon1_002469 COC(=O)[C@@H](O)[C@@H]1[C@@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C[C@]54O[C@@H]6C([C@@]2(O)C[C@@]1(C)[C@@H]6O)[C@@]35O)c7ccoc7 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P04 mock treatment 671946.0581 41900.0 0.19 555518.6916 -45700.0 -0.24 -0.035 -0.1129 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P05 compound treatment 651256.917 21200.0 0.1 661138.7755 59900.0 0.32 0.2937 0.8836 3616715 ACon1_002470 OC[C@H]1O[C@@H](Oc2ccc(cc2)c3coc4c([C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P06 mock treatment 606730.7692 -23400.0 -0.11 679372.2944 78100.0 0.41 0.2168 0.5064 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P07 compound treatment 614488.7892 -15600.0 -0.07 637324.4444 36100.0 0.19 0.0844 0.413 3616718 ACon1_002471 C[C@@H]1CC[C@@]2(CC[C@]3(C(=O)O)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)[C@@H]2[C@H]1C)C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P08 mock treatment 599766.5198 -30300.0 -0.14 525521.9512 -75700.0 -0.4 -0.3829 -0.9003 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P09 compound treatment 658860.7595 28800.0 0.13 622384.6154 21100.0 0.11 0.1731 0.9965 3616720 ACon1_002472 C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OCc3ccccc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P10 mock treatment 520164.3192 -110000.0 -0.51 530243.1193 -71000.0 -0.38 -0.6248 -0.9893 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P11 mock treatment 588384.0 -41700.0 -0.19 497705.8824 -104000.0 -0.55 -0.5243 -0.9011 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P12 mock treatment 508658.5366 -121000.0 -0.56 565102.8037 -36100.0 -0.19 -0.5315 -0.898 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P13 compound treatment 488267.1233 -142000.0 -0.65 549603.1128 -51600.0 -0.27 -0.6562 -0.9254 3616724 ACon1_002473 COc1cc2nc3occc3c(OC)c2cc1OCC(OC(=O)C)C(C)(C)OC(=O)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P14 mock treatment 540525.5814 -89600.0 -0.41 487822.7848 -113000.0 -0.6 -0.7175 -0.9832 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P15 compound treatment 474911.1111 -155000.0 -0.72 559357.9767 -41900.0 -0.22 -0.6631 -0.8849 3616725 ACon1_002474 CCCCCc1cc(OC)c2CC(O)C(C)(C)Oc2c1C(=O)O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P16 mock treatment 519924.4444 -110000.0 -0.51 495068.0 -106000.0 -0.56 -0.7575 -0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P17 compound treatment 430937.0861 -199000.0 -0.92 501581.3008 -99700.0 -0.53 -1.0232 -0.9656 1001668 ACon1_002475 CC(=CCCC1(C)Oc2c(C)cc3c4ccccc4[nH]c3c2C=C1)C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P18 mock treatment 448397.351 -182000.0 -0.84 507159.204 -94100.0 -0.5 -0.9454 -0.9693 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P19 compound treatment 350811.1111 -279000.0 -1.29 305062.7615 -296000.0 -1.57 -2.0215 -0.9951 3554138 ACon1_002476 CCC(C)C(=O)O[C@@H]1[C@H]2[C@@H](O)[C@@H](C)C[C@]2(O)C(=O)[C@@H](C)/C=C/C(C)(C)[C@H](O)[C@H](OC(=O)C(C)C)[C@@H](OC(=O)C(C)CC)C1=C 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P20 mock treatment 391007.0671 -239000.0 -1.1 458689.243 -143000.0 -0.76 -1.3143 -0.9831 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P21 compound treatment 425445.0867 -205000.0 -0.94 379406.6852 -222000.0 -1.18 -1.4993 -0.994 3559753 ACon1_002477 COC1=CC2(CCN(C)[C@@H]3Cc4cc(OC)c(OC)cc42)C3=CC1=O 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P22 mock treatment 404436.2416 -226000.0 -1.04 393861.4865 -207000.0 -1.1 -1.5136 -0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P23 mock treatment 393575.2896 -237000.0 -1.09 379075.5396 -222000.0 -1.18 -1.6045 -0.9993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.2297 P24 mock treatment 417186.2348 -213000.0 -0.98 418830.0395 -182000.0 -0.97 -1.3784 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A01 mock treatment 663198.2379 103000.0 0.48 532486.3636 -58700.0 -0.31 0.1164 0.2048 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A02 mock treatment 549467.5325 -10500.0 -0.05 523342.1053 -67800.0 -0.36 -0.2887 -0.7954 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A03 mock treatment 525539.823 -34500.0 -0.16 639023.6967 47900.0 0.25 0.0671 0.2241 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A04 mock treatment 626057.1429 66100.0 0.3 673533.3333 82400.0 0.44 0.5243 0.9845 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A05 mock treatment 698821.5962 139000.0 0.64 641232.8767 50100.0 0.27 0.6404 0.9241 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A06 mock treatment 486538.1679 -73500.0 -0.34 741528.0 150000.0 0.8 0.3244 0.3743 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A07 mock treatment 648745.8333 88700.0 0.41 720371.9008 129000.0 0.69 0.774 0.9696 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A08 mock treatment 647425.7028 87400.0 0.4 708378.2609 117000.0 0.62 0.7247 0.978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A09 mock treatment 668978.355 109000.0 0.5 681004.1322 89800.0 0.48 0.6923 0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A10 mock treatment 565258.3333 5250.0 0.02 627730.3922 36600.0 0.19 0.1543 0.7893 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A11 mock treatment 634174.5283 74200.0 0.34 600341.9913 9180.0 0.05 0.2763 0.7997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A12 mock treatment 616560.3448 56600.0 0.26 627032.9218 35900.0 0.19 0.3189 0.988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A13 mock treatment 588008.4034 28000.0 0.13 574289.916 -16900.0 -0.09 0.028 0.1784 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A14 mock treatment 586564.7668 26600.0 0.12 625086.5385 33900.0 0.18 0.2138 0.9824 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A15 mock treatment 558697.6744 -1310.0 -0.01 568581.4978 -22600.0 -0.12 -0.089 -0.7418 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A16 mock treatment 545821.2928 -14200.0 -0.07 623375.4789 32200.0 0.17 0.0746 0.4075 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A17 mock treatment 469692.3077 -90300.0 -0.42 632650.655 41500.0 0.22 -0.1389 -0.2949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A18 mock treatment 586416.6667 26400.0 0.12 655458.3333 64300.0 0.34 0.3273 0.9037 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A19 mock treatment 603057.377 43100.0 0.2 516239.4366 -74900.0 -0.4 -0.1406 -0.3165 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A20 mock treatment 574278.97 14300.0 0.07 655337.3016 64200.0 0.34 0.2872 0.8285 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A21 mock treatment 572484.9785 12500.0 0.06 580533.3333 -10600.0 -0.06 8.0E-4 0.0102 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A22 mock treatment 620152.9851 60100.0 0.28 588227.2727 -2940.0 -0.02 0.1851 0.6663 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A23 mock treatment 529584.6154 -30400.0 -0.14 665495.283 74300.0 0.39 0.1796 0.4291 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base A24 mock treatment 503610.8597 -56400.0 -0.26 645981.7073 54800.0 0.29 0.0217 0.0556 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B01 mock treatment 780626.506 221000.0 1.02 646338.7097 55200.0 0.29 0.9264 0.875 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B02 mock treatment 756950.6726 197000.0 0.91 720037.2093 129000.0 0.68 1.1256 0.9902 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B03 mock treatment 568796.2085 8790.0 0.04 771645.933 180000.0 0.96 0.7056 0.7364 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B04 mock treatment 707634.4538 148000.0 0.68 751057.6923 160000.0 0.85 1.0811 0.9941 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B05 mock treatment 571540.2844 11500.0 0.05 520477.6786 -70700.0 -0.37 -0.2275 -0.6008 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B06 mock treatment 624233.4802 64200.0 0.3 703654.6392 112000.0 0.6 0.6313 0.9478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B07 mock treatment 588495.4955 28500.0 0.13 594576.5306 3410.0 0.02 0.1057 0.797 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B08 mock treatment 644000.0 84000.0 0.39 669420.8145 78300.0 0.42 0.5674 0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B09 mock treatment 513343.3476 -46700.0 -0.22 521015.3846 -70100.0 -0.37 -0.4153 -0.9661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B10 mock treatment 563995.7627 3990.0 0.02 667986.4865 76800.0 0.41 0.3011 0.7383 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B11 mock treatment 674061.3027 114000.0 0.53 753252.1008 162000.0 0.86 0.9798 0.9722 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B12 mock treatment 722427.9279 162000.0 0.75 641886.4629 50700.0 0.27 0.7199 0.9045 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B13 mock treatment 761747.9339 202000.0 0.93 655471.4286 64300.0 0.34 0.899 0.9073 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B14 mock treatment 699426.1603 139000.0 0.64 526406.5421 -64800.0 -0.34 0.2118 0.2905 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B15 mock treatment 572484.7328 12500.0 0.06 586926.4069 -4240.0 -0.02 0.0248 0.4014 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B16 mock treatment 609435.8974 49400.0 0.23 628333.3333 37200.0 0.2 0.3006 0.9974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B17 mock treatment 753937.5 194000.0 0.89 469064.0 -122000.0 -0.65 0.1745 0.158 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B18 mock treatment 695430.7692 135000.0 0.62 664293.3884 73100.0 0.39 0.7159 0.9738 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B19 mock treatment 612898.8764 52900.0 0.24 499230.4965 -91900.0 -0.49 -0.1723 -0.3161 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B20 mock treatment 640238.5321 80200.0 0.37 631556.5611 40400.0 0.21 0.4131 0.9663 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B21 mock treatment 580779.1667 20800.0 0.1 686929.2035 95800.0 0.51 0.4269 0.8259 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B22 mock treatment 577093.2836 17100.0 0.08 532180.602 -59000.0 -0.31 -0.1655 -0.513 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B23 mock treatment 579316.4063 19300.0 0.09 522204.7244 -69000.0 -0.37 -0.1957 -0.5198 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base B24 mock treatment 639234.3096 79200.0 0.37 706229.7297 115000.0 0.61 0.6899 0.9699 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C01 mock treatment 501104.3478 -58900.0 -0.27 526463.4146 -64700.0 -0.34 -0.4347 -0.9933 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C02 mock treatment 533255.4348 -26800.0 -0.12 503879.3103 -87300.0 -0.46 -0.4146 -0.8653 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C03 mock treatment 695179.3478 135000.0 0.62 635005.6818 43800.0 0.23 0.6052 0.9097 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C04 mock treatment 589772.7273 29800.0 0.14 648349.7758 57200.0 0.3 0.3115 0.9358 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C05 mock treatment 591785.3659 31800.0 0.15 593868.6869 2700.0 0.01 0.1138 0.7726 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C06 mock treatment 601411.2554 41400.0 0.19 619346.8208 28200.0 0.15 0.2407 0.9927 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C07 mock treatment 708440.367 148000.0 0.68 657612.9032 66400.0 0.35 0.7332 0.9524 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C08 mock treatment 584936.8932 24900.0 0.11 540117.9487 -51000.0 -0.27 -0.1102 -0.3745 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C09 mock treatment 597799.1453 37800.0 0.17 647777.2512 56600.0 0.3 0.3356 0.9665 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C10 mock treatment 597721.03 37700.0 0.17 632526.3158 41400.0 0.22 0.2781 0.9934 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C11 mock treatment 602841.5842 42800.0 0.2 678245.5357 87100.0 0.46 0.4663 0.9282 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C12 mock treatment 580471.7742 20500.0 0.09 538579.4393 -52600.0 -0.28 -0.1305 -0.4431 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C13 mock treatment 590250.0 30200.0 0.14 582267.8571 -8900.0 -0.05 0.0653 0.4432 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C14 mock treatment 574722.449 14700.0 0.07 617419.3548 26300.0 0.14 0.1465 0.9454 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C15 mock treatment 555141.4141 -4870.0 -0.02 524402.3904 -66800.0 -0.35 -0.2663 -0.7504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C16 mock treatment 656144.7964 96100.0 0.44 587635.1931 -3530.0 -0.02 0.3003 0.6767 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C17 mock treatment 634063.4921 74100.0 0.34 526227.6423 -64900.0 -0.34 -0.002 -0.0042 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C18 mock treatment 527306.2201 -32700.0 -0.15 563938.2022 -27200.0 -0.14 -0.2087 -0.9998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C19 mock treatment 608159.6958 48200.0 0.22 572904.9587 -18300.0 -0.1 0.0885 0.3655 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C20 mock treatment 607325.4902 47300.0 0.22 476053.0612 -115000.0 -0.61 -0.2774 -0.4279 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C21 mock treatment 507989.7959 -52000.0 -0.24 508341.5842 -82800.0 -0.44 -0.4802 -0.9595 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C22 mock treatment 495974.9104 -64000.0 -0.3 547751.3228 -43400.0 -0.23 -0.3716 -0.9924 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C23 mock treatment 606124.5136 46100.0 0.21 506966.2447 -84200.0 -0.45 -0.1654 -0.3344 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base C24 mock treatment 519567.0996 -40400.0 -0.19 611730.2905 20600.0 0.11 -0.0547 -0.2533 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D01 mock treatment 715560.7477 156000.0 0.72 551500.0 -39700.0 -0.21 0.3585 0.4795 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D02 mock treatment 576397.5155 16400.0 0.08 512000.0 -79200.0 -0.42 -0.2435 -0.5706 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D03 mock treatment 556169.8113 -3840.0 -0.02 563307.2626 -27900.0 -0.15 -0.117 -0.7862 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D04 mock treatment 571470.8738 11500.0 0.05 554453.7815 -36700.0 -0.19 -0.1003 -0.4971 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D05 mock treatment 473906.5421 -86100.0 -0.4 527223.301 -63900.0 -0.34 -0.5206 -0.9969 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D06 mock treatment 508264.2276 -51700.0 -0.24 534696.5174 -56500.0 -0.3 -0.3805 -0.9937 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D07 mock treatment 527755.7604 -32300.0 -0.15 669108.4337 77900.0 0.41 0.1872 0.426 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D08 mock treatment 523815.9204 -36200.0 -0.17 748888.8889 158000.0 0.84 0.4735 0.5551 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D09 mock treatment 496204.461 -63800.0 -0.29 610513.2743 19300.0 0.1 -0.1355 -0.4348 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D10 mock treatment 461062.8019 -98900.0 -0.46 645870.8134 54700.0 0.29 -0.1175 -0.2172 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D11 mock treatment 501358.4906 -58600.0 -0.27 699283.7209 108000.0 0.57 0.2143 0.3379 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D12 mock treatment 629904.5802 69900.0 0.32 536804.5113 -54400.0 -0.29 0.0241 0.0556 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D13 mock treatment 596004.0984 36000.0 0.17 523135.9223 -68000.0 -0.36 -0.1378 -0.3468 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D14 mock treatment 488290.1786 -71700.0 -0.33 533008.8496 -58200.0 -0.31 -0.452 -0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D15 mock treatment 501703.3898 -58300.0 -0.27 596810.1852 5650.0 0.03 -0.1689 -0.6245 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D16 mock treatment 512893.5484 -47100.0 -0.22 515804.7337 -75400.0 -0.4 -0.4363 -0.959 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D17 mock treatment 546011.0701 -14000.0 -0.06 591732.3232 568.0 0.0 -0.0435 -0.6734 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D18 mock treatment 561885.1064 1880.0 0.01 492378.6408 -98800.0 -0.52 -0.3644 -0.6953 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D19 mock treatment 596931.8996 36900.0 0.17 549066.6667 -42100.0 -0.22 -0.0375 -0.1335 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D20 mock treatment 519273.0769 -40700.0 -0.19 550982.659 -40200.0 -0.21 -0.2835 -0.998 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D21 mock treatment 521157.0881 -38800.0 -0.18 460407.563 -131000.0 -0.69 -0.6171 -0.8615 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D22 mock treatment 477099.6016 -82900.0 -0.38 450093.2203 -141000.0 -0.75 -0.7994 -0.9514 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D23 mock treatment 559024.8963 -982.0 0.0 549511.5385 -41700.0 -0.22 -0.1594 -0.7214 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base D24 mock treatment 441833.887 -118000.0 -0.54 567778.2805 -23400.0 -0.12 -0.4731 -0.8464 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E01 mock treatment 537747.7876 -22300.0 -0.1 512531.401 -78600.0 -0.42 -0.3675 -0.8556 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E02 mock treatment 597254.0984 37200.0 0.17 534076.9231 -57100.0 -0.3 -0.0926 -0.2661 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E03 mock treatment 527826.2712 -32200.0 -0.15 585357.7982 -5810.0 -0.03 -0.1267 -0.836 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E04 mock treatment 640572.0165 80600.0 0.37 693045.4545 102000.0 0.54 0.6448 0.9833 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E05 mock treatment 492651.2605 -67400.0 -0.31 719565.2174 128000.0 0.68 0.2619 0.3499 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E06 mock treatment 352167.3469 -208000.0 -0.96 708616.4384 117000.0 0.62 -0.2372 -0.2075 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E07 mock treatment 564059.0406 4050.0 0.02 636618.2796 45500.0 0.24 0.1837 0.7596 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E08 mock treatment 570242.3077 10200.0 0.05 694175.8794 103000.0 0.55 0.4197 0.7653 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E09 mock treatment 528823.8342 -31200.0 -0.14 715583.7563 124000.0 0.66 0.365 0.5403 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E10 mock treatment 618400.9009 58400.0 0.27 672375.0 81200.0 0.43 0.495 0.9744 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E11 mock treatment 564013.9535 4010.0 0.02 728694.7368 138000.0 0.73 0.5289 0.7248 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E12 mock treatment 603953.125 43900.0 0.2 600605.0 9440.0 0.05 0.1787 0.8561 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E13 mock treatment 586495.614 26500.0 0.12 555328.2051 -35800.0 -0.19 -0.048 -0.2125 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E14 mock treatment 603963.37 44000.0 0.2 592154.8117 991.0 0.01 0.1471 0.7252 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E15 mock treatment 497102.5641 -62900.0 -0.29 655371.7949 64200.0 0.34 0.0357 0.0798 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E16 mock treatment 440575.8755 -119000.0 -0.55 612421.0526 21300.0 0.11 -0.3097 -0.5509 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E17 mock treatment 477000.0 -83000.0 -0.38 606875.0 15700.0 0.08 -0.2118 -0.5405 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E18 mock treatment 478292.1811 -81700.0 -0.38 608122.2222 17000.0 0.09 -0.2029 -0.5236 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E19 mock treatment 515514.377 -44500.0 -0.21 530195.0207 -61000.0 -0.32 -0.3737 -0.9759 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E20 mock treatment 554920.2658 -5090.0 -0.02 531126.3158 -60000.0 -0.32 -0.2418 -0.7571 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E21 mock treatment 539987.9032 -20000.0 -0.09 510043.7956 -81100.0 -0.43 -0.3695 -0.8397 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E22 mock treatment 587954.3726 27900.0 0.13 563400.9217 -27800.0 -0.15 -0.013 -0.0664 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E23 mock treatment 553925.0 -6080.0 -0.03 505302.521 -85900.0 -0.46 -0.3419 -0.7492 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base E24 mock treatment 611481.6514 51500.0 0.24 489046.3918 -102000.0 -0.54 -0.2151 -0.3638 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F01 mock treatment 783589.9582 224000.0 1.03 750464.7059 159000.0 0.84 1.3265 0.9951 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F02 mock treatment 526385.7143 -33600.0 -0.16 586809.3023 -4350.0 -0.02 -0.126 -0.8036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F03 mock treatment 665663.2124 106000.0 0.49 651260.6635 60100.0 0.32 0.5699 0.9788 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F04 mock treatment 679354.4304 119000.0 0.55 704808.9888 114000.0 0.6 0.8154 0.999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F05 mock treatment 533792.6267 -26200.0 -0.12 694411.1675 103000.0 0.55 0.3017 0.5381 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F06 mock treatment 487892.562 -72100.0 -0.33 673405.5556 82200.0 0.44 0.0733 0.1336 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F07 mock treatment 539341.3462 -20700.0 -0.1 796150.4854 205000.0 1.09 0.7014 0.6427 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F08 mock treatment 433129.8077 -127000.0 -0.59 619643.9024 28500.0 0.15 -0.3069 -0.5079 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F09 mock treatment 517219.2982 -42800.0 -0.2 656583.691 65400.0 0.35 0.1058 0.2651 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F10 mock treatment 457144.4444 -103000.0 -0.47 729772.5118 139000.0 0.74 0.1844 0.2108 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F11 mock treatment 524119.7917 -35900.0 -0.17 613988.5714 22800.0 0.12 -0.0314 -0.1532 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F12 mock treatment 513702.381 -46300.0 -0.21 531013.1579 -60200.0 -0.32 -0.3766 -0.9809 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F13 mock treatment 447023.0769 -113000.0 -0.52 631322.0339 40200.0 0.21 -0.2178 -0.387 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F14 mock treatment 431926.1993 -128000.0 -0.59 608957.5758 17800.0 0.09 -0.3509 -0.5867 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F15 mock treatment 568996.0159 8990.0 0.04 647288.8889 56100.0 0.3 0.2398 0.7979 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F16 mock treatment 455673.2673 -104000.0 -0.48 550200.9804 -41000.0 -0.22 -0.4939 -0.9355 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F17 mock treatment 406637.5546 -153000.0 -0.71 604367.2316 13200.0 0.07 -0.4506 -0.634 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F18 mock treatment 414318.9964 -146000.0 -0.67 591947.9167 784.0 0.0 -0.4721 -0.7027 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F19 mock treatment 472558.8235 -87400.0 -0.4 563697.4359 -27500.0 -0.15 -0.3882 -0.9053 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F20 mock treatment 461301.6949 -98700.0 -0.46 590316.0622 -848.0 0.0 -0.325 -0.7141 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F21 mock treatment 547757.2816 -12200.0 -0.06 626539.4737 35400.0 0.19 0.0927 0.4732 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F22 mock treatment 472600.0 -87400.0 -0.4 548618.0905 -42500.0 -0.23 -0.4446 -0.9624 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F23 mock treatment 544025.2101 -16000.0 -0.07 586100.8065 -5060.0 -0.03 -0.0711 -0.9065 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base F24 mock treatment 463305.1643 -96700.0 -0.45 479458.9372 -112000.0 -0.59 -0.7343 -0.9902 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G01 mock treatment 445985.1485 -114000.0 -0.53 481487.3096 -110000.0 -0.58 -0.7832 -0.9987 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G02 mock treatment 457581.0811 -102000.0 -0.47 534324.3243 -56800.0 -0.3 -0.5472 -0.9765 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G03 mock treatment 516390.2439 -43600.0 -0.2 600728.5714 9560.0 0.05 -0.1064 -0.5127 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G04 mock treatment 520369.0476 -39600.0 -0.18 497435.8974 -93700.0 -0.5 -0.4808 -0.9077 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G05 mock treatment 444910.0 -115000.0 -0.53 583775.6098 -7390.0 -0.04 -0.403 -0.7573 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G06 mock treatment 417324.1379 -143000.0 -0.66 519017.9372 -72100.0 -0.38 -0.7359 -0.9667 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G07 mock treatment 459691.4498 -100000.0 -0.46 581665.0718 -9500.0 -0.05 -0.3627 -0.7795 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G08 mock treatment 512982.5581 -47000.0 -0.22 572425.5319 -18700.0 -0.1 -0.2236 -0.9374 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G09 mock treatment 522671.2963 -37300.0 -0.17 532881.5166 -58300.0 -0.31 -0.3403 -0.9618 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G10 mock treatment 451980.0797 -108000.0 -0.5 639228.8136 48100.0 0.25 -0.172 -0.3074 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G11 mock treatment 413119.1489 -147000.0 -0.68 461961.7225 -129000.0 -0.69 -0.9636 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G12 mock treatment 417179.8246 -143000.0 -0.66 574461.5385 -16700.0 -0.09 -0.5284 -0.7951 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G13 mock treatment 484058.1818 -75900.0 -0.35 600636.8159 9470.0 0.05 -0.2121 -0.5995 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G14 mock treatment 464070.4846 -95900.0 -0.44 472206.8966 -119000.0 -0.63 -0.759 -0.9849 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G15 mock treatment 490464.2857 -69500.0 -0.32 519321.267 -71800.0 -0.38 -0.4962 -0.9963 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G16 mock treatment 363054.7264 -197000.0 -0.91 584791.8552 -6370.0 -0.03 -0.6661 -0.7329 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G17 mock treatment 364693.7799 -195000.0 -0.9 491674.1573 -99500.0 -0.53 -1.01 -0.9676 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G18 mock treatment 367683.4862 -192000.0 -0.89 469218.2741 -122000.0 -0.65 -1.0845 -0.988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G19 mock treatment 422713.7681 -137000.0 -0.63 563652.5424 -27500.0 -0.15 -0.5509 -0.8478 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G20 mock treatment 373289.5928 -187000.0 -0.86 532896.2264 -58300.0 -0.31 -0.8274 -0.9044 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G21 mock treatment 450003.6101 -110000.0 -0.51 486470.0461 -105000.0 -0.56 -0.7514 -0.999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G22 mock treatment 558367.5889 -1640.0 -0.01 497436.1702 -93700.0 -0.5 -0.3569 -0.7178 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G23 mock treatment 468176.0 -91800.0 -0.42 628330.6452 37200.0 0.2 -0.1601 -0.3426 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base G24 mock treatment 614795.2756 54800.0 0.25 489326.087 -102000.0 -0.54 -0.2033 -0.3409 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H01 mock treatment 597379.4643 37400.0 0.17 725939.6552 135000.0 0.71 0.6273 0.8531 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H02 mock treatment 593840.6593 33800.0 0.16 708783.4101 118000.0 0.62 0.5515 0.8575 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H03 mock treatment 644617.0213 84600.0 0.39 619290.9091 28100.0 0.15 0.3814 0.913 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H04 mock treatment 494465.1163 -65500.0 -0.3 563022.5989 -28100.0 -0.15 -0.3193 -0.9471 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H05 mock treatment 529028.0374 -31000.0 -0.14 667978.9474 76800.0 0.41 0.1871 0.4333 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H06 mock treatment 412090.0 -148000.0 -0.68 531711.9565 -59500.0 -0.32 -0.7053 -0.9386 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H07 mock treatment 510770.2703 -49200.0 -0.23 601425.8373 10300.0 0.05 -0.1221 -0.5228 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H08 mock treatment 554681.6327 -5320.0 -0.02 509256.5217 -81900.0 -0.43 -0.3246 -0.7459 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H09 mock treatment 441777.7778 -118000.0 -0.55 589160.4938 -2000.0 -0.01 -0.393 -0.7208 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H10 mock treatment 585892.4303 25900.0 0.12 627296.1373 36100.0 0.19 0.2199 0.9741 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H11 mock treatment 482304.7619 -77700.0 -0.36 608525.2525 17400.0 0.09 -0.1883 -0.5089 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H12 mock treatment 514333.3333 -45700.0 -0.21 541986.1111 -49200.0 -0.26 -0.3334 -0.9944 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H13 mock treatment 540008.3333 -20000.0 -0.09 571337.4233 -19800.0 -0.11 -0.1396 -0.9979 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H14 mock treatment 470834.7458 -89200.0 -0.41 546388.3495 -44800.0 -0.24 -0.4587 -0.966 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H15 mock treatment 535573.1707 -24400.0 -0.11 460519.5531 -131000.0 -0.69 -0.5697 -0.8114 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H16 mock treatment 465047.619 -95000.0 -0.44 543072.0721 -48100.0 -0.26 -0.49 -0.9669 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H17 mock treatment 415721.519 -144000.0 -0.67 478957.4468 -112000.0 -0.6 -0.8913 -0.9985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H18 mock treatment 393326.8608 -167000.0 -0.77 442104.0462 -149000.0 -0.79 -1.1026 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H19 mock treatment 415729.0076 -144000.0 -0.67 521216.9312 -69900.0 -0.37 -0.7328 -0.962 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H20 mock treatment 383180.1802 -177000.0 -0.82 474880.8511 -116000.0 -0.62 -1.0127 -0.9905 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H21 mock treatment 419942.6752 -140000.0 -0.65 490147.4654 -101000.0 -0.54 -0.8356 -0.9957 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H22 mock treatment 408347.5177 -152000.0 -0.7 465471.6157 -126000.0 -0.67 -0.966 -0.9997 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H23 mock treatment 555307.6923 -4700.0 -0.02 467623.8095 -124000.0 -0.66 -0.4787 -0.7301 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base H24 mock treatment 486133.6207 -73900.0 -0.34 481634.8315 -110000.0 -0.58 -0.6517 -0.9677 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I01 mock treatment 541787.3303 -18200.0 -0.08 508849.4624 -82300.0 -0.44 -0.3681 -0.828 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I02 mock treatment 520885.7143 -39100.0 -0.18 518237.2881 -72900.0 -0.39 -0.4011 -0.9397 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I03 mock treatment 604784.6154 44800.0 0.21 715945.4545 125000.0 0.66 0.614 0.8856 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I04 mock treatment 590887.3239 30900.0 0.14 644121.3592 53000.0 0.28 0.2993 0.9504 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I05 mock treatment 698525.641 139000.0 0.64 718768.4211 128000.0 0.68 0.9303 0.9996 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I06 mock treatment 594353.1915 34300.0 0.16 667907.2165 76700.0 0.41 0.3998 0.9154 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I07 mock treatment 560631.8182 625.0 0.0 621588.8325 30400.0 0.16 0.1161 0.7196 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I08 mock treatment 495746.7811 -64300.0 -0.3 761597.7654 170000.0 0.9 0.4297 0.4517 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I09 mock treatment 677389.6104 117000.0 0.54 709841.1765 119000.0 0.63 0.8279 0.9972 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I10 mock treatment 570531.3808 10500.0 0.05 615411.4583 24200.0 0.13 0.1253 0.9112 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I11 mock treatment 557703.5176 -2300.0 -0.01 769748.2993 179000.0 0.95 0.6623 0.6991 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I12 mock treatment 640267.7824 80300.0 0.37 629180.3279 38000.0 0.2 0.4043 0.9592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I13 mock treatment 601350.5535 41300.0 0.19 682254.6584 91100.0 0.48 0.4765 0.9173 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I14 mock treatment 426570.3704 -133000.0 -0.62 815430.8511 224000.0 1.19 0.406 0.3031 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I15 mock treatment 577677.7778 17700.0 0.08 694238.5787 103000.0 0.55 0.4442 0.8036 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I16 mock treatment 439587.0647 -120000.0 -0.56 528570.7071 -62600.0 -0.33 -0.6274 -0.9698 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I17 mock treatment 520444.9541 -39600.0 -0.18 613603.7736 22400.0 0.12 -0.0448 -0.2059 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I18 mock treatment 431746.7811 -128000.0 -0.59 691034.4828 99900.0 0.53 -0.0437 -0.055 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I19 mock treatment 480012.987 -80000.0 -0.37 560930.6931 -30200.0 -0.16 -0.3742 -0.9304 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I20 mock treatment 430619.6078 -129000.0 -0.6 606166.6667 15000.0 0.08 -0.3657 -0.6074 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I21 mock treatment 496515.748 -63500.0 -0.29 615618.6047 24500.0 0.13 -0.1153 -0.3601 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I22 mock treatment 534008.8496 -26000.0 -0.12 613868.6441 22700.0 0.12 4.0E-4 0.0022 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I23 mock treatment 625270.8333 65300.0 0.3 516067.4157 -75100.0 -0.4 -0.0688 -0.1379 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base I24 mock treatment 631238.806 71200.0 0.33 596984.1897 5820.0 0.03 0.2541 0.7702 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J01 mock treatment 773720.5882 214000.0 0.99 671475.4098 80300.0 0.43 0.9981 0.9296 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J02 mock treatment 596048.3092 36000.0 0.17 607774.7748 16600.0 0.09 0.1798 0.9559 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J03 mock treatment 609830.5085 49800.0 0.23 588315.7895 -2850.0 -0.02 0.1518 0.6592 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J04 mock treatment 538486.7257 -21500.0 -0.1 652640.0 61500.0 0.33 0.1604 0.4706 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J05 mock treatment 539845.4936 -20200.0 -0.09 564524.8619 -26600.0 -0.14 -0.1657 -0.9794 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J06 mock treatment 745477.2727 185000.0 0.86 604515.0215 13400.0 0.07 0.6549 0.763 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J07 mock treatment 494145.2991 -65900.0 -0.3 535711.5385 -55500.0 -0.29 -0.4227 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J08 mock treatment 543090.1639 -16900.0 -0.08 525836.8421 -65300.0 -0.35 -0.3002 -0.8452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J09 mock treatment 509109.7046 -50900.0 -0.23 505442.3963 -85700.0 -0.45 -0.4875 -0.9527 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J10 mock treatment 615910.4478 55900.0 0.26 685189.7436 94000.0 0.5 0.5349 0.9529 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J11 mock treatment 509195.4545 -50800.0 -0.23 551094.2408 -40100.0 -0.21 -0.316 -0.9988 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J12 mock treatment 473219.4093 -86800.0 -0.4 525563.3803 -65600.0 -0.35 -0.529 -0.9976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J13 mock treatment 519995.3488 -40000.0 -0.18 646035.4331 54900.0 0.29 0.0753 0.2186 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J14 mock treatment 470060.0858 -89900.0 -0.41 506230.7692 -84900.0 -0.45 -0.6118 -0.9992 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J15 mock treatment 451360.9756 -109000.0 -0.5 534104.4776 -57100.0 -0.3 -0.5683 -0.9709 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J16 mock treatment 527132.2314 -32900.0 -0.15 493889.7959 -97300.0 -0.52 -0.472 -0.8778 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J17 mock treatment 471259.9119 -88700.0 -0.41 587267.1756 -3900.0 -0.02 -0.304 -0.7419 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J18 mock treatment 557219.0813 -2790.0 -0.01 598406.3927 7240.0 0.04 0.0181 0.4462 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J19 mock treatment 579102.5641 19100.0 0.09 472522.6131 -119000.0 -0.63 -0.3827 -0.6023 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J20 mock treatment 521923.6364 -38100.0 -0.18 525008.2305 -66200.0 -0.35 -0.3723 -0.9488 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J21 mock treatment 601364.2384 41400.0 0.19 608702.7027 17500.0 0.09 0.2006 0.9455 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J22 mock treatment 496217.9931 -63800.0 -0.29 509766.2338 -81400.0 -0.43 -0.5133 -0.9825 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J23 mock treatment 547408.2569 -12600.0 -0.06 506373.913 -84800.0 -0.45 -0.3591 -0.7919 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base J24 mock treatment 493567.6692 -66400.0 -0.31 544535.7143 -46600.0 -0.25 -0.3915 -0.9944 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K01 mock treatment 585709.9567 25700.0 0.12 602697.9167 11500.0 0.06 0.1271 0.9527 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K02 mock treatment 528272.7273 -31700.0 -0.15 651838.565 60700.0 0.32 0.1241 0.351 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K03 mock treatment 559159.4828 -847.0 0.0 680385.0 89200.0 0.47 0.3319 0.7012 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K04 mock treatment 667671.9368 108000.0 0.5 622171.5686 31000.0 0.16 0.4674 0.8936 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K05 mock treatment 606239.4958 46200.0 0.21 649892.6554 58700.0 0.31 0.371 0.9829 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K06 mock treatment 574637.9928 14600.0 0.07 734956.7308 144000.0 0.76 0.587 0.7667 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K07 mock treatment 513816.0 -46200.0 -0.21 786497.8166 195000.0 1.04 0.582 0.5502 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K08 mock treatment 513324.3243 -46700.0 -0.22 751128.4916 160000.0 0.85 0.4477 0.5115 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K09 mock treatment 604215.4696 44200.0 0.2 717974.7475 127000.0 0.67 0.6198 0.8818 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K10 mock treatment 575449.1228 15400.0 0.07 703973.4043 113000.0 0.6 0.4734 0.7857 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K11 mock treatment 685432.9502 125000.0 0.58 697596.2441 106000.0 0.56 0.8082 0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K12 mock treatment 592618.2573 32600.0 0.15 723943.5897 133000.0 0.7 0.6043 0.8392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K13 mock treatment 603756.4103 43700.0 0.2 601773.399 10600.0 0.06 0.1825 0.8711 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K14 mock treatment 573789.9543 13800.0 0.06 690261.6822 99100.0 0.53 0.4166 0.7869 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K15 mock treatment 536276.9231 -23700.0 -0.11 633752.7473 42600.0 0.23 0.0823 0.3281 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K16 mock treatment 533106.4639 -26900.0 -0.12 544373.6842 -46800.0 -0.25 -0.2632 -0.9486 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K17 mock treatment 471228.4264 -88800.0 -0.41 575137.4408 -16000.0 -0.09 -0.3496 -0.8361 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K18 mock treatment 488024.3902 -72000.0 -0.33 563079.3651 -28100.0 -0.15 -0.3401 -0.9346 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K19 mock treatment 464904.059 -95100.0 -0.44 506888.0 -84300.0 -0.45 -0.6262 -1.0 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K20 mock treatment 521568.0272 -38400.0 -0.18 538463.9175 -52700.0 -0.28 -0.323 -0.9758 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K21 mock treatment 487909.0909 -72100.0 -0.33 606994.0828 15800.0 0.08 -0.1757 -0.5125 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K22 mock treatment 545856.5217 -14100.0 -0.07 608234.0426 17100.0 0.09 0.0179 0.1602 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K23 mock treatment 667642.5339 108000.0 0.5 582672.5146 -8490.0 -0.05 0.3191 0.6403 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base K24 mock treatment 681494.0711 121000.0 0.56 588195.0 -2970.0 -0.02 0.385 0.687 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L01 mock treatment 757500.0 197000.0 0.91 717320.7547 126000.0 0.67 1.1172 0.9885 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L02 mock treatment 799514.7059 240000.0 1.1 663525.8216 72400.0 0.38 1.0524 0.9 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L03 mock treatment 895691.9831 336000.0 1.55 658145.9459 67000.0 0.36 1.3459 0.8474 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L04 mock treatment 623016.0 63000.0 0.29 766349.7537 175000.0 0.93 0.8625 0.8859 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L05 mock treatment 699134.1991 139000.0 0.64 704132.2751 113000.0 0.6 0.8774 0.9994 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L06 mock treatment 703130.6306 143000.0 0.66 689071.4286 97900.0 0.52 0.8339 0.993 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L07 mock treatment 633558.2524 73600.0 0.34 681031.4136 89900.0 0.48 0.5769 0.9861 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L08 mock treatment 729935.0 170000.0 0.78 794449.1979 203000.0 1.08 1.3165 0.9877 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L09 mock treatment 664132.7434 104000.0 0.48 658045.8333 66900.0 0.35 0.5904 0.9889 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L10 mock treatment 656152.0 96100.0 0.44 758369.3694 167000.0 0.89 0.9406 0.9487 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L11 mock treatment 570571.4286 10600.0 0.05 834529.703 243000.0 1.29 0.9472 0.7333 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L12 mock treatment 725510.4603 166000.0 0.76 663490.566 72300.0 0.38 0.811 0.9493 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L13 mock treatment 743916.3347 184000.0 0.85 754808.5106 164000.0 0.87 1.2135 0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L14 mock treatment 628829.2683 68800.0 0.32 676381.9095 85200.0 0.45 0.544 0.985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L15 mock treatment 619606.0606 59600.0 0.27 726675.2577 136000.0 0.72 0.7026 0.913 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L16 mock treatment 564050.9804 4040.0 0.02 641360.9756 50200.0 0.27 0.2015 0.7548 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L17 mock treatment 637662.5 77700.0 0.36 594306.2201 3140.0 0.02 0.265 0.7392 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L18 mock treatment 548522.3368 -11500.0 -0.05 725033.4928 134000.0 0.71 0.4646 0.6526 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L19 mock treatment 532779.2208 -27200.0 -0.13 557838.8626 -33300.0 -0.18 -0.2138 -0.986 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L20 mock treatment 585759.4937 25800.0 0.12 709199.187 118000.0 0.63 0.5267 0.8265 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L21 mock treatment 540919.3548 -19100.0 -0.09 657900.369 66700.0 0.35 0.1881 0.5156 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L22 mock treatment 555429.1339 -4580.0 -0.02 504227.2727 -86900.0 -0.46 -0.341 -0.7387 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L23 mock treatment 606702.0408 46700.0 0.22 553780.4878 -37400.0 -0.2 0.0121 0.0412 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base L24 mock treatment 620855.9671 60800.0 0.28 578733.3333 -12400.0 -0.07 0.1518 0.5266 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M01 mock treatment 539939.3939 -20100.0 -0.09 592441.9643 1280.0 0.01 -0.0606 -0.6536 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M02 mock treatment 574462.963 14500.0 0.07 597389.4231 6230.0 0.03 0.0705 0.9475 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M03 mock treatment 502573.1707 -57400.0 -0.26 771880.531 181000.0 0.96 0.4905 0.4932 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M04 mock treatment 676044.4444 116000.0 0.54 627411.5044 36200.0 0.19 0.5143 0.9045 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M05 mock treatment 481110.5991 -78900.0 -0.36 574307.2917 -16900.0 -0.09 -0.3205 -0.8554 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M06 mock treatment 436000.0 -124000.0 -0.57 578213.4831 -13000.0 -0.07 -0.4529 -0.7864 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M07 mock treatment 592691.4498 32700.0 0.15 549438.8889 -41700.0 -0.22 -0.0499 -0.1864 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M08 mock treatment 617467.6806 57500.0 0.26 794369.6498 203000.0 1.08 0.9495 0.8555 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M09 mock treatment 472639.6761 -87400.0 -0.4 759574.8988 168000.0 0.89 0.3467 0.3538 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M10 mock treatment 487581.6733 -72400.0 -0.33 560534.2466 -30600.0 -0.16 -0.351 -0.9452 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M11 mock treatment 475628.7879 -84400.0 -0.39 533481.3278 -57700.0 -0.31 -0.4915 -0.9929 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M12 mock treatment 509176.9547 -50800.0 -0.23 564136.5639 -27000.0 -0.14 -0.2671 -0.9722 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M13 mock treatment 505547.9876 -54500.0 -0.25 586776.4706 -4390.0 -0.02 -0.194 -0.7693 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M14 mock treatment 471400.0 -88600.0 -0.41 566050.0 -25100.0 -0.13 -0.3831 -0.8914 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M15 mock treatment 546539.0625 -13500.0 -0.06 575372.093 -15800.0 -0.08 -0.1031 -0.9892 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M16 mock treatment 525332.0611 -34700.0 -0.16 556707.9646 -34500.0 -0.18 -0.2423 -0.9978 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M17 mock treatment 445012.5392 -115000.0 -0.53 548362.7907 -42800.0 -0.23 -0.5355 -0.9283 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M18 mock treatment 537934.7826 -22100.0 -0.1 561626.943 -29500.0 -0.16 -0.1828 -0.9782 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M19 mock treatment 538438.4615 -21600.0 -0.1 537776.699 -53400.0 -0.28 -0.2706 -0.9015 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M20 mock treatment 494264.4068 -65700.0 -0.3 532507.2464 -58700.0 -0.31 -0.4344 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M21 mock treatment 548971.8876 -11000.0 -0.05 501207.6271 -90000.0 -0.48 -0.3734 -0.7781 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M22 mock treatment 491693.4866 -68300.0 -0.32 517387.7551 -73800.0 -0.39 -0.4995 -0.9942 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M23 mock treatment 557953.1915 -2050.0 -0.01 506000.0 -85200.0 -0.45 -0.3261 -0.7218 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base M24 mock treatment 593838.843 33800.0 0.16 464566.6667 -127000.0 -0.67 -0.3645 -0.5287 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N01 mock treatment 861309.2784 301000.0 1.39 657839.8058 66700.0 0.35 1.2326 0.8597 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N02 mock treatment 824257.7778 264000.0 1.22 642145.7286 51000.0 0.27 1.0529 0.8435 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N03 mock treatment 662963.8009 103000.0 0.47 631911.215 40700.0 0.22 0.4886 0.9365 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N04 mock treatment 657013.5747 97000.0 0.45 564534.188 -26600.0 -0.14 0.2165 0.4614 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N05 mock treatment 648282.0513 88300.0 0.41 550917.0507 -40200.0 -0.21 0.1369 0.2979 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N06 mock treatment 663510.6383 104000.0 0.48 581069.3069 -10100.0 -0.05 0.2997 0.6239 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N07 mock treatment 547323.1441 -12700.0 -0.06 574167.5393 -17000.0 -0.09 -0.1051 -0.9781 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N08 mock treatment 718721.9512 159000.0 0.73 624017.2414 32900.0 0.17 0.6408 0.8516 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N09 mock treatment 666293.3884 106000.0 0.49 593547.9452 2380.0 0.01 0.3555 0.7251 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N10 mock treatment 647534.1365 87500.0 0.4 597892.0188 6730.0 0.04 0.3107 0.7666 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N11 mock treatment 747835.8209 188000.0 0.87 555946.281 -35200.0 -0.19 0.4804 0.5422 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N12 mock treatment 628670.3704 68700.0 0.32 556452.8302 -34700.0 -0.18 0.0937 0.2559 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N13 mock treatment 628494.2529 68500.0 0.32 574260.0897 -16900.0 -0.09 0.1599 0.4871 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N14 mock treatment 577061.9835 17100.0 0.08 538327.1889 -52800.0 -0.28 -0.1425 -0.4897 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N15 mock treatment 588523.9617 28500.0 0.13 563500.0 -27700.0 -0.15 -0.0108 -0.0546 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N16 mock treatment 505119.5219 -54900.0 -0.25 581378.2609 -9790.0 -0.05 -0.2157 -0.8347 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N17 mock treatment 568554.5455 8550.0 0.04 529517.2414 -61600.0 -0.33 -0.2033 -0.6174 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N18 mock treatment 564221.3439 4210.0 0.02 522827.7512 -68300.0 -0.36 -0.2425 -0.6682 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N19 mock treatment 615136.0 55100.0 0.25 538034.2205 -53100.0 -0.28 -0.0195 -0.0514 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N20 mock treatment 484660.0 -75300.0 -0.35 632707.4236 41500.0 0.22 -0.0899 -0.2185 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N21 mock treatment 560691.4894 685.0 0.0 549614.8148 -41500.0 -0.22 -0.1536 -0.6969 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N22 mock treatment 553940.7115 -6070.0 -0.03 592904.9296 1740.0 0.01 -0.0133 -0.4498 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N23 mock treatment 529329.9492 -30700.0 -0.14 501108.9109 -90100.0 -0.48 -0.4378 -0.8788 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base N24 mock treatment 524504.3478 -35500.0 -0.16 437428.5714 -154000.0 -0.82 -0.6924 -0.8325 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O01 mock treatment 503170.7317 -56800.0 -0.26 497775.7009 -93400.0 -0.5 -0.5356 -0.9557 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O02 mock treatment 500634.5382 -59400.0 -0.27 569411.7647 -21800.0 -0.12 -0.2752 -0.9262 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O03 mock treatment 666632.0346 107000.0 0.49 581805.0847 -9360.0 -0.05 0.3126 0.6325 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O04 mock treatment 659886.5979 99900.0 0.46 538464.455 -52700.0 -0.28 0.1281 0.2377 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O05 mock treatment 767334.7458 207000.0 0.96 583777.7778 -7390.0 -0.04 0.6484 0.6776 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O06 mock treatment 616452.9148 56400.0 0.26 545401.5748 -45800.0 -0.24 0.0124 0.0349 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O07 mock treatment 523158.9958 -36800.0 -0.17 541612.3348 -49600.0 -0.26 -0.306 -0.9777 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O08 mock treatment 589247.8992 29200.0 0.13 606995.6332 15800.0 0.08 0.1547 0.974 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O09 mock treatment 643147.619 83100.0 0.38 601197.6744 10000.0 0.05 0.3087 0.7976 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O10 mock treatment 603942.0849 43900.0 0.2 541301.0204 -49900.0 -0.26 -0.0437 -0.1313 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O11 mock treatment 666735.2941 107000.0 0.49 542597.561 -48600.0 -0.26 0.1659 0.2986 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O12 mock treatment 576649.5726 16600.0 0.08 550987.8543 -40200.0 -0.21 -0.0964 -0.4257 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O13 mock treatment 599802.6316 39800.0 0.18 597028.169 5860.0 0.03 0.1518 0.8153 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O14 mock treatment 590364.9635 30400.0 0.14 540448.8189 -50700.0 -0.27 -0.0912 -0.3008 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O15 mock treatment 573981.8182 14000.0 0.06 477911.33 -113000.0 -0.6 -0.3792 -0.6276 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O16 mock treatment 600277.9923 40300.0 0.19 505227.4368 -85900.0 -0.46 -0.191 -0.388 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O17 mock treatment 499342.9603 -60700.0 -0.28 490476.0 -101000.0 -0.53 -0.5754 -0.9545 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O18 mock treatment 563264.7059 3260.0 0.02 508069.3069 -83100.0 -0.44 -0.301 -0.6826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O19 mock treatment 460138.1579 -99900.0 -0.46 489474.7899 -102000.0 -0.54 -0.707 -0.9969 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O20 mock treatment 624626.0163 64600.0 0.3 500529.703 -90600.0 -0.48 -0.1292 -0.2284 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O21 mock treatment 514027.5862 -46000.0 -0.21 546191.3357 -45000.0 -0.24 -0.3186 -0.9983 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O22 mock treatment 482488.2155 -77500.0 -0.36 589050.4202 -2110.0 -0.01 -0.2607 -0.7289 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O23 mock treatment 528397.1631 -31600.0 -0.15 483704.1667 -107000.0 -0.57 -0.5061 -0.8603 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base O24 mock treatment 525050.9804 -35000.0 -0.16 566377.4319 -24800.0 -0.13 -0.2069 -0.9949 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P01 mock treatment 584512.5628 24500.0 0.11 547082.2511 -44100.0 -0.23 -0.0854 -0.3289 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P02 mock treatment 573533.3333 13500.0 0.06 587632.0755 -3530.0 -0.02 0.0309 0.4738 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P03 mock treatment 606618.3575 46600.0 0.21 594303.7975 3140.0 0.02 0.1638 0.7596 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P04 mock treatment 644336.4929 84300.0 0.39 568040.3587 -23100.0 -0.12 0.1883 0.4617 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P05 mock treatment 594023.2558 34000.0 0.16 501220.6573 -89900.0 -0.48 -0.2264 -0.4508 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P06 mock treatment 571746.0317 11700.0 0.05 514524.5098 -76600.0 -0.41 -0.2492 -0.6076 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P07 mock treatment 576905.1724 16900.0 0.08 514123.2227 -77000.0 -0.41 -0.2338 -0.5621 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P08 mock treatment 511908.6957 -48100.0 -0.22 527493.617 -63700.0 -0.34 -0.3956 -0.9792 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P09 mock treatment 727069.7674 167000.0 0.77 583942.1488 -7220.0 -0.04 0.5177 0.6711 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P10 mock treatment 536991.5254 -23000.0 -0.11 490357.1429 -101000.0 -0.53 -0.4531 -0.8313 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P11 mock treatment 677866.9355 118000.0 0.54 534367.9654 -56800.0 -0.3 0.1713 0.2757 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P12 mock treatment 541032.1101 -19000.0 -0.09 537074.5614 -54100.0 -0.29 -0.2647 -0.8826 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P13 mock treatment 657597.0149 97600.0 0.45 628188.0 37000.0 0.2 0.4571 0.9309 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P14 mock treatment 562795.9184 2790.0 0.01 476078.2609 -115000.0 -0.61 -0.4225 -0.6921 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P15 mock treatment 665139.6226 105000.0 0.48 511744.856 -79400.0 -0.42 0.045 0.07 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P16 mock treatment 550640.0 -9370.0 -0.04 498837.7193 -92300.0 -0.49 -0.3768 -0.7665 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P17 mock treatment 519698.1132 -40300.0 -0.19 483735.5372 -107000.0 -0.57 -0.5344 -0.8915 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P18 mock treatment 535013.9373 -25000.0 -0.12 530366.0714 -60800.0 -0.32 -0.3095 -0.9038 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P19 mock treatment 447293.9189 -113000.0 -0.52 490308.5502 -101000.0 -0.53 -0.7458 -0.9999 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P20 mock treatment 452077.4648 -108000.0 -0.5 457456.0 -134000.0 -0.71 -0.8534 -0.985 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P21 mock treatment 471108.0 -88900.0 -0.41 473387.0968 -118000.0 -0.62 -0.7316 -0.9791 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P22 mock treatment 510328.7671 -49700.0 -0.23 537988.3721 -53200.0 -0.28 -0.3614 -0.9947 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P23 mock treatment 452342.8571 -108000.0 -0.5 438543.6242 -153000.0 -0.81 -0.9235 -0.9725 1063.0015 Calc(E1/E2)(1063.0015) SigBInhibition 1063.0015.Base P24 mock treatment 591404.4444 31400.0 0.14 486279.7203 -105000.0 -0.56 -0.291 -0.5062