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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A01 mock treatment 1111.0 71.333 0.0615 63.0 -12.97 -0.0105 0.0361 0.578 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A02 mock treatment 1561.0 521.33 0.4496 1.0 -74.97 -0.0607 0.275 0.6061 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A03 compound treatment 1785.0 745.33 0.6428 80.0 4.0303 0.0033 0.4569 0.7107 3076292 SMP2_000001 C[C@H](CCCC(C)(C)O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A04 compound treatment 1803.0 763.33 0.6583 46.0 -29.97 -0.0243 0.4484 0.6806 170 SMP2_000002 CCCCCCCC[C@@H](O)/C=C/C=C/C=C\[C@@H](O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A05 compound treatment 1754.0 714.33 0.6161 159.0 83.03 0.0673 0.4832 0.7797 3076293 SMP2_000003 CN(C)CC/C=C/1\c2ccccc2CC(O)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A06 compound treatment 914.0 -125.67 -0.1084 0.0 -75.97 -0.0615 -0.1202 -0.964 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A07 compound treatment 1673.0 633.33 0.5462 120.0 44.03 0.0357 0.4115 0.7517 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A08 compound treatment 1443.0 403.33 0.3479 122.0 46.03 0.0373 0.2723 0.7784 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A09 compound treatment 1384.0 344.33 0.297 346.0 270.03 0.2188 0.3647 0.9887 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A10 compound treatment 0.0 -1039.7 -0.8967 376.0 300.03 0.2431 -0.4622 -0.4975 3199281 SMP2_000008 CC(=C[C@@H](O)C1=C[C@@H](O)[C@@H]2O[C@@H]2C1=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A11 compound treatment 1607.0 567.33 0.4893 58.0 -17.97 -0.0146 0.3357 0.6858 1001979 SMP2_000009 NCCC[C@H](N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A12 compound treatment 2406.0 1366.3 1.1784 127.0 51.03 0.0413 0.8625 0.7315 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A13 compound treatment 2004.0 964.33 0.8317 53.0 -22.97 -0.0186 0.5749 0.6911 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A14 compound treatment 1619.0 579.33 0.4997 48.0 -27.97 -0.0227 0.3373 0.6743 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A15 compound treatment 1457.0 417.33 0.3599 33.0 -42.97 -0.0348 0.2299 0.6358 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A16 compound treatment 5.0 -1034.7 -0.8924 0.0 -75.97 -0.0615 -0.6745 -0.7541 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A17 compound treatment 1270.0 230.33 0.1987 52.0 -23.97 -0.0194 0.1267 0.635 706 SMP2_000015 Nc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A18 compound treatment 3.0 -1036.7 -0.8941 0.0 -75.97 -0.0615 -0.6757 -0.754 1098997 SMP2_000016 CCC1(O)C(=O)OCc2c1cc3-c4nc5ccccc5cc4Cn3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A19 compound treatment 1458.0 418.33 0.3608 43.0 -32.97 -0.0267 0.2362 0.653 1001956 SMP2_000017 CC(C)C1N(C)c2cccc3[nH]cc(CC(CO)NC1=O)c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A20 compound treatment 1329.0 289.33 0.2495 18.0 -57.97 -0.047 0.1432 0.5641 1912779 SMP2_000018 CC(NC(=O)c1ccccc1/N=C/c2c(O)ccc3ccccc23)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A21 compound treatment 1387.0 347.33 0.2996 24.0 -51.97 -0.0421 0.1821 0.6018 230 SMP2_000019 CCCCCC(=O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C\C=C/CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A22 compound treatment 6.0 -1033.7 -0.8915 0.0 -75.97 -0.0615 -0.6739 -0.7541 464 SMP2_000020 CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A23 compound treatment 561.0 -478.67 -0.4128 18.0 -57.97 -0.047 -0.3251 -0.7825 548 SMP2_000021 N[C@H]1C[C@H]([C@H](O)[C@@H]1O)n2cc(I)c3c(N)ncnc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 A24 compound treatment 1085.0 45.333 0.0391 12.0 -63.97 -0.0518 -0.009 -0.1386 3199284 SMP2_000022 C/C(=C/CNc1ncnc2[nH]cnc12)/CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B01 mock treatment 774.0 -265.67 -0.2291 5.0 -70.97 -0.0575 -0.2027 -0.8579 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B02 mock treatment 1266.0 226.33 0.1952 31.0 -44.97 -0.0364 0.1123 0.5654 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B03 compound treatment 1254.0 214.33 0.1849 73.0 -2.9697 -0.0024 0.129 0.6978 1001866 SMP2_000023 NC(CCCNC(=N)N)C(=O)CC(Cc1ccccc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B04 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B05 compound treatment 633.0 -406.67 -0.3507 258.0 182.03 0.1475 -0.1437 -0.3778 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B06 compound treatment 1935.0 895.33 0.7722 120.0 44.03 0.0357 0.5712 0.739 3076300 SMP2_000026 CC1(C)C(O)C2(C)CCC1C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B07 compound treatment 2185.0 1145.3 0.9878 140.0 64.03 0.0519 0.7352 0.7432 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B08 compound treatment 1848.0 808.33 0.6972 98.0 22.03 0.0178 0.5056 0.725 3076301 SMP2_000028 Cn1cc(C[C@@H](N)C(=O)O)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B09 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B10 compound treatment 367.0 -672.67 -0.5801 75.0 -0.9697 -8.0E-4 -0.4108 -0.7081 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B11 compound treatment 1883.0 843.33 0.7273 30.0 -45.97 -0.0372 0.488 0.67 2006 SMP2_000031 O[C@H]1C2OC2[C@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B12 compound treatment 2649.0 1609.3 1.388 85.0 9.0303 0.0073 0.9866 0.7108 3076303 SMP2_000032 CN(C)c1nc2c(Br)c(Br)c(Br)c(Br)c2[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B13 compound treatment 0.0 -1039.7 -0.8967 7.0 -68.97 -0.0559 -0.6735 -0.7497 3076304 SMP2_000033 CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C/2\C(=O)Nc3ccc(Cl)cc23)c1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B14 compound treatment 1729.0 689.33 0.5945 132.0 56.03 0.0454 0.4525 0.7589 1000114 SMP2_000034 CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B15 compound treatment 1654.0 614.33 0.5298 8.0 -67.97 -0.0551 0.3357 0.6302 277 SMP2_000035 OC[C@H]1O[C@H]([C@H](O)[C@H]1O)n2cnc3cc(Cl)c(Cl)cc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B16 compound treatment 1685.0 645.33 0.5566 12.0 -63.97 -0.0518 0.3569 0.6385 3076306 SMP2_000036 CC(=O)c1ccc(cc1O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B17 compound treatment 1457.0 417.33 0.3599 32.0 -43.97 -0.0356 0.2293 0.634 2095622 SMP2_000037 CC(=CCC/C(=C/CC/C(=C/Cc1c(O)c2ccccc2oc1=O)/C)/C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B18 compound treatment 977.0 -62.667 -0.054 47.0 -28.97 -0.0235 -0.0548 -0.9302 1670 SMP2_000038 Nc1nc2n(COC(CO)CO)cnc2c(=O)[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B19 compound treatment 1088.0 48.333 0.0417 32.0 -43.97 -0.0356 0.0043 0.0782 2090 SMP2_000039 CCOC(=O)C(C#N)C1C(=C(N)Oc2ccc(Br)cc12)C(=O)OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B20 compound treatment 88.0 -951.67 -0.8208 0.0 -75.97 -0.0615 -0.6239 -0.758 1096696 SMP2_000040 Oc1ccc(cc1CC=C)c2cc(CC=C)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B21 compound treatment 1738.0 698.33 0.6023 35.0 -40.97 -0.0332 0.4024 0.6671 3199380 SMP2_000041 NC1=NC(=O)/C(=C\2/CCNC(=O)c3[nH]c(Br)cc23)/N1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B22 compound treatment 18.0 -1021.7 -0.8811 2.0 -73.97 -0.0599 -0.6654 -0.7535 2137 SMP2_000042 Oc1cc(O)c2c(=O)cc(oc2c1)c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B23 compound treatment 85.0 -954.67 -0.8234 5.0 -70.97 -0.0575 -0.6229 -0.7546 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 B24 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 907437 SMP2_000044 CCCCCCCCCCCCC(=O)N1CCCCC1CNC(=O)[C@@H](N)CCCCN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C01 mock treatment 663.0 -376.67 -0.3249 48.0 -27.97 -0.0227 -0.2457 -0.7546 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C02 mock treatment 602.0 -437.67 -0.3775 20.0 -55.97 -0.0453 -0.299 -0.7864 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C03 compound treatment 413.0 -626.67 -0.5405 197.0 121.03 0.098 -0.3128 -0.5695 907417 SMP2_000045 COc1cc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3CCc2cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C04 compound treatment 807.0 -232.67 -0.2007 31.0 -44.97 -0.0364 -0.1677 -0.822 180 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C05 compound treatment 772.0 -267.67 -0.2309 88.0 12.03 0.0097 -0.1563 -0.6767 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C06 compound treatment 27.0 -1012.7 -0.8734 180.0 104.03 0.0843 -0.558 -0.6359 3104900 SMP2_000048 C/C(=C\CCC1C=CC(OC1O)C2=CC(=O)OC2O)/CCC3=C(C)CCCC3(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C07 compound treatment 900.0 -139.67 -0.1205 312.0 236.03 0.1912 0.05 0.2214 907313 SMP2_000049 Oc1c(I)cc2c(Oc3c(I)c(O)c(I)cc3C42OC(=O)c5ccccc54)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C08 compound treatment 1115.0 75.333 0.065 75.0 -0.9697 -8.0E-4 0.0454 0.6985 3076308 SMP2_000050 CCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)CCCCCCCCCCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C09 compound treatment 1104.0 64.333 0.0555 174.0 98.03 0.0794 0.0954 0.9846 1002910 SMP2_000051 OC(C(O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C10 compound treatment 965.0 -74.667 -0.0644 42.0 -33.97 -0.0275 -0.065 -0.9281 453 SMP2_000052 COc1cccc(c1N)c2cc(=O)c3ccccc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C11 compound treatment 528.0 -511.67 -0.4413 101.0 25.03 0.0203 -0.2977 -0.6739 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C12 compound treatment 1258.0 218.33 0.1883 6.0 -69.97 -0.0567 0.0931 0.4733 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C13 compound treatment 1609.0 569.33 0.491 161.0 85.03 0.0689 0.3959 0.7985 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C14 compound treatment 1314.0 274.33 0.2366 43.0 -32.97 -0.0267 0.1484 0.6233 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C15 compound treatment 2.0 -1037.7 -0.8949 0.0 -75.97 -0.0615 -0.6763 -0.754 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C16 compound treatment 983.0 -56.667 -0.0489 53.0 -22.97 -0.0186 -0.0477 -0.9124 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C17 compound treatment 1173.0 133.33 0.115 91.0 15.03 0.0122 0.0899 0.7776 1448 SMP2_000059 OC(=O)c1cc(N=Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C18 compound treatment 289.0 -750.67 -0.6474 27.0 -48.97 -0.0397 -0.4858 -0.749 31 SMP2_000060 CCCCCCCCCCCCCCC[C@H](O)[C@@H](N)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C19 compound treatment 869.0 -170.67 -0.1472 49.0 -26.97 -0.0218 -0.1195 -0.8033 95 SMP2_000061 CCCCCC(O)/C=C/C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C20 compound treatment 4.0 -1035.7 -0.8932 0.0 -75.97 -0.0615 -0.6751 -0.754 2065223 SMP2_000062 CN(C)c1ccc(cc1)C(O)(c2ccccc2)c3ccc(cc3)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C21 compound treatment 2.0 -1037.7 -0.8949 47.0 -28.97 -0.0235 -0.6494 -0.7254 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C22 compound treatment 765.0 -274.67 -0.2369 20.0 -55.97 -0.0453 -0.1996 -0.8274 2041 SMP2_000064 OC(=O)CNC(=O)C(CS)Cc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C23 compound treatment 917.0 -122.67 -0.1058 38.0 -37.97 -0.0308 -0.0966 -0.8764 3076311 SMP2_000065 COc1cc2ccnc3cc[nH]c(c1OC)c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 C24 compound treatment 583.0 -456.67 -0.3939 10.0 -65.97 -0.0534 -0.3163 -0.7958 907566 SMP2_000066 C/C(=C\CNc1ncnc2n(cnc12)C3OC(CO)[C@@H](O)[C@H]3O)/CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D01 mock treatment 890.0 -149.67 -0.1291 11.0 -64.97 -0.0526 -0.1285 -0.9217 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D02 mock treatment 967.0 -72.667 -0.0627 48.0 -27.97 -0.0227 -0.0603 -0.9054 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D03 compound treatment 2.0 -1037.7 -0.8949 0.0 -75.97 -0.0615 -0.6763 -0.754 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D04 compound treatment 566.0 -473.67 -0.4085 44.0 -31.97 -0.0259 -0.3072 -0.7504 907555 SMP2_000068 CC1=C[C@H]2O[C@@H]3C[C@@H](O)C(C)(C43CO4)[C@@]2(CO)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D05 compound treatment 87.0 -952.67 -0.8216 11.0 -64.97 -0.0526 -0.6182 -0.7509 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D06 compound treatment 1456.0 416.33 0.3591 93.0 17.03 0.0138 0.2637 0.7337 852250 SMP2_000070 C1CCC(NC1)c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D07 compound treatment 1996.0 956.33 0.8248 181.0 105.03 0.0851 0.6434 0.7759 3076314 SMP2_000071 O[C@@H]1C=CC(Br)[C@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D08 compound treatment 11.0 -1028.7 -0.8872 76.0 0.030303 0.0 -0.6273 -0.7071 3076315 SMP2_000072 OC[C@H]1O[C@H](C[C@@H]1O)n2cc(I)c(O)nc2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D09 compound treatment 1952.0 912.33 0.7868 55.0 -20.97 -0.017 0.5444 0.6917 3199389 SMP2_000073 CCCCCCCc1c(C)c(O)cc2c3ccccc3[nH]c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D10 compound treatment 1640.0 600.33 0.5178 70.0 -5.9697 -0.0048 0.3627 0.7005 3199390 SMP2_000074 COc1ccc(cc1)C(O)(C2CC2)c3cncnc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D11 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D12 compound treatment 1593.0 553.33 0.4772 39.0 -36.97 -0.0299 0.3163 0.6614 2085117 SMP2_000076 COc1ccc(OC)c2c(=S)c3ccccc3[nH]c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D13 compound treatment 1532.0 492.33 0.4246 183.0 107.03 0.0867 0.3616 0.8343 251 SMP2_000077 Nc1ncnc2n(cnc12)C3(CO)OC(=C)C(O)C3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D14 compound treatment 1406.0 366.33 0.3159 105.0 29.03 0.0235 0.24 0.7576 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D15 compound treatment 1964.0 924.33 0.7972 155.0 79.03 0.064 0.609 0.7614 751 SMP2_000079 COc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D16 compound treatment 5.0 -1034.7 -0.8924 0.0 -75.97 -0.0615 -0.6745 -0.7541 3076316 SMP2_000080 Oc1cc(ccc1C(=O)c2ccccc2)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D17 compound treatment 605.0 -434.67 -0.3749 32.0 -43.97 -0.0356 -0.2903 -0.7708 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D18 compound treatment 1753.0 713.33 0.6152 68.0 -7.9697 -0.0065 0.4305 0.6996 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D19 compound treatment 1637.0 597.33 0.5152 174.0 98.03 0.0794 0.4204 0.8066 610 SMP2_000083 O=S(=O)(N1CCCNCC1)c2cccc3cnccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D20 compound treatment 1147.0 107.33 0.0926 45.0 -30.97 -0.0251 0.0477 0.4975 3076318 SMP2_000084 Oc1nccc2c(cccc12)S(=O)(=O)N3CCCNCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D21 compound treatment 1336.0 296.33 0.2556 30.0 -45.97 -0.0372 0.1544 0.5978 616 SMP2_000085 COc1cc(O)c2c(=O)c(OC)c3CC(C)C(C(=O)C)c4c(OC)c(=O)c5c(O)cc(OC)c6c1c2c3c4c56 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D22 compound treatment 187.0 -852.67 -0.7354 5.0 -70.97 -0.0575 -0.5607 -0.7601 1096695 SMP2_000086 Oc1ccc(CC=C)cc1c2cc(CC=C)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D23 compound treatment 446.0 -593.67 -0.512 24.0 -51.97 -0.0421 -0.3918 -0.7627 3176136 SMP2_000087 C[C@@H]1C2NCC(C)C[C@H]2O[C@@]31CCC4C5CC=C6CC(O)CCC6(C)C5C(=O)C4=C3C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 D24 compound treatment 557.0 -482.67 -0.4163 4.0 -71.97 -0.0583 -0.3356 -0.7984 3076319 SMP2_000088 Nc1nc(OCC2CCCCC2)c3[nH]cnc3n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E01 mock treatment 927.0 -112.67 -0.0972 46.0 -29.97 -0.0243 -0.0859 -0.8574 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E02 mock treatment 1132.0 92.333 0.0796 29.0 -46.97 -0.0381 0.0294 0.3332 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E03 compound treatment 1261.0 221.33 0.1909 72.0 -3.9697 -0.0032 0.1327 0.6951 445 SMP2_000089 NC(=O)c1cccc(N)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E04 compound treatment 811.0 -228.67 -0.1972 87.0 11.03 0.0089 -0.1331 -0.6744 1057045 SMP2_000090 COC(=O)c1ccc(O)c2nc3c(C=O)c(O)cc(O)c3nc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E05 compound treatment 819.0 -220.67 -0.1903 29.0 -46.97 -0.0381 -0.1615 -0.832 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E06 compound treatment 476.0 -563.67 -0.4861 97.0 21.03 0.017 -0.3317 -0.6819 2180 SMP2_000092 COc1ccc(CNc2nc(NCc3ccc(OC)cc3)c4ncn(C(C)C)c4n2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E07 compound treatment 256.0 -783.67 -0.6759 71.0 -4.9697 -0.004 -0.4808 -0.7113 1020463 SMP2_000093 Oc1cc2ccc(=O)oc2cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E08 compound treatment 1898.0 858.33 0.7403 12.0 -63.97 -0.0518 0.4868 0.656 3076699 SMP2_000094 CN1CCC[C@H]1CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E09 compound treatment 4.0 -1035.7 -0.8932 1.0 -74.97 -0.0607 -0.6745 -0.7534 1694 SMP2_000095 Oc1ccc(cc1)c2sc3cc(O)ccc3c2C(=O)c4ccc(OCCN5CCCCC5)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E10 compound treatment 1.0 -1038.7 -0.8958 0.0 -75.97 -0.0615 -0.6769 -0.7539 2345 SMP2_000096 Nc1ncnc2n(ccc12)[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E11 compound treatment 2072.0 1032.3 0.8903 120.0 44.03 0.0357 0.6548 0.7348 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E12 compound treatment 2195.0 1155.3 0.9964 96.0 20.03 0.0162 0.7161 0.7185 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E13 compound treatment 1955.0 915.33 0.7894 204.0 128.03 0.1037 0.6316 0.7932 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E14 compound treatment 704.0 -335.67 -0.2895 52.0 -23.97 -0.0194 -0.2184 -0.7528 267 SMP2_000100 CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)C=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E15 compound treatment 1746.0 706.33 0.6092 99.0 23.03 0.0187 0.444 0.7284 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E16 compound treatment 1424.0 384.33 0.3315 61.0 -14.97 -0.0121 0.2258 0.6808 1000121 SMP2_000102 C/C(=C\CO)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E17 compound treatment 1339.0 299.33 0.2582 242.0 166.03 0.1345 0.2777 0.9538 1599897 SMP2_000103 O=c1n2CCc3c([nH]c4ccccc34)-c2nc5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E18 compound treatment 1326.0 286.33 0.247 27.0 -48.97 -0.0397 0.1466 0.586 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E19 compound treatment 1433.0 393.33 0.3392 18.0 -57.97 -0.047 0.2067 0.6035 1001870 SMP2_000105 C/C(=C/C(=O)O)/C=C/[C@@]1(O)C(=CC(=O)CC1(C)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E20 compound treatment 1180.0 140.33 0.121 88.0 12.03 0.0097 0.0925 0.7616 296 SMP2_000106 Nc1ncnc2N(=CNc21)C3CCCO3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E21 compound treatment 16.0 -1023.7 -0.8829 2.0 -73.97 -0.0599 -0.6667 -0.7534 600 SMP2_000107 COC(=O)/C=C/c1cc(O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E22 compound treatment 1.0 -1038.7 -0.8958 218.0 142.03 0.1151 -0.5521 -0.6113 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E23 compound treatment 1007.0 -32.667 -0.0282 14.0 -61.97 -0.0502 -0.0554 -0.9627 3076759 SMP2_000109 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)NC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 E24 compound treatment 566.0 -473.67 -0.4085 182.0 106.03 0.0859 -0.2281 -0.5465 3199491 SMP2_000110 C/C=C/C1OC2=C(C(=O)C[C@H](C)O2)C(=O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F01 mock treatment 919.0 -120.67 -0.1041 25.0 -50.97 -0.0413 -0.1028 -0.918 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F02 mock treatment 1156.0 116.33 0.1003 10.0 -65.97 -0.0534 0.0332 0.2917 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F03 compound treatment 758.0 -281.67 -0.2429 74.0 -1.9697 -0.0016 -0.1729 -0.7117 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F04 compound treatment 282.0 -757.67 -0.6535 16.0 -59.97 -0.0486 -0.4964 -0.7576 3076760 SMP2_000112 COc1cc(O)c2c3oc4cc(O)c(O)cc4c3c(=O)oc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F05 compound treatment 815.0 -224.67 -0.1938 178.0 102.03 0.0827 -0.0786 -0.373 328 SMP2_000113 C/C=C(/C)\C=C\1/CN=C2N(CCC2(O)C1=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F06 compound treatment 25.0 -1014.7 -0.8751 0.0 -75.97 -0.0615 -0.6623 -0.755 3076761 SMP2_000114 CNCC/C=C/1\c2ccccc2CC(O)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F07 compound treatment 1479.0 439.33 0.3789 95.0 19.03 0.0154 0.2788 0.7353 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F08 compound treatment 2.0 -1037.7 -0.8949 0.0 -75.97 -0.0615 -0.6763 -0.754 1046629 SMP2_000116 Nc1cc2c3ccccc3ccc2c4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F09 compound treatment 17.0 -1022.7 -0.882 1.0 -74.97 -0.0607 -0.6666 -0.754 1037664 SMP2_000117 CSCS(=O)CC(CO)NC(=O)C=Cc1c(C)nc(O)nc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F10 compound treatment 1894.0 854.33 0.7368 77.0 1.0303 8.0E-4 0.5216 0.7079 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F11 compound treatment 1912.0 872.33 0.7524 179.0 103.03 0.0835 0.591 0.7808 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F12 compound treatment 1.0 -1038.7 -0.8958 0.0 -75.97 -0.0615 -0.6769 -0.7539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F13 compound treatment 1377.0 337.33 0.2909 140.0 64.03 0.0519 0.2424 0.8202 745 SMP2_000121 CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F14 compound treatment 10.0 -1029.7 -0.888 8.0 -67.97 -0.0551 -0.6669 -0.7495 2008 SMP2_000122 CC1=C(SCCO)C(=O)c2ccccc2C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F15 compound treatment 1945.0 905.33 0.7808 139.0 63.03 0.0511 0.5882 0.7517 3199495 SMP2_000123 CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](N)COP(=O)(O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F16 compound treatment 1693.0 653.33 0.5635 163.0 87.03 0.0705 0.4483 0.7894 3076763 SMP2_000124 Oc1ccc2c(Oc3cc(O)ccc3C42OC(=O)c5ccc(Nc6nc(Cl)nc(Cl)n6)cc54)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F17 compound treatment 477.0 -562.67 -0.4853 401.0 325.03 0.2633 -0.157 -0.2843 1433 SMP2_000125 CS(=O)(=O)c1ccc(cc1)[C@@H](O)[C@@H](CO)NC(=O)C(Cl)Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F18 compound treatment 1834.0 794.33 0.6851 46.0 -29.97 -0.0243 0.4673 0.6816 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F19 compound treatment 3.0 -1036.7 -0.8941 2.0 -73.97 -0.0599 -0.6746 -0.7528 3000453 SMP2_000127 C[C@@H]1CC2OC(=O)C(=C)C2[C@H](O)[C@@]3(C)[C@H]1C=CC3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F20 compound treatment 1412.0 372.33 0.3211 5.0 -70.97 -0.0575 0.1864 0.5714 3060680 SMP2_000128 Oc1ccccc1N2CC=C(NC2=O)c3cccc(c3)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F21 compound treatment 1105.0 65.333 0.0563 585.0 509.03 0.4124 0.3314 0.7963 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F22 compound treatment 2.0 -1037.7 -0.8949 0.0 -75.97 -0.0615 -0.6763 -0.754 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F23 compound treatment 394.0 -645.67 -0.5569 10.0 -65.97 -0.0534 -0.4315 -0.7714 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 F24 compound treatment 653.0 -386.67 -0.3335 16.0 -59.97 -0.0486 -0.2702 -0.8017 288 SMP2_000132 C[C@@H]1Cc2c(Cl)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G01 mock treatment 788.0 -251.67 -0.2171 1.0 -74.97 -0.0607 -0.1964 -0.8715 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G02 mock treatment 1073.0 33.333 0.0287 30.0 -45.97 -0.0372 -0.006 -0.1276 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G03 compound treatment 262.0 -777.67 -0.6707 130.0 54.03 0.0438 -0.4433 -0.6596 2407 SMP2_000133 CN1C(=C(O)c2ccccc2S1(=O)=O)C(=O)Nc3ncc(C)s3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G04 compound treatment 207.0 -832.67 -0.7181 40.0 -35.97 -0.0291 -0.5284 -0.7352 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G05 compound treatment 974.0 -65.667 -0.0566 42.0 -33.97 -0.0275 -0.0595 -0.945 1978 SMP2_000135 OC(=O)/C=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G06 compound treatment 44.0 -995.67 -0.8587 0.0 -75.97 -0.0615 -0.6507 -0.7558 3076766 SMP2_000136 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)[N+](C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G07 compound treatment 1227.0 187.33 0.1616 111.0 35.03 0.0284 0.1343 0.8188 1117 SMP2_000137 Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)cnc2[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G08 compound treatment 1749.0 709.33 0.6118 103.0 27.03 0.0219 0.4481 0.7319 313 SMP2_000138 CCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=O)CCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G09 compound treatment 1779.0 739.33 0.6376 146.0 70.03 0.0567 0.491 0.767 3076819 SMP2_000139 COCC(=O)c1ncn-2c1[C@@H]3CCNC3C(=O)c4cc(OC)ccc42 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G10 compound treatment 1710.0 670.33 0.5781 235.0 159.03 0.1288 0.4999 0.844 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G11 compound treatment 2141.0 1101.3 0.9499 182.0 106.03 0.0859 0.7324 0.7679 939 SMP2_000141 Cc1cccc(Nc2ccccc2C(=O)O)c1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G12 compound treatment 1.0 -1038.7 -0.8958 0.0 -75.97 -0.0615 -0.6769 -0.7539 3076821 SMP2_000142 CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@@H](N)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G13 compound treatment 953.0 -86.667 -0.0747 158.0 82.03 0.0665 -0.0059 -0.0586 1012954 SMP2_000143 OC(Cc1ccncc1)C(Cl)(Cl)Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G14 compound treatment 1739.0 699.33 0.6031 40.0 -35.97 -0.0291 0.4059 0.6722 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G15 compound treatment 1079.0 39.333 0.0339 58.0 -17.97 -0.0146 0.0137 0.371 942 SMP2_000145 OC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G16 compound treatment 965.0 -74.667 -0.0644 80.0 4.0303 0.0033 -0.0432 -0.6704 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G17 compound treatment 185.0 -854.67 -0.7371 48.0 -27.97 -0.0227 -0.5372 -0.7285 1011013 SMP2_000147 Nc1ccc2nc3ccc(N)cc3[s+]c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G18 compound treatment 1223.0 183.33 0.1581 92.0 16.03 0.013 0.121 0.7626 3076824 SMP2_000148 NC(=O)OCC1N=C(N)N2CCC(O)(O)C32NC(=NC13)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G19 compound treatment 1284.0 244.33 0.2107 25.0 -50.97 -0.0413 0.1198 0.5579 3199593 SMP2_000149 COc1cc(ccc1O)[C@H]2Oc3cc(ccc3O[C@H]2CO)[C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G20 compound treatment 726.0 -313.67 -0.2705 20.0 -55.97 -0.0453 -0.2234 -0.8143 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G21 compound treatment 1697.0 657.33 0.5669 12.0 -63.97 -0.0518 0.3642 0.6398 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G22 compound treatment 936.0 -103.67 -0.0894 29.0 -46.97 -0.0381 -0.0901 -0.9275 3076825 SMP2_000152 NC(=O)C1CCCN1C(=O)C(Cc2c[nH]cn2)NC(=O)C3CCC(=O)N3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G23 compound treatment 8.0 -1031.7 -0.8898 10.0 -65.97 -0.0534 -0.667 -0.7482 1095351 SMP2_000153 COC1=C(Br)C(O)C(O)(CC#N)C=C1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 G24 compound treatment 73.0 -966.67 -0.8337 6.0 -69.97 -0.0567 -0.6296 -0.7534 3 SMP2_000154 Oc1ccc(/C=C(\C#N)/C(=O)NCc2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H01 mock treatment 1252.0 212.33 0.1831 31.0 -44.97 -0.0364 0.1037 0.5556 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H02 mock treatment 1359.0 319.33 0.2754 79.0 3.0303 0.0025 0.1965 0.7134 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H03 compound treatment 1170.0 130.33 0.1124 139.0 63.03 0.0511 0.1156 0.9362 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H04 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 1303231 SMP2_000156 CN(C)CC(O)Cn1c2ccc(Br)cc2c3cc(Br)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H05 compound treatment 529.0 -510.67 -0.4404 215.0 139.03 0.1126 -0.2318 -0.5099 3076826 SMP2_000157 Nc1ccccc1NC(=O)CCCCCCC(=O)Nc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H06 compound treatment 2219.0 1179.3 1.0171 94.0 18.03 0.0146 0.7295 0.7172 3076827 SMP2_000158 OC[C@H]1CC2CCN1CC2C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H07 compound treatment 2230.0 1190.3 1.0266 217.0 141.03 0.1143 0.8067 0.781 3199596 SMP2_000159 OC(=O)c1cc(/C=C/c2ccc(/C=C/c3ccc(O)c(c3)C(=O)O)c(Br)c2)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H08 compound treatment 74.0 -965.67 -0.8328 5.0 -70.97 -0.0575 -0.6296 -0.7541 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H09 compound treatment 2384.0 1344.3 1.1594 232.0 156.03 0.1264 0.9092 0.7796 3069011 SMP2_000161 NCCC(=O)NCCc1c[nH]cn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H10 compound treatment 2455.0 1415.3 1.2207 102.0 26.03 0.0211 0.8781 0.7192 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H11 compound treatment 1622.0 582.33 0.5022 205.0 129.03 0.1045 0.429 0.8364 1018447 SMP2_000163 Oc1ccc2c(c1)oc3c2c(=O)oc4cc(O)ccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H12 compound treatment 1515.0 475.33 0.41 129.0 53.03 0.043 0.3203 0.777 1000068 SMP2_000164 CC1=C(N2[C@H](SC1)C(NC(=O)C(N)c3ccccc3)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H13 compound treatment 844.0 -195.67 -0.1688 240.0 164.03 0.1329 -0.0254 -0.1181 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H14 compound treatment 0.0 -1039.7 -0.8967 4.0 -71.97 -0.0583 -0.6753 -0.7515 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H15 compound treatment 1565.0 525.33 0.4531 146.0 70.03 0.0567 0.3605 0.7895 907301 SMP2_000167 CCC(C)C(O)C(C)C(=O)C(C)/C=C(\C)/CC(C)C1OC(=O)C1CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H16 compound treatment 1874.0 834.33 0.7196 366.0 290.03 0.235 0.675 0.8917 3076266 SMP2_000168 CO[C@@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H17 compound treatment 2137.0 1097.3 0.9464 71.0 -4.9697 -0.004 0.6664 0.7041 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H18 compound treatment 4.0 -1035.7 -0.8932 4.0 -71.97 -0.0583 -0.6728 -0.7517 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H19 compound treatment 84.0 -955.67 -0.8242 21.0 -54.97 -0.0445 -0.6143 -0.7442 2334 SMP2_000171 C/C(=C\1/C(=O)NC(Cc2ccccc2)C1=O)/Nc3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H20 compound treatment 859.0 -180.67 -0.1558 29.0 -46.97 -0.0381 -0.1371 -0.8547 2109 SMP2_000172 OCc1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H21 compound treatment 1373.0 333.33 0.2875 24.0 -51.97 -0.0421 0.1735 0.5972 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H22 compound treatment 0.0 -1039.7 -0.8967 1.0 -74.97 -0.0607 -0.677 -0.7533 1260 SMP2_000174 N[C@@H](Cc1ccc(cc1)N(CCCl)CCCl)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H23 compound treatment 8.0 -1031.7 -0.8898 0.0 -75.97 -0.0615 -0.6727 -0.7542 3076270 SMP2_000175 C[C@]12C=Cc3occc3C2CC[C@]4(C[C@H]5CCC41)C[C@]5(O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 H24 compound treatment 800.0 -239.67 -0.2067 22.0 -53.97 -0.0437 -0.1771 -0.8381 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I01 mock treatment 1015.0 -24.667 -0.0213 37.0 -38.97 -0.0316 -0.0374 -0.9815 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I02 mock treatment 1101.0 61.333 0.0529 48.0 -27.97 -0.0227 0.0214 0.3716 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I03 compound treatment 1258.0 218.33 0.1883 254.0 178.03 0.1442 0.2351 0.9913 3076271 SMP2_000177 OC(=O)/C=C/c1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I04 compound treatment 7.0 -1032.7 -0.8906 10.0 -65.97 -0.0534 -0.6676 -0.7482 3199602 SMP2_000178 C/C(=C\CCC1=CC(=O)OC1O)/CC/C=C(\C)/CCC2=C(C)CCCC2(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I05 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 1135 SMP2_000179 OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I06 compound treatment 2437.0 1397.3 1.2051 114.0 38.03 0.0308 0.8739 0.7249 252 SMP2_000180 CCCCCCOC(=O)[C@]1(O)C[C@H]2O[C@@]1(C)n3c4ccccc4c5c6CNC(=O)c6c7c8ccccc8n2c7c35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I07 compound treatment 2297.0 1257.3 1.0844 114.0 38.03 0.0308 0.7886 0.7269 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I08 compound treatment 2014.0 974.33 0.8403 319.0 243.03 0.1969 0.7334 0.8498 3199603 SMP2_000182 CCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=O)CCCCCCCCCCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I09 compound treatment 2217.0 1177.3 1.0154 285.0 209.03 0.1693 0.8377 0.8138 2129 SMP2_000183 OCC(O)C1OC(=O)C(=C1O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I10 compound treatment 1976.0 936.33 0.8075 167.0 91.03 0.0737 0.6232 0.7685 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I11 compound treatment 328.0 -711.67 -0.6138 107.0 31.03 0.0251 -0.4162 -0.6776 1865 SMP2_000185 Clc1cccc(Nc2nnc(c3ccccc3)c4ccccc24)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I12 mock treatment 2465.0 1425.3 1.2293 91.0 15.03 0.0122 0.8779 0.7141 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I13 compound treatment 1545.0 505.33 0.4358 129.0 53.03 0.043 0.3386 0.7731 3472730 SMP2_000186 CC12CCC3C(CC=C4CC(O)CCC34C)C2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I14 compound treatment 2062.0 1022.3 0.8817 71.0 -4.9697 -0.004 0.6206 0.7039 3076274 SMP2_000187 Oc1ccc(cc1)C2COc3cc(O)ccc3C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I15 compound treatment 484.0 -555.67 -0.4792 90.0 14.03 0.0114 -0.3308 -0.6901 2288 SMP2_000188 CC(=CCC(O)C1=CC(=O)c2c(O)ccc(O)c2C1=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I16 compound treatment 295.0 -744.67 -0.6422 134.0 58.03 0.047 -0.4209 -0.6536 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I17 compound treatment 1964.0 924.33 0.7972 180.0 104.03 0.0843 0.6233 0.7775 1025605 SMP2_000190 OCCN(CCO)CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I18 compound treatment 791.0 -248.67 -0.2145 39.0 -36.97 -0.0299 -0.1728 -0.7981 3060146 SMP2_000191 Oc1ccc(cc1)c2nc(c([nH]2)c3ccc(F)cc3)c4ccncc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I19 compound treatment 1815.0 775.33 0.6687 107.0 31.03 0.0251 0.4906 0.7332 1874 SMP2_000192 Oc1cccc2c(O)nccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I20 compound treatment 294.0 -745.67 -0.6431 50.0 -25.97 -0.021 -0.4696 -0.7298 1080610 SMP2_000193 COc1ccc(O)c2c(=O)c3c(OC)cc4OC5OC=CC5c4c3oc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I21 compound treatment 1472.0 432.33 0.3729 68.0 -7.9697 -0.0065 0.2591 0.6948 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I22 compound treatment 9.0 -1030.7 -0.8889 4.0 -71.97 -0.0583 -0.6698 -0.7519 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I23 compound treatment 984.0 -55.667 -0.048 71.0 -4.9697 -0.004 -0.0368 -0.7637 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 I24 compound treatment 34.0 -1005.7 -0.8673 0.0 -75.97 -0.0615 -0.6568 -0.7554 325 SMP2_000197 N/C(=C(/C#N)\C(=C(/N)\Sc1ccccc1N)\C#N)/Sc2ccccc2N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J01 mock treatment 427.0 -612.67 -0.5284 16.0 -59.97 -0.0486 -0.408 -0.7689 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J02 mock treatment 676.0 -363.67 -0.3136 57.0 -18.97 -0.0154 -0.2326 -0.7409 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J03 compound treatment 975.0 -64.667 -0.0558 89.0 13.03 0.0106 -0.032 -0.5633 3076170 SMP2_000198 OC[C@@H]1[C@@H](O)[C@H](O)[C@H]2[C@@H](O)CCN12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J04 compound treatment 942.0 -97.667 -0.0842 83.0 7.0303 0.0057 -0.0555 -0.6578 677 SMP2_000199 C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc2ccncc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J05 compound treatment 58.0 -981.67 -0.8466 75.0 -0.9697 -8.0E-4 -0.5992 -0.7078 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J06 compound treatment 504.0 -535.67 -0.462 231.0 155.03 0.1256 -0.2379 -0.4968 414 SMP2_000201 CC1CNCCN1S(=O)(=O)c2cccc3cnccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J07 compound treatment 1368.0 328.33 0.2832 118.0 42.03 0.034 0.2243 0.7865 1972 SMP2_000202 COC(=O)/C(=C\Nc1ccc(Oc2ccccc2OC(C)C)nc1)/NC(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J08 compound treatment 1572.0 532.33 0.4591 60.0 -15.97 -0.0129 0.3155 0.6869 3189311 SMP2_000203 CC(=O)OCC1=C(N2[C@H](SC1)[C@H](N)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J09 compound treatment 30.0 -1009.7 -0.8708 100.0 24.03 0.0195 -0.602 -0.6911 2109607 SMP2_000204 CC(C)c1cc2CC[C@H]3C(C)(C)CCC[C@]3(C(=O)O)c2c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J10 compound treatment 1687.0 647.33 0.5583 106.0 30.03 0.0243 0.412 0.7372 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J11 compound treatment 509.0 -530.67 -0.4577 149.0 73.03 0.0592 -0.2818 -0.6106 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J12 compound treatment 0.0 -1039.7 -0.8967 12.0 -63.97 -0.0518 -0.6707 -0.7467 874122 SMP2_000207 COc1c(O)c2c(=O)cc3OCOc4cc(O)c5c(=O)c(OC)c(CC(C)O)c6c(c1CC(C)O)c2c3c4c56 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J13 compound treatment 1675.0 635.33 0.5479 21.0 -54.97 -0.0445 0.356 0.6475 1301 SMP2_000208 OCCN(CCO)c1nc(N2CCCCC2)c3nc(nc(N4CCCCC4)c3n1)N(CCO)CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J14 compound treatment 18.0 -1021.7 -0.8811 8.0 -67.97 -0.0551 -0.662 -0.7498 1001900 SMP2_000209 Nc1ccn(C2OC(CO)C(O)C2O)c(=O)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J15 compound treatment 1493.0 453.33 0.391 73.0 -2.9697 -0.0024 0.2748 0.7027 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J16 compound treatment 918.0 -121.67 -0.1049 68.0 -7.9697 -0.0065 -0.0788 -0.7492 599 SMP2_000211 Cc1cc(O)c2C(=O)c3c(O)cc(O)cc3C(=O)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J17 compound treatment 1276.0 236.33 0.2038 58.0 -17.97 -0.0146 0.1338 0.6549 162 SMP2_000212 CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J18 compound treatment 1377.0 337.33 0.2909 30.0 -45.97 -0.0372 0.1794 0.6116 3076285 SMP2_000213 CN1C(=O)/C(=C/2\Nc3ccccc3\C2=N\O)/c4ccc(Br)cc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J19 compound treatment 2111.0 1071.3 0.924 60.0 -15.97 -0.0129 0.6442 0.6971 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J20 compound treatment 754.0 -285.67 -0.2464 39.0 -36.97 -0.0299 -0.1954 -0.7873 3076287 SMP2_000215 COc1cc(O)c(CC=C(C)C)c2OC(CC(=O)c12)c3ccc(O)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J21 compound treatment 1544.0 504.33 0.435 73.0 -2.9697 -0.0024 0.3059 0.7032 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J22 compound treatment 148.0 -891.67 -0.769 49.0 -26.97 -0.0218 -0.5592 -0.7269 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J23 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 J24 compound treatment 578.0 -461.67 -0.3982 23.0 -52.97 -0.0429 -0.3119 -0.7788 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K01 mock treatment 751.0 -288.67 -0.249 33.0 -42.97 -0.0348 -0.2007 -0.7982 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K02 mock treatment 1177.0 137.33 0.1184 23.0 -52.97 -0.0429 0.0534 0.424 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K03 compound treatment 1381.0 341.33 0.2944 82.0 6.0303 0.0049 0.2116 0.7187 3076443 SMP2_000220 CC(C)CCC[C@@H](C)C1CCC2C3C(O)C=C4CC(O)CCC4(C)C3CCC12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K04 compound treatment 1410.0 370.33 0.3194 70.0 -5.9697 -0.0048 0.2224 0.6963 25 SMP2_000221 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)COP(=O)(O)OCC[N+](C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K05 compound treatment 306.0 -733.67 -0.6328 162.0 86.03 0.0697 -0.3981 -0.6254 3076448 SMP2_000222 CCC1=CC2C[C@@H]3c4[nH]c5ccccc5c4CCN(C2)[C@@]31C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K06 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 309 SMP2_000223 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K07 compound treatment 1239.0 199.33 0.1719 24.0 -51.97 -0.0421 0.0918 0.5186 1000097 SMP2_000224 Cc1c(C)c2OC(C)(COc3ccc(CC4SC(=O)NC4=O)cc3)CCc2c(C)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K08 compound treatment 0.0 -1039.7 -0.8967 9.0 -66.97 -0.0543 -0.6724 -0.7485 2113458 SMP2_000225 CCC(=O)NCCc1c2scnc2c3nccc4c5ccccc5[nH]c1c43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K09 compound treatment 2166.0 1126.3 0.9714 249.0 173.03 0.1402 0.786 0.8008 3076491 SMP2_000226 CCCCCCCCCCCCCCCC(=O)OCC(O)[C@H]1OC(=O)C(=C1O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K10 compound treatment 1910.0 870.33 0.7506 89.0 13.03 0.0106 0.5382 0.717 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K11 compound treatment 492.0 -547.67 -0.4723 81.0 5.0303 0.0041 -0.3311 -0.701 1313 SMP2_000228 Oc1ccc(Cl)cc1C(=O)Nc2ccc(cc2Cl)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K12 compound treatment 1376.0 336.33 0.2901 692.0 616.03 0.4991 0.558 0.9667 3199699 SMP2_000229 CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(O)ccc4[nH]3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K13 compound treatment 1470.0 430.33 0.3711 141.0 65.03 0.0527 0.2997 0.7995 2709 SMP2_000230 Cc1ncc(CO)c(CO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K14 compound treatment 3.0 -1036.7 -0.8941 0.0 -75.97 -0.0615 -0.6757 -0.754 3076498 SMP2_000231 CC1CC2OC2/C=C\C=C/C(=O)Cc3c(Cl)c(O)cc(O)c3C(=O)O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K15 compound treatment 1784.0 744.33 0.642 513.0 437.03 0.354 0.7043 0.9607 3076544 SMP2_000232 CCN(CC)CCCC(C)Nc1nc(C)cc(Nc2ccc3nc(C)cc(N)c3c2)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K16 compound treatment 1265.0 225.33 0.1943 70.0 -5.9697 -0.0048 0.134 0.6893 633 SMP2_000233 OC(=O)c1cc(ccc1O)N(Cc2ccccc2O)Cc3ccccc3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K17 compound treatment 1.0 -1038.7 -0.8958 0.0 -75.97 -0.0615 -0.6769 -0.7539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K18 compound treatment 1362.0 322.33 0.278 51.0 -24.97 -0.0202 0.1823 0.6539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K19 compound treatment 1286.0 246.33 0.2125 77.0 1.0303 8.0E-4 0.1508 0.7099 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K20 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K21 compound treatment 769.0 -270.67 -0.2334 80.0 4.0303 0.0033 -0.1628 -0.6971 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K22 compound treatment 1.0 -1038.7 -0.8958 0.0 -75.97 -0.0615 -0.6769 -0.7539 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K23 compound treatment 1260.0 220.33 0.19 109.0 33.03 0.0268 0.1533 0.7988 1000035 SMP2_000240 O=C1c2ccccc2-c3n[nH]c4cccc1c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 K24 compound treatment 210.0 -829.67 -0.7156 15.0 -60.97 -0.0494 -0.5409 -0.7541 1100080 SMP2_000241 OCC1OC(C(O)C1O)n2cccnc2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L01 mock treatment 837.0 -202.67 -0.1748 31.0 -44.97 -0.0364 -0.1494 -0.8365 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L02 mock treatment 1236.0 196.33 0.1693 36.0 -39.97 -0.0324 0.0968 0.5617 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L03 compound treatment 1089.0 49.333 0.0425 124.0 48.03 0.0389 0.0576 0.999 155 SMP2_000242 CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC[C@@H](NC[C@@H](N)CS)C(C)C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L04 compound treatment 3.0 -1036.7 -0.8941 3.0 -72.97 -0.0591 -0.674 -0.7522 410 SMP2_000243 CC(=N)NCc1cccc(CN)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L05 compound treatment 1577.0 537.33 0.4634 355.0 279.03 0.226 0.4875 0.9455 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L06 compound treatment 1976.0 936.33 0.8075 91.0 15.03 0.0122 0.5796 0.7177 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L07 compound treatment 21.0 -1018.7 -0.8786 1177.0 1101.0 0.892 0.0095 0.0076 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L08 compound treatment 0.0 -1039.7 -0.8967 1.0 -74.97 -0.0607 -0.677 -0.7533 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L09 compound treatment 238.0 -801.67 -0.6914 53.0 -22.97 -0.0186 -0.5021 -0.7259 1983 SMP2_000248 CC(C)c1cc2C3CC4C(C)(C)CCCC4(C(=O)O3)c2c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L10 compound treatment 1758.0 718.33 0.6195 217.0 141.03 0.1143 0.5189 0.8236 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L11 compound treatment 689.0 -350.67 -0.3024 252.0 176.03 0.1426 -0.113 -0.338 3199795 SMP2_000250 CC1C2C(Cc3ccccc3)NC(=O)C24C(/C=C\CC(C)CC(C)(O)/C=C\C4O)C(O)C1=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L12 compound treatment 2215.0 1175.3 1.0137 79.0 3.0303 0.0025 0.7185 0.7088 964 SMP2_000251 CN(C)N=Nc1[nH]cnc1C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L13 compound treatment 1771.0 731.33 0.6307 96.0 20.03 0.0162 0.4575 0.7251 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L14 compound treatment 1675.0 635.33 0.5479 225.0 149.03 0.1207 0.4728 0.8427 1001931 SMP2_000253 C[C@@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]2CC[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L15 compound treatment 1842.0 802.33 0.692 147.0 71.03 0.0575 0.53 0.7633 831956 SMP2_000254 COc1c(O)ccc2c1cc([N+](=O)[O-])c3c(cc4OCOc4c23)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L16 compound treatment 1094.0 54.333 0.0469 119.0 43.03 0.0349 0.0578 0.9894 604 SMP2_000255 Oc1c(Br)cc(/C=C\2/C3C=C(I)C=CC3NC2=O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L17 compound treatment 1561.0 521.33 0.4496 49.0 -26.97 -0.0218 0.3025 0.672 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L18 compound treatment 535.0 -504.67 -0.4353 29.0 -46.97 -0.0381 -0.3347 -0.766 604 SMP2_000257 Oc1c(Br)cc(/C=C\2/C3C=C(I)C=CC3NC2=O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L19 compound treatment 1477.0 437.33 0.3772 57.0 -18.97 -0.0154 0.2558 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L20 compound treatment 1562.0 522.33 0.4505 44.0 -31.97 -0.0259 0.3002 0.6654 3199798 SMP2_000259 CC1CC(OC2C(O)C(O)C(O)C(O)C2O)C(N)CC1NC(=N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L21 compound treatment 146.0 -893.67 -0.7708 14.0 -61.97 -0.0502 -0.5805 -0.7516 2108 SMP2_000260 COc1cc2C/C(=C\c3cc(C)c(O)c(C)c3)/C(=O)c2c(N)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L22 compound treatment 123.0 -916.67 -0.7906 5.0 -70.97 -0.0575 -0.5997 -0.7565 440 SMP2_000261 COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3cccs3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L23 compound treatment 1285.0 245.33 0.2116 16.0 -59.97 -0.0486 0.1153 0.5309 1201 SMP2_000262 COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 L24 compound treatment 38.0 -1001.7 -0.8639 10.0 -65.97 -0.0534 -0.6487 -0.7494 648 SMP2_000263 Oc1cc(O)cc(/C=C/c2ccc(O)c(O)c2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M01 mock treatment 703.0 -336.67 -0.2904 114.0 38.03 0.0308 -0.1835 -0.6286 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M02 mock treatment 1625.0 585.33 0.5048 29.0 -46.97 -0.0381 0.3301 0.652 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M03 compound treatment 1099.0 59.333 0.0512 1053.0 977.03 0.7915 0.5959 0.7513 549 SMP2_000264 Nc1ncnc2nc(cc(c3cccc(Br)c3)c12)c4ccc(nc4)N5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M04 compound treatment 3.0 -1036.7 -0.8941 0.0 -75.97 -0.0615 -0.6757 -0.754 1092656 SMP2_000265 CC1OC(CC(=O)O)CC2=C1C(=O)c3c(O)cccc3C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M05 compound treatment 1309.0 269.33 0.2323 94.0 18.03 0.0146 0.1746 0.7501 1000067 SMP2_000266 NC(C(=O)NC1[C@H]2SCC(=C(N2C1=O)C(=O)O)Cl)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M06 compound treatment 0.0 -1039.7 -0.8967 7.0 -68.97 -0.0559 -0.6735 -0.7497 535 SMP2_000267 ONC(=O)CCCN1C(=O)c2cccc3cccc(C1=O)c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M07 compound treatment 62.0 -977.67 -0.8432 4.0 -71.97 -0.0583 -0.6375 -0.7542 3177114 SMP2_000268 CN(C)c1cc2c(Nc3ccc4n(Cc5ccccc5)ncc4c3)ncnc2cn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M08 compound treatment 1306.0 266.33 0.2297 77.0 1.0303 8.0E-4 0.163 0.7097 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M09 compound treatment 1372.0 332.33 0.2866 398.0 322.03 0.2609 0.3871 0.9989 3076808 SMP2_000270 CC1(C)[C@H]2C[C@@H]1C(=C)[C@H](O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M10 compound treatment 498.0 -541.67 -0.4672 169.0 93.03 0.0754 -0.277 -0.5855 220 SMP2_000271 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M11 compound treatment 65.0 -974.67 -0.8406 14.0 -61.97 -0.0502 -0.6299 -0.748 1579 SMP2_000272 CC(Cc1ccc(O)c(O)c1)C(C)Cc2ccc(O)c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M12 compound treatment 2045.0 1005.3 0.8671 349.0 273.03 0.2212 0.7695 0.8599 284 SMP2_000273 OC(=O)c1cc(ccc1O)N(Cc2ccccc2O)Cc3cc(O)ccc3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M13 compound treatment 1725.0 685.33 0.5911 455.0 379.03 0.3071 0.6351 0.9535 3076815 SMP2_000274 CC(O)CCCCn1c(=O)n(C)c2ncn(C)c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M14 compound treatment 1635.0 595.33 0.5135 371.0 295.03 0.239 0.5321 0.9395 1102317 SMP2_000275 COc1ccc(cc1)C23Oc4cc(OC)cc(OC)c4C3(O)C(O)C(C2c5ccccc5)C(=O)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M15 compound treatment 1888.0 848.33 0.7317 34.0 -41.97 -0.034 0.4933 0.6735 1907751 SMP2_000276 CN/C(=N\c1ccc(cc1)C2=NNC(=O)CC2C)/NC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M16 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 536 SMP2_000277 ONC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M17 compound treatment 1.0 -1038.7 -0.8958 9.0 -66.97 -0.0543 -0.6718 -0.7486 3076873 SMP2_000278 COc1cc(O)c(CC=C(C)C)c(O)c1C(=O)/C=C/c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M18 compound treatment 2.0 -1037.7 -0.8949 28.0 -47.97 -0.0389 -0.6603 -0.7371 536 SMP2_000279 ONC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M19 compound treatment 1633.0 593.33 0.5117 42.0 -33.97 -0.0275 0.3424 0.6681 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M20 compound treatment 1055.0 15.333 0.0132 32.0 -43.97 -0.0356 -0.0158 -0.4168 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M21 compound treatment 2072.0 1032.3 0.8903 30.0 -45.97 -0.0372 0.6032 0.6769 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M22 compound treatment 1817.0 777.33 0.6704 36.0 -39.97 -0.0324 0.4512 0.6722 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M23 compound treatment 1638.0 598.33 0.516 68.0 -7.9697 -0.0065 0.3603 0.6982 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 M24 compound treatment 25.0 -1014.7 -0.8751 12.0 -63.97 -0.0518 -0.6554 -0.7477 2350 SMP2_000285 Cc1c(C)c2OC(C)(CN3CCN(CC3)c4cc(nc(n4)N5CCCC5)N6CCCC6)CCc2c(C)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N01 mock treatment 167.0 -872.67 -0.7526 247.0 171.03 0.1386 -0.4342 -0.5674 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N02 mock treatment 2536.0 1496.3 1.2905 269.0 193.03 0.1564 1.0231 0.787 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N03 compound treatment 3973.0 2933.3 2.5299 294.0 218.03 0.1766 1.9138 0.7546 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N04 compound treatment 7.0 -1032.7 -0.8906 12.0 -63.97 -0.0518 -0.6664 -0.747 907302 SMP2_000287 CN1CC[C@]2(C)C1N(C)c3ccc(O)cc32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N05 compound treatment 929.0 -110.67 -0.0954 74.0 -1.9697 -0.0016 -0.0686 -0.7188 3199802 SMP2_000288 CSC(=S)NCc1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N06 compound treatment 1255.0 215.33 0.1857 40.0 -35.97 -0.0291 0.1107 0.589 398 SMP2_000289 OC[C@H]1NC[C@@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N07 compound treatment 1379.0 339.33 0.2927 121.0 45.03 0.0365 0.2327 0.7891 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N08 compound treatment 437.0 -602.67 -0.5198 98.0 22.03 0.0178 -0.3549 -0.6824 1026746 SMP2_000291 OCc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N09 compound treatment 9.0 -1030.7 -0.8889 8.0 -67.97 -0.0551 -0.6675 -0.7495 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N10 compound treatment 1309.0 269.33 0.2323 81.0 5.0303 0.0041 0.1671 0.7194 3176068 SMP2_000293 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N11 compound treatment 1747.0 707.33 0.61 126.0 50.03 0.0405 0.46 0.7524 2018 SMP2_000294 NC1=NC(=O)/C(=C/2\CCNC(=O)c3[nH]ccc23)/N1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N12 compound treatment 1536.0 496.33 0.4281 527.0 451.03 0.3654 0.5611 0.9969 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N13 compound treatment 1699.0 659.33 0.5686 367.0 291.03 0.2358 0.5688 0.924 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N14 compound treatment 2.0 -1037.7 -0.8949 0.0 -75.97 -0.0615 -0.6763 -0.754 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N15 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 1084811 SMP2_000298 Cc1c2[nH]c3ccc(O)cc3c2c(C)c4cnccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N16 compound treatment 567.0 -472.67 -0.4077 132.0 56.03 0.0454 -0.2562 -0.6245 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N17 compound treatment 1211.0 171.33 0.1478 71.0 -4.9697 -0.004 0.1016 0.6876 1108916 SMP2_000300 NCCCCC(NC(=O)C(Cc1c[nH]cn1)NC(=O)CN)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N18 compound treatment 1147.0 107.33 0.0926 154.0 78.03 0.0632 0.1102 0.9827 3177114 SMP2_000301 CN(C)c1cc2c(Nc3ccc4n(Cc5ccccc5)ncc4c3)ncnc2cn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N19 compound treatment 2098.0 1058.3 0.9128 50.0 -25.97 -0.021 0.6305 0.6906 3076041 SMP2_000302 COc1cc(/C=C/c2cccc[n+]2C)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N20 compound treatment 959.0 -80.667 -0.0696 30.0 -45.97 -0.0372 -0.0755 -0.9571 1734 SMP2_000303 Nc1nnc(c(N)n1)c2cccc(Cl)c2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N21 compound treatment 1716.0 676.33 0.5833 60.0 -15.97 -0.0129 0.4033 0.6913 3076048 SMP2_000304 OC[C@H]1O[C@@H](Oc2c[nH]c3ccccc23)[C@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N22 compound treatment 2.0 -1037.7 -0.8949 0.0 -75.97 -0.0615 -0.6763 -0.754 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N23 compound treatment 1197.0 157.33 0.1357 60.0 -15.97 -0.0129 0.0868 0.6368 628 SMP2_000306 Brc1ccc2[nH]c-3c(CC(=O)Nc4ccccc34)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 N24 compound treatment 434.0 -605.67 -0.5224 396.0 320.03 0.2593 -0.186 -0.319 1273 SMP2_000307 C[C@@]12CC(=O)C3C(CCC4=CC(=O)C=C[C@]34C)C2CC[C@]1(O)C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O01 mock treatment 382.0 -657.67 -0.5672 104.0 28.03 0.0227 -0.385 -0.6783 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O02 mock treatment 1399.0 359.33 0.3099 649.0 573.03 0.4642 0.5474 0.9807 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O03 compound treatment 1197.0 157.33 0.1357 296.0 220.03 0.1782 0.222 0.9909 1059696 SMP2_000308 CC1CCC2(C)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O04 compound treatment 3044.0 2004.3 1.7287 229.0 153.03 0.124 1.31 0.7559 988 SMP2_000309 COc1ccc2[nH]cc(CCNC(=O)C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O05 compound treatment 480.0 -559.67 -0.4827 48.0 -27.97 -0.0227 -0.3573 -0.7395 413 SMP2_000310 CCCCCC[C@@H]([C@@H](C)O)n1cnc2c(N)ncnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O06 compound treatment 2384.0 1344.3 1.1594 101.0 25.03 0.0203 0.8342 0.7194 3199805 SMP2_000311 NC(=O)OC[C@H]1[C@@H]2NC(=N)N[C@]23N(CCC3(O)O)C(=N)N1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O07 compound treatment 6.0 -1033.7 -0.8915 146.0 70.03 0.0567 -0.5903 -0.6608 2081802 SMP2_000312 CC[C@@]1(O)C(=O)OCc2c1cc3-c4nc5ccc(O)c(CN(C)C)c5cc4Cn3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O08 compound treatment 1520.0 480.33 0.4143 61.0 -14.97 -0.0121 0.2844 0.6861 1080649 SMP2_000313 CC1(CC2(O)OC3O1)C4(CC2C34COC(=O)c5ccccc5)OC6OC(CO)C(O)C(O)C6O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O09 compound treatment 57.0 -982.67 -0.8475 17.0 -58.97 -0.0478 -0.6331 -0.7458 3076119 SMP2_000314 CNc1ccc2ccccc2c1N=Nc3ccc(N=Nc4ccccc4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O10 compound treatment 1223.0 183.33 0.1581 286.0 210.03 0.1701 0.2321 0.9993 1072985 SMP2_000315 CC1C(O)C2(O)C(C3C=C(CO)CC4(O)C(C=C(C)C4=O)C13O)C2(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O11 compound treatment 1519.0 479.33 0.4134 20.0 -55.97 -0.0453 0.2603 0.6258 3076122 SMP2_000316 CC(=C[C@H](C=C)C(C)(C)O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O12 compound treatment 762.0 -277.67 -0.2395 145.0 69.03 0.0559 -0.1298 -0.5278 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O13 compound treatment 7.0 -1032.7 -0.8906 0.0 -75.97 -0.0615 -0.6733 -0.7542 189 SMP2_000318 CCCCCC(O)c1cccc(OCc2ccc3ccccc3n2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O14 compound treatment 1197.0 157.33 0.1357 188.0 112.03 0.0908 0.1601 0.9809 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O15 compound treatment 2.0 -1037.7 -0.8949 1.0 -74.97 -0.0607 -0.6758 -0.7534 2305 SMP2_000320 COC1=C(N)C(=O)c2nc(ccc2C1=O)c3nc(C(=O)O)c(C)c(c3N)c4ccc(OC)c(OC)c4O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O16 compound treatment 1328.0 288.33 0.2487 16.0 -59.97 -0.0486 0.1415 0.5584 3076126 SMP2_000321 Nc1ncnc2n([C@@H]3OC4COP(O)(S)O[C@@H]4C3O)c(nc12)N5CCCCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O17 compound treatment 1082.0 42.333 0.0365 772.0 696.03 0.5639 0.4245 0.7513 2080871 SMP2_000322 CC1=C(O)C(=O)[C@@H]2O[C@@H]2C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O18 compound treatment 1155.0 115.33 0.0995 1.0 -74.97 -0.0607 0.0274 0.235 3076175 SMP2_000323 COc1cc(ccc1O)[C@H]2Oc3cc(ccc3O[C@@H]2CO)[C@H]4Oc5cc(O)cc(O)c5C(=O)[C@@H]4O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O19 compound treatment 20.0 -1019.7 -0.8794 8.0 -67.97 -0.0551 -0.6608 -0.7499 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O20 compound treatment 778.0 -261.67 -0.2257 406.0 330.03 0.2674 0.0295 0.0842 3076177 SMP2_000325 COc1cc(ccc1O)c2cc(=O)c3c(O)cc(OC4OC(CO)C(O)C(O)C4OS(=O)(=O)O)cc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O21 compound treatment 23.0 -1016.7 -0.8768 6.0 -69.97 -0.0567 -0.6601 -0.7513 2119025 SMP2_000326 Nc1nc(S)c2nc[nH]c2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O22 compound treatment 1.0 -1038.7 -0.8958 0.0 -75.97 -0.0615 -0.6769 -0.7539 2081802 SMP2_000327 CC[C@@]1(O)C(=O)OCc2c1cc3-c4nc5ccc(O)c(CN(C)C)c5cc4Cn3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O23 compound treatment 215.0 -824.67 -0.7112 7.0 -68.97 -0.0559 -0.5424 -0.7603 316 SMP2_000328 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 O24 compound treatment 500.0 -539.67 -0.4654 9.0 -66.97 -0.0543 -0.3675 -0.7842 1004963 SMP2_000329 CC1CCC2(CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P01 mock treatment 328.0 -711.67 -0.6138 30.0 -45.97 -0.0372 -0.4603 -0.7486 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P02 mock treatment 1044.0 4.3333 0.0037 215.0 139.03 0.1126 0.0823 0.7302 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P03 compound treatment 440.0 -599.67 -0.5172 618.0 542.03 0.4391 -0.0552 -0.0814 3199897 SMP2_000330 CS[C@]12CC3=CC=CC(O)[C@H]3N2C(=O)[C@@](CO)(SC)N(C)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P04 compound treatment 1597.0 557.33 0.4807 31.0 -44.97 -0.0364 0.3141 0.6516 2060488 SMP2_000331 CC(=CCC[C@@](C)(O)C=C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P05 compound treatment 305.0 -734.67 -0.6336 117.0 41.03 0.0332 -0.4245 -0.6691 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P06 compound treatment 1661.0 621.33 0.5359 21.0 -54.97 -0.0445 0.3474 0.6461 1000053 SMP2_000333 OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P07 compound treatment 1296.0 256.33 0.2211 112.0 36.03 0.0292 0.177 0.7936 1977 SMP2_000334 CC12CCc3occc3[C@H]2CCC4(CC5CC[C@H]41)C[C@]5(O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P08 compound treatment 1121.0 81.333 0.0701 43.0 -32.97 -0.0267 0.0307 0.4092 1693 SMP2_000335 NCCCNCCSP(=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P09 compound treatment 5.0 -1034.7 -0.8924 8.0 -67.97 -0.0551 -0.6699 -0.7493 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P10 compound treatment 592.0 -447.67 -0.3861 33.0 -42.97 -0.0348 -0.2976 -0.7677 446 SMP2_000337 COc1cc(CNC(=O)CCCC/C=C/C(C)C)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P11 compound treatment 1357.0 317.33 0.2737 108.0 32.03 0.0259 0.2119 0.7707 360 SMP2_000338 Oc1ccc(cc1)c2cc(=O)c3c(O)cc(O)cc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P12 compound treatment 582.0 -457.67 -0.3947 19.0 -56.97 -0.0462 -0.3117 -0.7844 3068886 SMP2_000339 CC(C)/N=c/1\cc2n(c3ccc(Cl)cc3)c4ccccc4nc2cc1Nc5ccc(Cl)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P13 compound treatment 768.0 -271.67 -0.2343 72.0 -3.9697 -0.0032 -0.168 -0.7167 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P14 compound treatment 721.0 -318.67 -0.2748 10.0 -65.97 -0.0534 -0.2321 -0.8291 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P15 compound treatment 3.0 -1036.7 -0.8941 0.0 -75.97 -0.0615 -0.6757 -0.754 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P16 compound treatment 744.0 -295.67 -0.255 19.0 -56.97 -0.0462 -0.2129 -0.8217 2069 SMP2_000343 CC12CCC3C(CCC4=C(O)C(=O)CCC34C)C2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P17 compound treatment 975.0 -64.667 -0.0558 41.0 -34.97 -0.0283 -0.0595 -0.9507 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P18 compound treatment 0.0 -1039.7 -0.8967 0.0 -75.97 -0.0615 -0.6776 -0.7539 2100 SMP2_000345 COC(=O)CC(O)(CCCC(C)(C)O)C(=O)O[C@H]1[C@H]2c3cc4OCOc4cc3CCN5CCC[C@]25C=C1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P19 compound treatment 1052.0 12.333 0.0106 12.0 -63.97 -0.0518 -0.0291 -0.5505 613 SMP2_000346 Oc1cc(/C=C/c2ccc(O)c(O)c2)oc(=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P20 compound treatment 832.0 -207.67 -0.1791 10.0 -65.97 -0.0534 -0.1644 -0.8798 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P21 compound treatment 254.0 -785.67 -0.6776 312.0 236.03 0.1912 -0.3439 -0.4885 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P22 compound treatment 552.0 -487.67 -0.4206 18.0 -57.97 -0.047 -0.3306 -0.7812 1048361 SMP2_000349 c1ccc2c(c1)[nH]c3cnccc32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P23 compound treatment 362.0 -677.67 -0.5845 5.0 -70.97 -0.0575 -0.4539 -0.7729 832145 SMP2_000350 OC[C@@H]1[C@@H](O)[C@H](O)[C@H](O)[C@H]2NC(=O)C(=O)N21 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2099 P24 compound treatment 576.0 -463.67 -0.3999 16.0 -59.97 -0.0486 -0.3171 -0.7872 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A01 compound treatment 1337.0 -458.5 -0.3954 -0.3954 -1.0 3213058 Ald1-H_000001 NNC(=O)CCCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A02 compound treatment 1450.0 -345.5 -0.298 -0.298 -1.0 3213059 Ald1-H_000002 NNC(=O)CCCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A03 compound treatment 10.0 -1785.5 -1.5399 -1.5399 -1.0 3213060 Ald1-H_000003 ONC(=O)CCCCCCC(=O)N/N=C/c1ccccc1OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A04 compound treatment 1425.0 -370.5 -0.3195 -0.3195 -1.0 3213062 Ald1-H_000004 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccccc2OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A05 compound treatment 7.0 -1788.5 -1.5425 -1.5425 -1.0 3213064 Ald1-H_000005 COc1ccc(/C=N/NC(=O)CCCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A06 compound treatment 1517.0 -278.5 -0.2402 -0.2402 -1.0 3213066 Ald1-H_000006 COc1ccc(/C=N/NC(=O)CCCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A07 compound treatment 5.0 -1790.5 -1.5442 -1.5442 -1.0 3213068 Ald1-H_000007 ONC(=O)CCCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A08 compound treatment 2106.0 310.5 0.2678 0.2678 1.0 3213070 Ald1-H_000008 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A09 compound treatment 5.0 -1790.5 -1.5442 -1.5442 -1.0 3213072 Ald1-H_000009 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc2OCCOc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A10 compound treatment 712.0 -1083.5 -0.9345 -0.9345 -1.0 3213074 Ald1-H_000010 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc3OCCOc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A11 compound treatment 215.0 -1580.5 -1.3631 -1.3631 -1.0 3213076 Ald1-H_000011 ONC(=O)CCCCCCC(=O)N/N=C/COCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A12 compound treatment 317.0 -1478.5 -1.2751 -1.2751 -1.0 3213078 Ald1-H_000012 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/COCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A13 mock treatment 2142.0 346.5 0.2988 0.2988 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A14 mock treatment 1449.0 -346.5 -0.2988 -0.2988 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A15 compound treatment 4.0 -1791.5 -1.5451 -1.5451 -1.0 3213080 Ald1-H_000013 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A16 compound treatment 1290.0 -505.5 -0.436 -0.436 -1.0 3213082 Ald1-H_000014 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A17 compound treatment 1.0 -1794.5 -1.5477 -1.5477 -1.0 3213084 Ald1-H_000015 ONC(=O)CCCCCCC(=O)N/N=C/c1ccccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A18 compound treatment 67.0 -1728.5 -1.4908 -1.4908 -1.0 3213086 Ald1-H_000016 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccccc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A19 compound treatment 5.0 -1790.5 -1.5442 -1.5442 -1.0 3213088 Ald1-H_000017 ONC(=O)CCCCCCC(=O)N/N=C/c1cccc(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2131 A20 compound treatment 1298.0 -497.5 -0.4291 -0.4291 -1.0 3213090 Ald1-H_000018 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2cccc(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A01 compound treatment 3212.0 1772.6 1.5288 1649.0 131.14 0.1062 1.1561 0.7544 3213668 Ald1-H_000315 NNC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A02 compound treatment 1588.0 148.56 0.1281 1778.0 260.14 0.2107 0.2396 0.9715 3213669 Ald1-H_000316 NNC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A03 compound treatment 2472.0 1032.6 0.8905 2573.0 1055.1 0.8548 1.2341 0.9998 3213670 Ald1-H_000317 OC(=O)CCCCCCC(=O)N/N=C/c1ccccc1OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A04 compound treatment 0.0 -1439.4 -1.2415 13.0 -1504.9 -1.2191 -1.7399 -1.0 3213672 Ald1-H_000318 OC(=O)CCCCCC(=O)N/N=C/c1ccccc1OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A05 compound treatment 1935.0 495.56 0.4274 2430.0 912.14 0.7389 0.8247 0.9661 3213674 Ald1-H_000319 COc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A06 compound treatment 3835.0 2395.6 2.0661 150.0 -1367.9 -1.1081 0.6774 0.2889 3213676 Ald1-H_000320 COc1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A07 compound treatment 2059.0 619.56 0.5343 2529.0 1011.1 0.8191 0.9571 0.9786 3213678 Ald1-H_000321 OC(=O)CCCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A08 compound treatment 904.0 -535.44 -0.4618 9.0 -1508.9 -1.2223 -1.1909 -0.9114 3213680 Ald1-H_000322 OC(=O)CCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A09 compound treatment 1754.0 314.56 0.2713 5122.0 3604.1 2.9198 2.2564 0.7695 3213682 Ald1-H_000323 OC(=O)CCCCCCC(=O)N/N=C/c1ccc2OCCOc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A10 compound treatment 2013.0 573.56 0.4947 1958.0 440.14 0.3566 0.6019 0.9871 3213684 Ald1-H_000324 OC(=O)CCCCCC(=O)N/N=C/c1ccc2OCCOc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A11 compound treatment 1588.0 148.56 0.1281 1942.0 424.14 0.3436 0.3336 0.9096 3213686 Ald1-H_000325 OC(=O)CCCCCCC(=O)N/N=C/COCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A12 compound treatment 1610.0 170.56 0.1471 170.0 -1347.9 -1.0919 -0.6681 -0.6064 3213688 Ald1-H_000326 OC(=O)CCCCCC(=O)N/N=C/COCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A13 mock treatment 1583.0 143.56 0.1238 2952.0 1434.1 1.1618 0.9091 0.7781 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A14 mock treatment 3589.0 2149.6 1.8539 1014.0 -503.86 -0.4082 1.0223 0.5385 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A15 compound treatment 1906.0 466.56 0.4024 1368.0 -149.86 -0.1214 0.1987 0.4727 3213690 Ald1-H_000327 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A16 compound treatment 19.0 -1420.4 -1.2251 0.0 -1517.9 -1.2296 -1.7357 -1.0 3213692 Ald1-H_000328 OC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A17 compound treatment 1832.0 392.56 0.3386 1545.0 27.143 0.022 0.2549 0.7514 3213694 Ald1-H_000329 OC(=O)CCCCCCC(=O)N/N=C/c1ccccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A18 compound treatment 727.0 -712.44 -0.6145 999.0 -518.86 -0.4203 -0.7317 -0.9829 3213696 Ald1-H_000330 OC(=O)CCCCCC(=O)N/N=C/c1ccccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A19 compound treatment 1263.0 -176.44 -0.1522 1301.0 -216.86 -0.1757 -0.2318 -0.9974 3213698 Ald1-H_000331 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A20 compound treatment 900.0 -539.44 -0.4652 638.0 -879.86 -0.7128 -0.833 -0.9786 3213700 Ald1-H_000332 OC(=O)CCCCCC(=O)N/N=C/c1cccc(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A21 compound treatment 1520.0 80.558 0.0695 1065.0 -452.86 -0.3669 -0.2103 -0.5632 3213702 Ald1-H_000333 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(Br)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A22 compound treatment 891.0 -548.44 -0.473 644.0 -873.86 -0.7079 -0.835 -0.9808 3213704 Ald1-H_000334 OC(=O)CCCCCC(=O)N/N=C/c1ccc(Br)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A23 compound treatment 1115.0 -324.44 -0.2798 586.0 -931.86 -0.7549 -0.7317 -0.9088 3213706 Ald1-H_000335 OC(=O)CCCCCCC(=O)N/N=C/C(=C/c1ccccc1)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 A24 compound treatment 528.0 -911.44 -0.7861 217.0 -1300.9 -1.0538 -1.301 -0.9896 3213708 Ald1-H_000336 OC(=O)CCCCCC(=O)N/N=C/C(=C/c1ccccc1)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B01 compound treatment 1653.0 213.56 0.1842 2123.0 605.14 0.4902 0.4769 0.9106 3213710 Ald1-H_000337 OC(=O)CCCCCC(=O)N/N=C/c1c(O)ccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B02 compound treatment 1683.0 243.56 0.2101 1922.0 404.14 0.3274 0.38 0.977 3213712 Ald1-H_000338 OC(=O)CCCCCCC(=O)N/N=C/c1c(O)ccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B03 compound treatment 994.0 -445.44 -0.3842 1333.0 -184.86 -0.1498 -0.3775 -0.9156 3213714 Ald1-H_000339 OC(=O)CCCCCC(=O)N/N=C/c1ccc(O)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B04 compound treatment 881.0 -558.44 -0.4816 1017.0 -500.86 -0.4058 -0.6275 -0.9964 3213716 Ald1-H_000340 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B05 compound treatment 1789.0 349.56 0.3015 1615.0 97.143 0.0787 0.2688 0.8628 3213718 Ald1-H_000341 OC(=O)CCCCCC(=O)N/N=C/c1ccc([N+](=O)[O-])c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B06 compound treatment 1162.0 -277.44 -0.2393 1423.0 -94.857 -0.0768 -0.2235 -0.8895 3213720 Ald1-H_000342 OC(=O)CCCCCCC(=O)N/N=C/c1ccc([N+](=O)[O-])c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B07 compound treatment 1681.0 241.56 0.2083 1707.0 189.14 0.1532 0.2557 0.9886 3213722 Ald1-H_000343 OC(=O)CCCCCC(=O)N/N=C/c1cc(O)ccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B08 compound treatment 772.0 -667.44 -0.5756 417.0 -1100.9 -0.8918 -1.0377 -0.9776 3213724 Ald1-H_000344 OC(=O)CCCCCCC(=O)N/N=C/c1cc(O)ccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B09 compound treatment 1504.0 64.558 0.0557 1519.0 1.1429 9.0E-4 0.04 0.7188 3213726 Ald1-H_000345 OC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)n2ccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B10 compound treatment 954.0 -485.44 -0.4187 891.0 -626.86 -0.5078 -0.6551 -0.9954 3213728 Ald1-H_000346 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)n2ccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B11 compound treatment 1506.0 66.558 0.0574 1287.0 -230.86 -0.187 -0.0917 -0.4685 3213730 Ald1-H_000347 OC(=O)CCCCCC(=O)N/N=C/c1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B12 compound treatment 1394.0 -45.442 -0.0392 839.0 -678.86 -0.55 -0.4166 -0.7556 3213732 Ald1-H_000348 OC(=O)CCCCCCC(=O)N/N=C/c1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B13 mock treatment 1350.0 -89.442 -0.0771 1436.0 -81.857 -0.0663 -0.1014 -0.9972 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B14 mock treatment 1221.0 -218.44 -0.1884 1001.0 -516.86 -0.4187 -0.4293 -0.935 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B15 compound treatment 1165.0 -274.44 -0.2367 1129.0 -388.86 -0.315 -0.3901 -0.9901 3213734 Ald1-H_000349 OC(=O)CCCCCC(=O)N/N=C/c1ccc(I)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B16 compound treatment 1121.0 -318.44 -0.2746 1049.0 -468.86 -0.3798 -0.4628 -0.9873 3213736 Ald1-H_000350 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(I)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B17 compound treatment 483.0 -956.44 -0.8249 816.0 -701.86 -0.5686 -0.9853 -0.9835 3213738 Ald1-H_000351 C/C=C(/C)\C=N\NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B18 compound treatment 771.0 -668.44 -0.5765 820.0 -697.86 -0.5653 -0.8074 -1.0 3213740 Ald1-H_000352 C/C=C(/C)\C=N\NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B19 compound treatment 984.0 -455.44 -0.3928 967.0 -550.86 -0.4463 -0.5933 -0.998 3213742 Ald1-H_000353 OC(=O)CCCCCC(=O)N/N=C/c1ccccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B20 compound treatment 776.0 -663.44 -0.5722 713.0 -804.86 -0.652 -0.8657 -0.9979 3213744 Ald1-H_000354 OC(=O)CCCCCCC(=O)N/N=C/c1ccccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B21 compound treatment 972.0 -467.44 -0.4031 947.0 -570.86 -0.4625 -0.6121 -0.9977 3213746 Ald1-H_000355 Cc1ccc(/C=N/NC(=O)CCCCCC(=O)O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B22 compound treatment 689.0 -750.44 -0.6472 667.0 -850.86 -0.6893 -0.9451 -0.9995 3213748 Ald1-H_000356 Cc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B23 compound treatment 544.0 -895.44 -0.7723 746.0 -771.86 -0.6253 -0.9882 -0.9945 3213750 Ald1-H_000357 Cc1[nH]cnc1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 B24 compound treatment 481.0 -958.44 -0.8266 297.0 -1220.9 -0.989 -1.2839 -0.996 3213752 Ald1-H_000358 Cc1[nH]cnc1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C01 compound treatment 1740.0 300.56 0.2592 2305.0 787.14 0.6377 0.6342 0.9213 3213754 Ald1-H_000359 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(Br)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C02 compound treatment 1564.0 124.56 0.1074 1298.0 -219.86 -0.1781 -0.05 -0.2403 3213756 Ald1-H_000360 OC(=O)CCCCCC(=O)N/N=C/c1ccc(Br)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C03 compound treatment 844.0 -595.44 -0.5135 1111.0 -406.86 -0.3296 -0.5962 -0.977 3213758 Ald1-H_000361 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C04 compound treatment 1209.0 -230.44 -0.1987 1653.0 135.14 0.1095 -0.0631 -0.2782 3213760 Ald1-H_000362 OC(=O)CCCCCC(=O)N/N=C/c1ccc(O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C05 compound treatment 1416.0 -23.442 -0.0202 1594.0 76.143 0.0617 0.0293 0.4517 3213762 Ald1-H_000363 OC(=O)CCCCCCC(=O)N/N=C/c1cc(O)ccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C06 compound treatment 1151.0 -288.44 -0.2488 1153.0 -364.86 -0.2956 -0.3849 -0.9963 3213764 Ald1-H_000364 OC(=O)CCCCCC(=O)N/N=C/c1cc(O)ccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C07 compound treatment 1873.0 433.56 0.3739 1579.0 61.143 0.0495 0.2994 0.7938 3213766 Ald1-H_000365 COc1cc(Br)cc(/C=N/NC(=O)CCCCCCC(=O)O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C08 compound treatment 1392.0 -47.442 -0.0409 1421.0 -96.857 -0.0785 -0.0844 -0.9539 3213768 Ald1-H_000366 COc1cc(Br)cc(/C=N/NC(=O)CCCCCC(=O)O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C09 compound treatment 1317.0 -122.44 -0.1056 1407.0 -110.86 -0.0898 -0.1382 -0.9967 3213770 Ald1-H_000367 COc1ccc(Br)c(/C=N/NC(=O)CCCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C10 compound treatment 1635.0 195.56 0.1687 1537.0 19.143 0.0155 0.1302 0.7689 3213772 Ald1-H_000368 COc1ccc(Br)c(/C=N/NC(=O)CCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C11 mock treatment 2026.0 586.56 0.5059 1880.0 362.14 0.2934 0.5652 0.9664 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C12 mock treatment 2012.0 572.56 0.4938 873.0 -644.86 -0.5224 -0.0202 -0.0281 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C13 compound treatment 1596.0 156.56 0.135 1291.0 -226.86 -0.1838 -0.0345 -0.1512 3213774 Ald1-H_000369 COc1ccc(Br)cc1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C14 compound treatment 1462.0 22.558 0.0195 788.0 -729.86 -0.5913 -0.4043 -0.6835 3213776 Ald1-H_000370 COc1ccc(Br)cc1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C15 mock treatment 1686.0 246.56 0.2126 1327.0 -190.86 -0.1546 0.041 0.1561 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C16 mock treatment 1322.0 -117.44 -0.1013 805.0 -712.86 -0.5775 -0.48 -0.8186 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C17 compound treatment 1364.0 -75.442 -0.0651 929.0 -588.86 -0.477 -0.3833 -0.7962 3213778 Ald1-H_000371 OC(=O)CCCCCCC(=O)N/N=C/c1cc2OCOc2cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C18 compound treatment 889.0 -550.44 -0.4747 205.0 -1312.9 -1.0636 -1.0877 -0.9339 3213780 Ald1-H_000372 OC(=O)CCCCCC(=O)N/N=C/c1cc2OCOc2cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C19 compound treatment 1347.0 -92.442 -0.0797 965.0 -552.86 -0.4479 -0.3731 -0.8201 3213782 Ald1-H_000373 OC(=O)CCCCCCC(=O)N/N=C/c1cccnc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C20 compound treatment 1045.0 -394.44 -0.3402 770.0 -747.86 -0.6058 -0.669 -0.9628 3213784 Ald1-H_000374 OC(=O)CCCCCC(=O)N/N=C/c1cccnc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C21 compound treatment 1024.0 -415.44 -0.3583 906.0 -611.86 -0.4957 -0.6039 -0.9873 3213786 Ald1-H_000375 OC(=O)CCCCCCC(=O)N/N=C/c1ccncc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C22 compound treatment 1032.0 -407.44 -0.3514 483.0 -1034.9 -0.8384 -0.8413 -0.9255 3213788 Ald1-H_000376 OC(=O)CCCCCC(=O)N/N=C/c1ccncc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C23 compound treatment 747.0 -692.44 -0.5972 539.0 -978.86 -0.793 -0.983 -0.9902 3213790 Ald1-H_000377 OC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 C24 compound treatment 303.0 -1136.4 -0.9801 1115.0 -402.86 -0.3264 -0.9238 -0.8943 3213792 Ald1-H_000378 OC(=O)CCCCCC(=O)N/N=C/c1cc(Br)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D01 compound treatment 1779.0 339.56 0.2929 2221.0 703.14 0.5696 0.6099 0.9522 3213794 Ald1-H_000379 Cc1ccsc1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D02 compound treatment 1536.0 96.558 0.0833 1575.0 57.143 0.0463 0.0916 0.9616 3213796 Ald1-H_000380 Cc1ccsc1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D03 compound treatment 1670.0 230.56 0.1988 1997.0 479.14 0.3882 0.4151 0.9517 3213798 Ald1-H_000381 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D04 compound treatment 1457.0 17.558 0.0151 1694.0 176.14 0.1427 0.1116 0.7778 3213800 Ald1-H_000382 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D05 compound treatment 1888.0 448.56 0.3869 1925.0 407.14 0.3298 0.5068 0.9968 3213802 Ald1-H_000383 OC(=O)CCCCCC(=O)N/N=C/c1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D06 compound treatment 1887.0 447.56 0.386 1683.0 165.14 0.1338 0.3675 0.8997 3213804 Ald1-H_000384 OC(=O)CCCCCCC(=O)N/N=C/c1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D07 compound treatment 2042.0 602.56 0.5197 2733.0 1215.1 0.9844 1.0635 0.9554 3213806 Ald1-H_000385 COc1cc(/C=N/NC(=O)CCCCCC(=O)O)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D08 compound treatment 1451.0 11.558 0.01 1637.0 119.14 0.0965 0.0753 0.776 3213808 Ald1-H_000386 COc1cc(/C=N/NC(=O)CCCCCCC(=O)O)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D09 compound treatment 1025.0 -414.44 -0.3574 1657.0 139.14 0.1127 -0.173 -0.4617 3213810 Ald1-H_000387 OC(=O)CCCCCC(=O)N/N=C/c1ccc2ccccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D10 compound treatment 1435.0 -4.4423 -0.0038 1265.0 -252.86 -0.2048 -0.1476 -0.7202 3213812 Ald1-H_000388 OC(=O)CCCCCCC(=O)N/N=C/c1ccc2ccccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D11 mock treatment 1955.0 515.56 0.4446 1697.0 179.14 0.1451 0.417 0.8916 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D12 mock treatment 1616.0 176.56 0.1523 1183.0 -334.86 -0.2713 -0.0841 -0.2705 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D13 compound treatment 2227.0 787.56 0.6792 2065.0 547.14 0.4432 0.7937 0.9786 3213814 Ald1-H_000389 OC(=O)CCCCCC(=O)N/N=C/c1ccc(s1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D14 compound treatment 1785.0 345.56 0.298 1049.0 -468.86 -0.3798 -0.0578 -0.1198 3213816 Ald1-H_000390 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(s1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D15 mock treatment 1424.0 -15.442 -0.0133 1160.0 -357.86 -0.2899 -0.2144 -0.7388 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D16 mock treatment 1126.0 -313.44 -0.2703 942.0 -575.86 -0.4665 -0.521 -0.9663 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D17 compound treatment 1561.0 121.56 0.1048 1172.0 -345.86 -0.2802 -0.124 -0.4145 3213818 Ald1-H_000391 OC(=O)CCCCCC(=O)N/N=C/c1c(F)c(F)c(F)c(F)c1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D18 compound treatment 1230.0 -209.44 -0.1806 228.0 -1289.9 -1.0449 -0.8666 -0.8172 3213820 Ald1-H_000392 OC(=O)CCCCCCC(=O)N/N=C/c1c(F)c(F)c(F)c(F)c1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D19 compound treatment 1103.0 -336.44 -0.2902 1329.0 -188.86 -0.153 -0.3134 -0.9553 3213822 Ald1-H_000393 OC(=O)CCCCCC(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D20 compound treatment 360.0 -1079.4 -0.931 743.0 -774.86 -0.6277 -1.1022 -0.9816 3213824 Ald1-H_000394 OC(=O)CCCCCCC(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D21 compound treatment 1420.0 -19.442 -0.0168 1001.0 -516.86 -0.4187 -0.3079 -0.7348 3213826 Ald1-H_000395 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D22 compound treatment 848.0 -591.44 -0.5101 707.0 -810.86 -0.6569 -0.8252 -0.9922 3213828 Ald1-H_000396 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D23 compound treatment 1141.0 -298.44 -0.2574 744.0 -773.86 -0.6269 -0.6253 -0.9227 3213830 Ald1-H_000397 OC(=O)CCCCCC(=O)N/N=C/c1cccc(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 D24 compound treatment 744.0 -695.44 -0.5998 853.0 -664.86 -0.5386 -0.805 -0.9986 3213832 Ald1-H_000398 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E01 mock treatment 2460.0 1020.6 0.8802 2176.0 658.14 0.5332 0.9994 0.9712 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E02 mock treatment 1860.0 420.56 0.3627 2166.0 648.14 0.5251 0.6278 0.9837 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E03 compound treatment 2657.0 1217.6 1.0501 2460.0 942.14 0.7632 1.2822 0.9877 3213834 Ald1-H_000399 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(Br)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E04 compound treatment 1825.0 385.56 0.3325 2404.0 886.14 0.7179 0.7427 0.9388 3213836 Ald1-H_000400 OC(=O)CCCCCC(=O)N/N=C/c1ccc(Br)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E05 compound treatment 4126.0 2686.6 2.317 2245.0 727.14 0.5891 2.0549 0.8595 3213838 Ald1-H_000401 COc1cc(/C=N/NC(=O)CCCCCCC(=O)O)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E06 compound treatment 1918.0 478.56 0.4127 2441.0 923.14 0.7479 0.8207 0.9608 3213840 Ald1-H_000402 COc1cc(/C=N/NC(=O)CCCCCC(=O)O)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E07 compound treatment 1197.0 -242.44 -0.2091 2498.0 980.14 0.794 0.4136 0.5037 3213842 Ald1-H_000403 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E08 compound treatment 1631.0 191.56 0.1652 1474.0 -43.857 -0.0355 0.0917 0.5426 3213844 Ald1-H_000404 OC(=O)CCCCCC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E09 mock treatment 1726.0 286.56 0.2471 2157.0 639.14 0.5178 0.5409 0.9427 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E10 mock treatment 265.0 -1174.4 -1.0129 1877.0 359.14 0.2909 -0.5105 -0.4844 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E11 compound treatment 2835.0 1395.6 1.2036 1714.0 196.14 0.1589 0.9634 0.7936 3213846 Ald1-H_000405 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E12 compound treatment 1669.0 229.56 0.198 1864.0 346.14 0.2804 0.3383 0.9855 3213848 Ald1-H_000406 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E13 compound treatment 2794.0 1354.6 1.1683 2167.0 649.14 0.5259 1.1979 0.935 3213850 Ald1-H_000407 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E14 compound treatment 1525.0 85.558 0.0738 1178.0 -339.86 -0.2753 -0.1425 -0.4999 3213852 Ald1-H_000408 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E15 compound treatment 2035.0 595.56 0.5136 1645.0 127.14 0.103 0.436 0.8323 3213854 Ald1-H_000409 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)CCCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E16 compound treatment 1287.0 -152.44 -0.1315 1309.0 -208.86 -0.1692 -0.2126 -0.9922 3213856 Ald1-H_000410 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)CCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E17 mock treatment 3032.0 1592.6 1.3735 1474.0 -43.857 -0.0355 0.9461 0.6886 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E18 mock treatment 2592.0 1152.6 0.994 1065.0 -452.86 -0.3669 0.4435 0.4185 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E19 compound treatment 1285.0 -154.44 -0.1332 1322.0 -195.86 -0.1587 -0.2064 -0.9962 3213858 Ald1-H_000411 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E20 compound treatment 1080.0 -359.44 -0.31 865.0 -652.86 -0.5289 -0.5932 -0.9676 3213860 Ald1-H_000412 OC(=O)CCCCCC(=O)N/N=C/c1cccc(c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E21 compound treatment 2520.0 1080.6 0.9319 714.0 -803.86 -0.6512 0.1985 0.1746 3213862 Ald1-H_000413 OC(=O)CCCCCCC(=O)N/N=C/c1ccccc1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E22 compound treatment 955.0 -484.44 -0.4178 601.0 -916.86 -0.7428 -0.8206 -0.963 3213864 Ald1-H_000414 OC(=O)CCCCCC(=O)N/N=C/c1ccccc1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E23 compound treatment 1264.0 -175.44 -0.1513 800.0 -717.86 -0.5815 -0.5182 -0.8624 3213866 Ald1-H_000415 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 E24 compound treatment 738.0 -701.44 -0.605 675.0 -842.86 -0.6828 -0.9106 -0.9982 3213868 Ald1-H_000416 OC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F01 mock treatment 2202.0 762.56 0.6577 1984.0 466.14 0.3776 0.7321 0.9653 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F02 mock treatment 2203.0 763.56 0.6585 2955.0 1437.1 1.1642 1.2889 0.9636 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F03 compound treatment 2729.0 1289.6 1.1122 2310.0 792.14 0.6417 1.2402 0.9659 3213870 Ald1-H_000417 OC(=O)CCCCCC(=O)N/N=C/c1cn(c2ccccc12)S(=O)(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F04 compound treatment 1584.0 144.56 0.1247 2918.0 1400.1 1.1343 0.8902 0.7801 3213872 Ald1-H_000418 OC(=O)CCCCCCC(=O)N/N=C/c1cn(c2ccccc12)S(=O)(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F05 compound treatment 2008.0 568.56 0.4904 2137.0 619.14 0.5016 0.7014 0.9999 3213874 Ald1-H_000419 OC(=O)CCCCCC(=O)N/N=C/c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F06 compound treatment 1927.0 487.56 0.4205 2567.0 1049.1 0.8499 0.8983 0.9473 3213876 Ald1-H_000420 OC(=O)CCCCCCC(=O)N/N=C/c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F07 compound treatment 2675.0 1235.6 1.0656 2660.0 1142.1 0.9253 1.4078 0.9975 3213878 Ald1-H_000421 OC(=O)CCCCCC(=O)N/N=C/c1cccnc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F08 compound treatment 2467.0 1027.6 0.8862 1485.0 -32.857 -0.0266 0.6078 0.6856 3213880 Ald1-H_000422 OC(=O)CCCCCCC(=O)N/N=C/c1cccnc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F09 mock treatment 2224.0 784.56 0.6766 2796.0 1278.1 1.0354 1.2106 0.9787 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F10 mock treatment 2099.0 659.56 0.5688 113.0 -1404.9 -1.1381 -0.4025 -0.3164 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F11 compound treatment 2050.0 610.56 0.5266 2836.0 1318.1 1.0678 1.1274 0.9469 3213882 Ald1-H_000423 Cc1ncc(CO)c(/C=N/NC(=O)CCCCCC(=O)O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F12 compound treatment 1819.0 379.56 0.3274 2083.0 565.14 0.4578 0.5552 0.9865 3213884 Ald1-H_000424 Cc1ncc(CO)c(/C=N/NC(=O)CCCCCCC(=O)O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F13 compound treatment 2919.0 1479.6 1.2761 2611.0 1093.1 0.8856 1.5285 0.9841 3213886 Ald1-H_000425 OC(=O)CCCCCC(=O)N/N=C/c1ccc[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F14 compound treatment 1889.0 449.56 0.3877 2896.0 1378.1 1.1165 1.0636 0.8999 3213888 Ald1-H_000426 OC(=O)CCCCCCC(=O)N/N=C/c1ccc[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F15 compound treatment 1789.0 349.56 0.3015 1623.0 105.14 0.0852 0.2734 0.8727 3213890 Ald1-H_000427 OC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)N2CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F16 compound treatment 435.0 -1004.4 -0.8663 943.0 -574.86 -0.4657 -0.9419 -0.9576 3213892 Ald1-H_000428 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)N2CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F17 mock treatment 1998.0 558.56 0.4817 829.0 -688.86 -0.5581 -0.054 -0.0732 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F18 mock treatment 2124.0 684.56 0.5904 1036.0 -481.86 -0.3904 0.1415 0.1999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F19 compound treatment 2115.0 675.56 0.5826 2007.0 489.14 0.3963 0.6922 0.9824 3213894 Ald1-H_000429 OC(=O)CCCCCC(=O)N/N=C/c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F20 compound treatment 1638.0 198.56 0.1712 997.0 -520.86 -0.422 -0.1773 -0.3893 3213896 Ald1-H_000430 OC(=O)CCCCCCC(=O)N/N=C/c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F21 compound treatment 1659.0 219.56 0.1894 1586.0 68.143 0.0552 0.1729 0.8768 3213898 Ald1-H_000431 CCCCCCC/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F22 compound treatment 406.0 -1033.4 -0.8913 701.0 -816.86 -0.6617 -1.0982 -0.9893 3213900 Ald1-H_000432 CCCCCCC/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F23 compound treatment 1748.0 308.56 0.2661 1574.0 56.143 0.0455 0.2203 0.8161 3213902 Ald1-H_000433 OC(=O)CCCCCC(=O)N/N=C/c1nccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 F24 compound treatment 1079.0 -360.44 -0.3109 420.0 -1097.9 -0.8894 -0.8487 -0.9008 3213904 Ald1-H_000434 OC(=O)CCCCCCC(=O)N/N=C/c1nccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G01 compound treatment 1330.0 -109.44 -0.0944 1685.0 167.14 0.1354 0.029 0.1757 3213906 Ald1-H_000435 OC(=O)CCCCCCC(=O)N/N=C/c1ccccc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G02 compound treatment 956.0 -483.44 -0.4169 1009.0 -508.86 -0.4122 -0.5863 -1.0 3213908 Ald1-H_000436 OC(=O)CCCCCC(=O)N/N=C/c1ccccc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G03 mock treatment 1212.0 -227.44 -0.1962 1244.0 -273.86 -0.2219 -0.2956 -0.9981 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G04 mock treatment 613.0 -826.44 -0.7128 1071.0 -446.86 -0.362 -0.76 -0.9507 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G05 compound treatment 1099.0 -340.44 -0.2936 1028.0 -489.86 -0.3968 -0.4882 -0.989 3213910 Ald1-H_000437 OC(=O)CCCCCCC(=O)N/N=C/c1cccnc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G06 compound treatment 886.0 -553.44 -0.4773 870.0 -647.86 -0.5248 -0.7086 -0.9989 3213912 Ald1-H_000438 OC(=O)CCCCCC(=O)N/N=C/c1cccnc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G07 compound treatment 982.0 -457.44 -0.3945 1246.0 -271.86 -0.2202 -0.4347 -0.9621 3213914 Ald1-H_000439 OC(=O)CCCCCCC(=O)N/N=C/C=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G08 compound treatment 647.0 -792.44 -0.6834 767.0 -750.86 -0.6083 -0.9134 -0.9983 3213916 Ald1-H_000440 OC(=O)CCCCCC(=O)N/N=C/C=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G09 compound treatment 1101.0 -338.44 -0.2919 1047.0 -470.86 -0.3814 -0.4761 -0.9913 3213918 Ald1-H_000441 C[C@H](CCC=C(C)C)C/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G10 compound treatment 996.0 -443.44 -0.3825 628.0 -889.86 -0.7209 -0.7802 -0.956 3213920 Ald1-H_000442 C[C@H](CCC=C(C)C)C/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G11 compound treatment 888.0 -551.44 -0.4756 1142.0 -375.86 -0.3045 -0.5516 -0.9768 3213922 Ald1-H_000443 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G12 compound treatment 798.0 -641.44 -0.5532 710.0 -807.86 -0.6545 -0.854 -0.9965 3213923 Ald1-H_000444 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G13 compound treatment 1134.0 -305.44 -0.2634 1320.0 -197.86 -0.1603 -0.2996 -0.9716 3213924 Ald1-H_000445 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(C#N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G14 compound treatment 774.0 -665.44 -0.5739 780.0 -737.86 -0.5977 -0.8285 -0.9998 3213926 Ald1-H_000446 OC(=O)CCCCCC(=O)N/N=C/c1ccc(C#N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G15 compound treatment 617.0 -822.44 -0.7093 977.0 -540.86 -0.4382 -0.8114 -0.9732 3213928 Ald1-H_000447 OC(=O)CCCCCCC(=O)N/N=C/C1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G16 compound treatment 719.0 -720.44 -0.6214 675.0 -842.86 -0.6828 -0.9222 -0.9989 3213930 Ald1-H_000448 OC(=O)CCCCCC(=O)N/N=C/C1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G17 compound treatment 725.0 -714.44 -0.6162 1096.0 -421.86 -0.3418 -0.6774 -0.9613 3213932 Ald1-H_000449 COc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G18 compound treatment 567.0 -872.44 -0.7524 600.0 -917.86 -0.7436 -1.0578 -1.0 3213934 Ald1-H_000450 COc1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G19 mock treatment 810.0 -629.44 -0.5429 878.0 -639.86 -0.5184 -0.7504 -0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G20 mock treatment 687.0 -752.44 -0.649 461.0 -1056.9 -0.8562 -1.0643 -0.9907 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G21 compound treatment 421.0 -1018.4 -0.8784 407.0 -1110.9 -0.8999 -1.2574 -0.9999 3213936 Ald1-H_000451 OC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)cc(Br)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G22 compound treatment 317.0 -1122.4 -0.9681 114.0 -1403.9 -1.1373 -1.4887 -0.9968 3213938 Ald1-H_000452 OC(=O)CCCCCC(=O)N/N=C/c1cc(Br)cc(Br)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G23 compound treatment 4.0 -1435.4 -1.238 5.0 -1512.9 -1.2256 -1.742 -1.0 3213940 Ald1-H_000453 CCCCN(CCCC)c1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 G24 compound treatment 0.0 -1439.4 -1.2415 1.0 -1516.9 -1.2288 -1.7468 -1.0 3213942 Ald1-H_000454 CCCCN(CCCC)c1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H01 compound treatment 1788.0 348.56 0.3006 2033.0 515.14 0.4173 0.5077 0.987 3213944 Ald1-H_000455 OC(=O)CCCCCC(=O)N/N=C/c1cccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H02 compound treatment 1703.0 263.56 0.2273 1743.0 225.14 0.1824 0.2897 0.994 3213946 Ald1-H_000456 OC(=O)CCCCCCC(=O)N/N=C/c1cccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H03 mock treatment 1870.0 430.56 0.3713 2498.0 980.14 0.794 0.824 0.9401 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H04 mock treatment 1800.0 360.56 0.311 1856.0 338.14 0.2739 0.4136 0.998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H05 compound treatment 1981.0 541.56 0.4671 2284.0 766.14 0.6207 0.7691 0.9902 3213948 Ald1-H_000457 OC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H06 compound treatment 1618.0 178.56 0.154 2047.0 529.14 0.4287 0.412 0.9045 3213950 Ald1-H_000458 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H07 compound treatment 2087.0 647.56 0.5585 1809.0 291.14 0.2359 0.5617 0.9265 3213952 Ald1-H_000459 OC(=O)CCCCCC(=O)N/N=C/c1ccc(O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H08 compound treatment 1971.0 531.56 0.4584 1991.0 473.14 0.3833 0.5952 0.996 3213954 Ald1-H_000460 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H09 compound treatment 1674.0 234.56 0.2023 2326.0 808.14 0.6547 0.606 0.8843 3213956 Ald1-H_000461 OC(=O)CCCCCC(=O)N/N=C/c1c(O)cc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H10 compound treatment 1466.0 26.558 0.0229 1770.0 252.14 0.2043 0.1606 0.7815 3213958 Ald1-H_000462 OC(=O)CCCCCCC(=O)N/N=C/c1c(O)cc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H11 compound treatment 1378.0 -61.442 -0.053 1768.0 250.14 0.2026 0.1058 0.5052 3213960 Ald1-H_000463 COc1cc(OC)c(/C=N/NC(=O)CCCCCC(=O)O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H12 compound treatment 1657.0 217.56 0.1876 1721.0 203.14 0.1646 0.249 0.9979 3213962 Ald1-H_000464 COc1cc(OC)c(/C=N/NC(=O)CCCCCCC(=O)O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H13 compound treatment 1819.0 379.56 0.3274 2162.0 644.14 0.5218 0.6005 0.9748 3213964 Ald1-H_000465 COc1cc(/C=N/NC(=O)CCCCCC(=O)O)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H14 compound treatment 1650.0 210.56 0.1816 1114.0 -403.86 -0.3272 -0.1029 -0.2751 3213966 Ald1-H_000466 COc1cc(/C=N/NC(=O)CCCCCCC(=O)O)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H15 compound treatment 1490.0 50.558 0.0436 2163.0 645.14 0.5226 0.4004 0.7634 3213968 Ald1-H_000467 CC(C)(C)/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H16 compound treatment 1373.0 -66.442 -0.0573 1135.0 -382.86 -0.3102 -0.2598 -0.8238 3213970 Ald1-H_000468 CC(C)(C)/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H17 compound treatment 1525.0 85.558 0.0738 1379.0 -138.86 -0.1125 -0.0274 -0.2034 3213972 Ald1-H_000469 CC1=C(C/C=N/NC(=O)CCCCCC(=O)O)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H18 compound treatment 1170.0 -269.44 -0.2324 1252.0 -265.86 -0.2154 -0.3166 -0.9993 3213974 Ald1-H_000470 CC1=C(C/C=N/NC(=O)CCCCCCC(=O)O)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H19 mock treatment 1055.0 -384.44 -0.3316 1314.0 -203.86 -0.1651 -0.3512 -0.9482 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H20 mock treatment 721.0 -718.44 -0.6196 797.0 -720.86 -0.584 -0.8511 -0.9996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H21 compound treatment 756.0 -683.44 -0.5894 852.0 -665.86 -0.5394 -0.7982 -0.999 3213976 Ald1-H_000471 NC(=O)COc1ccccc1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H22 compound treatment 490.0 -949.44 -0.8189 838.0 -679.86 -0.5508 -0.9685 -0.9814 3213978 Ald1-H_000472 NC(=O)COc1ccccc1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H23 compound treatment 352.0 -1087.4 -0.9379 923.0 -594.86 -0.4819 -1.0039 -0.9521 3213980 Ald1-H_000473 NC(=O)COc1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 H24 compound treatment 844.0 -595.44 -0.5135 394.0 -1123.9 -0.9105 -1.0069 -0.9633 3213982 Ald1-H_000474 NC(=O)COc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I01 compound treatment 1700.0 260.56 0.2247 2151.0 633.14 0.5129 0.5216 0.9314 3213984 Ald1-H_000475 COc1cc(Cl)c(/C=N/NC(=O)CCCCCCC(=O)O)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I02 compound treatment 1814.0 374.56 0.323 1657.0 139.14 0.1127 0.3081 0.9006 3213986 Ald1-H_000476 COc1cc(Cl)c(/C=N/NC(=O)CCCCCC(=O)O)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I03 compound treatment 1956.0 516.56 0.4455 2040.0 522.14 0.423 0.6141 0.9997 3213988 Ald1-H_000477 OC(=O)CCCCCCC(=O)N/N=C/c1cc(Cl)cc(Cl)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I04 compound treatment 1621.0 181.56 0.1566 1934.0 416.14 0.3371 0.3491 0.9392 3213990 Ald1-H_000478 OC(=O)CCCCCC(=O)N/N=C/c1cc(Cl)cc(Cl)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I05 mock treatment 1926.0 486.56 0.4196 2020.0 502.14 0.4068 0.5844 0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I06 mock treatment 1601.0 161.56 0.1393 2067.0 549.14 0.4449 0.4131 0.8861 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I07 compound treatment 1842.0 402.56 0.3472 1896.0 378.14 0.3063 0.4621 0.9981 3213992 Ald1-H_000479 OC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I08 compound treatment 1331.0 -108.44 -0.0935 1354.0 -163.86 -0.1327 -0.16 -0.9853 3213994 Ald1-H_000480 OC(=O)CCCCCC(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I09 compound treatment 1429.0 -10.442 -0.009 1857.0 339.14 0.2747 0.1879 0.6836 3213996 Ald1-H_000481 CCN(CC)c1ccc(/C=N/NC(=O)CCCCCCC(=O)O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I10 compound treatment 1365.0 -74.442 -0.0642 1295.0 -222.86 -0.1805 -0.1731 -0.9032 3213998 Ald1-H_000482 CCN(CC)c1ccc(/C=N/NC(=O)CCCCCC(=O)O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I11 compound treatment 1583.0 143.56 0.1238 1951.0 433.14 0.3509 0.3357 0.9021 3214000 Ald1-H_000483 OC(=O)CCCCCCC(=O)N/N=C/c1ccc2OCCc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I12 compound treatment 1836.0 396.56 0.342 1594.0 76.143 0.0617 0.2855 0.8214 3214002 Ald1-H_000484 OC(=O)CCCCCC(=O)N/N=C/c1ccc2OCCc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I13 compound treatment 1409.0 -30.442 -0.0263 1787.0 269.14 0.218 0.1356 0.6175 3214004 Ald1-H_000485 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I14 compound treatment 1368.0 -71.442 -0.0616 1239.0 -278.86 -0.2259 -0.2033 -0.8683 3214006 Ald1-H_000486 OC(=O)CCCCCC(=O)N/N=C/c1cccc(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I15 compound treatment 888.0 -551.44 -0.4756 1268.0 -249.86 -0.2024 -0.4794 -0.9275 3214008 Ald1-H_000487 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I16 compound treatment 789.0 -650.44 -0.561 1098.0 -419.86 -0.3401 -0.6372 -0.9713 3214010 Ald1-H_000488 OC(=O)CCCCCC(=O)N/N=C/c1ccc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I17 compound treatment 1356.0 -83.442 -0.072 1795.0 277.14 0.2245 0.1079 0.4575 3214012 Ald1-H_000489 OC(=O)CCCCCCC(=O)N/N=C/c1cc(O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I18 compound treatment 1072.0 -367.44 -0.3169 1091.0 -426.86 -0.3458 -0.4686 -0.9991 3214014 Ald1-H_000490 OC(=O)CCCCCC(=O)N/N=C/c1cc(O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I19 compound treatment 1011.0 -428.44 -0.3695 1510.0 -7.8571 -0.0064 -0.2658 -0.7192 3214016 Ald1-H_000491 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I20 compound treatment 1076.0 -363.44 -0.3135 1137.0 -380.86 -0.3085 -0.4398 -1.0 3214018 Ald1-H_000492 OC(=O)CCCCCC(=O)N/N=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I21 mock treatment 1065.0 -374.44 -0.3229 1316.0 -201.86 -0.1635 -0.344 -0.9503 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I22 mock treatment 658.0 -781.44 -0.674 816.0 -701.86 -0.5686 -0.8786 -0.9964 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I23 compound treatment 1270.0 -169.44 -0.1461 762.0 -755.86 -0.6123 -0.5363 -0.8519 3214020 Ald1-H_000493 COc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 I24 compound treatment 593.0 -846.44 -0.73 443.0 -1074.9 -0.8708 -1.1319 -0.9962 3214022 Ald1-H_000494 COc1ccc(/C=N/NC(=O)CCCCCC(=O)O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J01 compound treatment 1739.0 299.56 0.2584 1626.0 108.14 0.0876 0.2446 0.8967 3214024 Ald1-H_000495 OC(=O)CCCCCC(=O)NN=C1CCCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J02 compound treatment 1507.0 67.558 0.0583 1432.0 -85.857 -0.0696 -0.008 -0.088 3214025 Ald1-H_000496 OC(=O)CCCCCCC(=O)NN=C1CCCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J03 compound treatment 1572.0 132.56 0.1143 1797.0 279.14 0.2261 0.2407 0.9501 3214026 Ald1-H_000497 OC(=O)CCCCCC(=O)NN=C1CCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J04 compound treatment 1374.0 -65.442 -0.0564 1459.0 -58.857 -0.0477 -0.0736 -0.9965 3214027 Ald1-H_000498 OC(=O)CCCCCCC(=O)NN=C1CCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J05 mock treatment 1614.0 174.56 0.1505 1748.0 230.14 0.1864 0.2383 0.9944 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J06 mock treatment 1743.0 303.56 0.2618 1141.0 -376.86 -0.3053 -0.0308 -0.0765 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J07 compound treatment 1724.0 284.56 0.2454 1613.0 95.143 0.0771 0.228 0.8865 3214028 Ald1-H_000499 OC(=O)CCCCCC(=O)NN=C1CCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J08 compound treatment 1408.0 -31.442 -0.0271 317.0 -1200.9 -0.9728 -0.7071 -0.7265 3214029 Ald1-H_000500 OC(=O)CCCCCCC(=O)NN=C1CCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J09 mock treatment 1666.0 226.56 0.1954 1982.0 464.14 0.376 0.404 0.9535 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J10 mock treatment 1538.0 98.558 0.085 1355.0 -162.86 -0.1319 -0.0332 -0.2114 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J11 compound treatment 1719.0 279.56 0.2411 1733.0 215.14 0.1743 0.2937 0.9873 3214030 Ald1-H_000501 COc1cc(Br)c(/C=N/NC(=O)CCCCCC(=O)O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J12 compound treatment 1023.0 -416.44 -0.3592 1012.0 -505.86 -0.4098 -0.5437 -0.9978 3214032 Ald1-H_000502 COc1cc(Br)c(/C=N/NC(=O)CCCCCCC(=O)O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J13 compound treatment 1829.0 389.56 0.336 2213.0 695.14 0.5631 0.6358 0.9695 3214034 Ald1-H_000503 OC(=O)CCCCCC(=O)N/N=C/CCC1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J14 compound treatment 1354.0 -85.442 -0.0737 1426.0 -91.857 -0.0744 -0.1047 -1.0 3214036 Ald1-H_000504 OC(=O)CCCCCCC(=O)N/N=C/CCC1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J15 compound treatment 1574.0 134.56 0.1161 1331.0 -186.86 -0.1514 -0.025 -0.131 3214038 Ald1-H_000505 OC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J16 compound treatment 1084.0 -355.44 -0.3066 696.0 -821.86 -0.6658 -0.6876 -0.938 3214040 Ald1-H_000506 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J17 compound treatment 10.0 -1429.4 -1.2328 11.0 -1506.9 -1.2207 -1.7349 -1.0 3214042 Ald1-H_000507 OC(=O)CCCCCC(=O)N/N=C/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J18 compound treatment 75.0 -1364.4 -1.1768 45.0 -1472.9 -1.1932 -1.6758 -1.0 3214044 Ald1-H_000508 OC(=O)CCCCCCC(=O)N/N=C/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J19 mock treatment 1538.0 98.558 0.085 1621.0 103.14 0.0836 0.1192 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J20 mock treatment 1087.0 -352.44 -0.304 980.0 -537.86 -0.4357 -0.523 -0.9845 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J21 mock treatment 1636.0 196.56 0.1695 1435.0 -82.857 -0.0671 0.0724 0.3971 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J22 mock treatment 1551.0 111.56 0.0962 488.0 -1029.9 -0.8343 -0.5219 -0.6214 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J23 mock treatment 1487.0 47.558 0.041 969.0 -548.86 -0.4446 -0.2854 -0.6392 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 J24 mock treatment 1455.0 15.558 0.0134 84.0 -1433.9 -1.1616 -0.8119 -0.6989 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K01 compound treatment 743.0 -696.44 -0.6007 2184.0 666.14 0.5397 -0.0431 -0.0534 3214046 Ald1-H_000509 COc1cccc(OC)c1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K02 compound treatment 1427.0 -12.442 -0.0107 1614.0 96.143 0.0779 0.0475 0.604 3214048 Ald1-H_000510 COc1cccc(OC)c1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K03 compound treatment 1968.0 528.56 0.4559 2231.0 713.14 0.5777 0.7309 0.9931 3214050 Ald1-H_000511 COc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K04 compound treatment 1570.0 130.56 0.1126 1940.0 422.14 0.342 0.3214 0.8928 3214052 Ald1-H_000512 COc1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K05 compound treatment 1906.0 466.56 0.4024 2037.0 519.14 0.4206 0.5819 0.9998 3214054 Ald1-H_000513 COc1cc(O)cc(OC)c1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K06 compound treatment 1255.0 -184.44 -0.1591 1841.0 323.14 0.2618 0.0726 0.2371 3214056 Ald1-H_000514 COc1cc(O)cc(OC)c1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K07 mock treatment 1647.0 207.56 0.179 2364.0 846.14 0.6855 0.6113 0.8628 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K08 mock treatment 1119.0 -320.44 -0.2764 2039.0 521.14 0.4222 0.1031 0.2043 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K09 compound treatment 1591.0 151.56 0.1307 2508.0 990.14 0.8021 0.6596 0.8116 3214058 Ald1-H_000515 CC1(C)COC(CCC/C=N/NC(=O)CCCCCCC(=O)O)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K10 compound treatment 1210.0 -229.44 -0.1979 2427.0 909.14 0.7365 0.3809 0.4994 3214060 Ald1-H_000516 CC1(C)COC(CCC/C=N/NC(=O)CCCCCC(=O)O)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K11 compound treatment 1425.0 -14.442 -0.0125 2442.0 924.14 0.7487 0.5206 0.6952 3214062 Ald1-H_000517 Cc1nnc(Sc2ccc(/C=N/NC(=O)CCCCCCC(=O)O)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K12 compound treatment 2014.0 574.56 0.4955 1328.0 -189.86 -0.1538 0.2416 0.4657 3214064 Ald1-H_000518 Cc1nnc(Sc2ccc(/C=N/NC(=O)CCCCCC(=O)O)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K13 compound treatment 1566.0 126.56 0.1092 2232.0 714.14 0.5785 0.4863 0.8259 3214066 Ald1-H_000519 OC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)cs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K14 compound treatment 1238.0 -201.44 -0.1737 1262.0 -255.86 -0.2073 -0.2694 -0.9961 3214068 Ald1-H_000520 OC(=O)CCCCCC(=O)N/N=C/c1cc(Br)cs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K15 mock treatment 1001.0 -438.44 -0.3781 1927.0 409.14 0.3315 -0.033 -0.0657 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K16 mock treatment 1211.0 -228.44 -0.197 1391.0 -126.86 -0.1028 -0.212 -0.954 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K17 compound treatment 1000.0 -439.44 -0.379 1842.0 324.14 0.2626 -0.0823 -0.1785 3214070 Ald1-H_000521 CC(C)(C)OC(=O)NC/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K18 compound treatment 933.0 -506.44 -0.4368 1743.0 225.14 0.1824 -0.1799 -0.38 3214072 Ald1-H_000522 CC(C)(C)OC(=O)NC/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K19 compound treatment 970.0 -469.44 -0.4049 1911.0 393.14 0.3185 -0.0611 -0.1186 3214074 Ald1-H_000523 OC(=O)CCCCCCC(=O)N/N=C/c1ccc-2c(Cc3ccccc32)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K20 compound treatment 922.0 -517.44 -0.4463 942.0 -575.86 -0.4665 -0.6454 -0.9998 3214076 Ald1-H_000524 OC(=O)CCCCCC(=O)N/N=C/c1ccc-2c(Cc3ccccc32)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K21 compound treatment 989.0 -450.44 -0.3885 1346.0 -171.86 -0.1392 -0.3731 -0.9042 3214078 Ald1-H_000525 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K22 compound treatment 953.0 -486.44 -0.4195 999.0 -518.86 -0.4203 -0.5939 -1.0 3214080 Ald1-H_000526 OC(=O)CCCCCC(=O)N/N=C/c1ccc(F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K23 mock treatment 1088.0 -351.44 -0.3031 1078.0 -439.86 -0.3563 -0.4663 -0.9968 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 K24 mock treatment 889.0 -550.44 -0.4747 176.0 -1341.9 -1.0871 -1.1044 -0.931 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L01 mock treatment 2328.0 888.56 0.7663 2610.0 1092.1 0.8848 1.1675 0.9974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L02 mock treatment 1651.0 211.56 0.1825 1656.0 138.14 0.1119 0.2082 0.9725 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L03 mock treatment 2176.0 736.56 0.6353 2877.0 1359.1 1.1011 1.2278 0.9658 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L04 mock treatment 1742.0 302.56 0.2609 1887.0 369.14 0.299 0.396 0.9977 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L05 mock treatment 2337.0 897.56 0.7741 2080.0 562.14 0.4554 0.8694 0.968 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L06 mock treatment 1705.0 265.56 0.229 2270.0 752.14 0.6093 0.5928 0.9107 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L07 mock treatment 1830.0 390.56 0.3368 2638.0 1120.1 0.9074 0.8798 0.909 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L08 mock treatment 1652.0 212.56 0.1833 1992.0 474.14 0.3841 0.4012 0.9427 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L09 mock treatment 1922.0 482.56 0.4162 3759.0 2241.1 1.8156 1.5781 0.8472 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L10 mock treatment 1524.0 84.558 0.0729 1829.0 311.14 0.2521 0.2298 0.8758 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L11 mock treatment 1383.0 -56.442 -0.0487 2619.0 1101.1 0.8921 0.5964 0.6675 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L12 mock treatment 1665.0 225.56 0.1945 1823.0 305.14 0.2472 0.3124 0.993 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L13 mock treatment 1522.0 82.558 0.0712 2013.0 495.14 0.4011 0.334 0.8198 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L14 mock treatment 1254.0 -185.44 -0.1599 1143.0 -374.86 -0.3037 -0.3278 -0.9551 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L15 mock treatment 1641.0 201.56 0.1738 2409.0 891.14 0.7219 0.6334 0.853 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L16 mock treatment 1133.0 -306.44 -0.2643 1358.0 -159.86 -0.1295 -0.2785 -0.9461 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L17 compound treatment 1477.0 37.558 0.0324 1523.0 5.1429 0.0042 0.0259 0.7915 3214082 Ald1-H_000527 OC(=O)CCCCCC(=O)N/N=C/c1ccc(Oc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L18 compound treatment 1107.0 -332.44 -0.2867 1681.0 163.14 0.1322 -0.1093 -0.3462 3214084 Ald1-H_000528 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(Oc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L19 compound treatment 1241.0 -198.44 -0.1711 1540.0 22.143 0.0179 -0.1083 -0.6295 3214086 Ald1-H_000529 OC(=O)CCCCCC(=O)N/N=C/c1cc[n+]([O-])cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L20 compound treatment 1294.0 -145.44 -0.1254 845.0 -672.86 -0.5451 -0.4741 -0.8477 3214088 Ald1-H_000530 OC(=O)CCCCCCC(=O)N/N=C/c1cc[n+]([O-])cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L21 compound treatment 524.0 -915.44 -0.7895 1147.0 -370.86 -0.3004 -0.7707 -0.9124 3214090 Ald1-H_000531 OC(=O)CCCCCC(=O)N/N=C/c1ccc2ccccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L22 compound treatment 973.0 -466.44 -0.4023 1028.0 -489.86 -0.3968 -0.5651 -1.0 3214092 Ald1-H_000532 OC(=O)CCCCCCC(=O)N/N=C/c1ccc2ccccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L23 mock treatment 1209.0 -230.44 -0.1987 1187.0 -330.86 -0.268 -0.3301 -0.9892 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 L24 mock treatment 969.0 -470.44 -0.4057 706.0 -811.86 -0.6577 -0.752 -0.9731 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M01 compound treatment 2053.0 613.56 0.5292 2213.0 695.14 0.5631 0.7724 0.9995 3214094 Ald1-H_000533 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c(F)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M02 compound treatment 1778.0 338.56 0.292 1661.0 143.14 0.116 0.2885 0.9182 3214096 Ald1-H_000534 OC(=O)CCCCCC(=O)N/N=C/c1ccc(O)c(F)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M03 compound treatment 2070.0 630.56 0.5438 2191.0 673.14 0.5453 0.7701 1.0 3214098 Ald1-H_000535 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(F)c(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M04 compound treatment 1523.0 83.558 0.0721 1956.0 438.14 0.3549 0.3019 0.8337 3214100 Ald1-H_000536 OC(=O)CCCCCC(=O)N/N=C/c1ccc(F)c(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M05 compound treatment 3679.0 2239.6 1.9315 2020.0 502.14 0.4068 1.6534 0.8377 3214102 Ald1-H_000537 OC(=O)CCCCCCC(=O)N/N=C/c1cc(F)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M06 compound treatment 2126.0 686.56 0.5921 2271.0 753.14 0.6101 0.8501 0.9999 3214104 Ald1-H_000538 OC(=O)CCCCCC(=O)N/N=C/c1cc(F)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M07 compound treatment 864.0 -575.44 -0.4963 2134.0 616.14 0.4991 0.002 0.0029 3214106 Ald1-H_000539 OC(=O)CCCCCCC(=O)N/N=C/c1coc2ccccc2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M08 compound treatment 1255.0 -184.44 -0.1591 2343.0 825.14 0.6685 0.3602 0.5242 3214108 Ald1-H_000540 OC(=O)CCCCCC(=O)N/N=C/c1coc2ccccc2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M09 mock treatment 1892.0 452.56 0.3903 2181.0 663.14 0.5372 0.6559 0.9877 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M10 mock treatment 1406.0 -33.442 -0.0288 2030.0 512.14 0.4149 0.273 0.6564 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M11 compound treatment 827.0 -612.44 -0.5282 1683.0 165.14 0.1338 -0.2789 -0.5118 3214110 Ald1-H_000541 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M12 compound treatment 1343.0 -96.442 -0.0832 1735.0 217.14 0.1759 0.0656 0.337 3214112 Ald1-H_000542 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M13 mock treatment 1386.0 -53.442 -0.0461 1677.0 159.14 0.1289 0.0586 0.4278 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M14 mock treatment 1189.0 -250.44 -0.216 900.0 -617.86 -0.5005 -0.5067 -0.9294 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M15 compound treatment 978.0 -461.44 -0.398 1393.0 -124.86 -0.1011 -0.3529 -0.8595 3214114 Ald1-H_000543 OB(O)c1cccc(/C=N/NC(=O)CCCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M16 compound treatment 1529.0 89.558 0.0772 1860.0 342.14 0.2772 0.2506 0.871 3214116 Ald1-H_000544 OB(O)c1cccc(/C=N/NC(=O)CCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M17 compound treatment 1285.0 -154.44 -0.1332 1689.0 171.14 0.1386 0.0039 0.02 3214118 Ald1-H_000545 OC(=O)CCCCCCC(=O)N/N=C/c1ccco1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M18 compound treatment 955.0 -484.44 -0.4178 972.0 -545.86 -0.4422 -0.6081 -0.9996 3214120 Ald1-H_000546 OC(=O)CCCCCC(=O)N/N=C/c1ccco1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M19 compound treatment 990.0 -449.44 -0.3876 1422.0 -95.857 -0.0777 -0.329 -0.8322 3214122 Ald1-H_000547 OC(=O)CCCCCCC(=O)N/N=C/c1ccoc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M20 compound treatment 858.0 -581.44 -0.5015 653.0 -864.86 -0.7006 -0.85 -0.9866 3214124 Ald1-H_000548 OC(=O)CCCCCC(=O)N/N=C/c1ccoc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M21 compound treatment 1265.0 -174.44 -0.1504 1505.0 -12.857 -0.0104 -0.1137 -0.7543 3214126 Ald1-H_000549 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M22 compound treatment 1037.0 -402.44 -0.3471 1099.0 -418.86 -0.3393 -0.4854 -0.9999 3214128 Ald1-H_000550 OC(=O)CCCCCC(=O)N/N=C/c1cccc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M23 compound treatment 1085.0 -354.44 -0.3057 934.0 -583.86 -0.473 -0.5506 -0.9777 3214130 Ald1-H_000551 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 M24 compound treatment 742.0 -697.44 -0.6015 274.0 -1243.9 -1.0077 -1.1379 -0.9696 3214132 Ald1-H_000552 OC(=O)CCCCCC(=O)N/N=C/c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N01 compound treatment 1877.0 437.56 0.3774 2009.0 491.14 0.3979 0.5482 0.9997 3214134 Ald1-H_000553 Cc1ccccc1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N02 compound treatment 1922.0 482.56 0.4162 1925.0 407.14 0.3298 0.5275 0.9934 3214136 Ald1-H_000554 Cc1ccccc1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N03 compound treatment 1982.0 542.56 0.4679 2221.0 703.14 0.5696 0.7337 0.9952 3214138 Ald1-H_000555 COc1cc(/C=N/NC(=O)CCCCCC(=O)O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N04 compound treatment 1302.0 -137.44 -0.1185 1915.0 397.14 0.3217 0.1437 0.419 3214140 Ald1-H_000556 COc1cc(/C=N/NC(=O)CCCCCCC(=O)O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N05 mock treatment 1527.0 87.558 0.0755 2255.0 737.14 0.5972 0.4757 0.7902 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N06 mock treatment 1588.0 148.56 0.1281 2493.0 975.14 0.79 0.6492 0.8112 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N07 mock treatment 2047.0 607.56 0.524 2220.0 702.14 0.5688 0.7727 0.9992 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N08 mock treatment 1993.0 553.56 0.4774 2415.0 897.14 0.7268 0.8515 0.9792 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N09 mock treatment 1647.0 207.56 0.179 2296.0 778.14 0.6304 0.5723 0.8734 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N10 mock treatment 1424.0 -15.442 -0.0133 2124.0 606.14 0.491 0.3378 0.6877 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N11 compound treatment 1367.0 -72.442 -0.0625 2428.0 910.14 0.7373 0.4772 0.6449 3214142 Ald1-H_000557 COc1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N12 compound treatment 1721.0 281.56 0.2428 1770.0 252.14 0.2043 0.3161 0.9963 3214144 Ald1-H_000558 COc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N13 mock treatment 1481.0 41.558 0.0358 1521.0 3.1429 0.0025 0.0271 0.7554 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N14 mock treatment 3578.0 2138.6 1.8444 1962.0 444.14 0.3598 1.5586 0.8294 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N15 compound treatment 1530.0 90.558 0.0781 2544.0 1026.1 0.8313 0.643 0.7701 3214146 Ald1-H_000559 CCOc1cccc(/C=N/NC(=O)CCCCCC(=O)O)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N16 compound treatment 1619.0 179.56 0.1549 1988.0 470.14 0.3809 0.3788 0.9214 3214148 Ald1-H_000560 CCOc1cccc(/C=N/NC(=O)CCCCCCC(=O)O)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N17 compound treatment 1162.0 -277.44 -0.2393 1970.0 452.14 0.3663 0.0898 0.2053 3214150 Ald1-H_000561 OC(=O)CCCCCC(=O)N/N=C/c1cc(I)cc(I)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N18 compound treatment 1153.0 -286.44 -0.247 1810.0 292.14 0.2367 -0.0073 -0.0214 3214152 Ald1-H_000562 OC(=O)CCCCCCC(=O)N/N=C/c1cc(I)cc(I)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N19 compound treatment 990.0 -449.44 -0.3876 554.0 -963.86 -0.7808 -0.8262 -0.9478 3214154 Ald1-H_000563 CN(C)c1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N20 compound treatment 773.0 -666.44 -0.5748 1489.0 -28.857 -0.0234 -0.423 -0.7353 3214156 Ald1-H_000564 CN(C)c1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N21 compound treatment 882.0 -557.44 -0.4808 1353.0 -164.86 -0.1336 -0.4344 -0.8706 3214158 Ald1-H_000565 CCn1c2ccccc2c3cc(/C=N/NC(=O)CCCCCC(=O)O)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N22 compound treatment 1179.0 -260.44 -0.2246 1595.0 77.143 0.0625 -0.1146 -0.4917 3214160 Ald1-H_000566 CCn1c2ccccc2c3cc(/C=N/NC(=O)CCCCCCC(=O)O)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N23 compound treatment 917.0 -522.44 -0.4506 883.0 -634.86 -0.5143 -0.6823 -0.9978 3214162 Ald1-H_000567 OC(=O)CCCCCC(=O)N/N=C/c1ccc(c(F)c1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 N24 compound treatment 736.0 -703.44 -0.6067 826.0 -691.86 -0.5605 -0.8253 -0.9992 3214164 Ald1-H_000568 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(c(F)c1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O01 compound treatment 2139.0 699.56 0.6033 1764.0 246.14 0.1994 0.5676 0.8933 3214166 Ald1-H_000569 OCCOc1ccccc1/C=N/NC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O02 compound treatment 1735.0 295.56 0.2549 1530.0 12.143 0.0098 0.1872 0.7338 3214168 Ald1-H_000570 OCCOc1ccccc1/C=N/NC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O03 compound treatment 1641.0 201.56 0.1738 2095.0 577.14 0.4676 0.4535 0.9092 3214170 Ald1-H_000571 OCCOc1cccc(/C=N/NC(=O)CCCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O04 compound treatment 1211.0 -228.44 -0.197 1696.0 178.14 0.1443 -0.0373 -0.1526 3214172 Ald1-H_000572 OCCOc1cccc(/C=N/NC(=O)CCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O05 compound treatment 1971.0 531.56 0.4584 2457.0 939.14 0.7608 0.8621 0.9706 3214174 Ald1-H_000573 OCCOc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O06 compound treatment 399.0 -1040.4 -0.8973 2067.0 549.14 0.4449 -0.3199 -0.3194 3214176 Ald1-H_000574 OCCOc1ccc(/C=N/NC(=O)CCCCCC(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O07 compound treatment 1391.0 -48.442 -0.0418 1955.0 437.14 0.3541 0.2209 0.6194 3214178 Ald1-H_000575 COc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O08 compound treatment 1429.0 -10.442 -0.009 1589.0 71.143 0.0576 0.0344 0.5895 3214180 Ald1-H_000576 COc1ccc(/C=N/NC(=O)CCCCCC(=O)O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O09 compound treatment 1365.0 -74.442 -0.0642 2478.0 960.14 0.7778 0.5046 0.6465 3214182 Ald1-H_000577 COc1ccc(O)c(/C=N/NC(=O)CCCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O10 compound treatment 1529.0 89.558 0.0772 1984.0 466.14 0.3776 0.3216 0.8345 3214184 Ald1-H_000578 COc1ccc(O)c(/C=N/NC(=O)CCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O11 mock treatment 1140.0 -299.44 -0.2583 2423.0 905.14 0.7333 0.3359 0.4321 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O12 mock treatment 1305.0 -134.44 -0.116 1218.0 -299.86 -0.2429 -0.2538 -0.9427 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O13 compound treatment 1519.0 79.558 0.0686 1974.0 456.14 0.3695 0.3098 0.8243 3214186 Ald1-H_000579 COc1cc(/C=C/C=N/NC(=O)CCCCCCC(=O)O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O14 compound treatment 1045.0 -394.44 -0.3402 1821.0 303.14 0.2456 -0.0669 -0.1594 3214188 Ald1-H_000580 COc1cc(/C=C/C=N/NC(=O)CCCCCC(=O)O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O15 compound treatment 897.0 -542.44 -0.4678 1652.0 134.14 0.1087 -0.254 -0.5288 3214190 Ald1-H_000581 Cc1ccc(O)c(/C=N/NC(=O)CCCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O16 compound treatment 1105.0 -334.44 -0.2884 1580.0 62.143 0.0503 -0.1684 -0.575 3214192 Ald1-H_000582 Cc1ccc(O)c(/C=N/NC(=O)CCCCCC(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O17 compound treatment 1106.0 -333.44 -0.2876 1378.0 -139.86 -0.1133 -0.2835 -0.9171 3214194 Ald1-H_000583 OCc1ccc(/C=N/NC(=O)CCCCCCC(=O)O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O18 compound treatment 739.0 -700.44 -0.6041 1417.0 -100.86 -0.0817 -0.4849 -0.7955 3214196 Ald1-H_000584 OCc1ccc(/C=N/NC(=O)CCCCCC(=O)O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O19 compound treatment 918.0 -521.44 -0.4497 1188.0 -329.86 -0.2672 -0.507 -0.9691 3214198 Ald1-H_000585 OC(=O)CCCCCCC(=O)N/N=C/c1ccc2ccccc2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O20 compound treatment 896.0 -543.44 -0.4687 678.0 -839.86 -0.6804 -0.8125 -0.9835 3214200 Ald1-H_000586 OC(=O)CCCCCC(=O)N/N=C/c1ccc2ccccc2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O21 compound treatment 336.0 -1103.4 -0.9517 1040.0 -477.86 -0.3871 -0.9467 -0.9214 3214202 Ald1-H_000587 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(o1)c2cccc(Cl)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O22 compound treatment 1178.0 -261.44 -0.2255 569.0 -948.86 -0.7687 -0.703 -0.8776 3214204 Ald1-H_000588 OC(=O)CCCCCC(=O)N/N=C/c1ccc(o1)c2cccc(Cl)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O23 compound treatment 834.0 -605.44 -0.5222 1112.0 -405.86 -0.3288 -0.6017 -0.9751 3214206 Ald1-H_000589 OC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)c(O)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 O24 compound treatment 705.0 -734.44 -0.6334 407.0 -1110.9 -0.8999 -1.0842 -0.9852 3214208 Ald1-H_000590 OC(=O)CCCCCC(=O)N/N=C/c1cc(Br)c(O)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P01 compound treatment 1413.0 -26.442 -0.0228 1713.0 195.14 0.1581 0.0957 0.5989 3214210 Ald1-H_000591 OC(=O)CCCCCC(=O)N/N=C/c1ccc(o1)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P02 compound treatment 1330.0 -109.44 -0.0944 981.0 -536.86 -0.4349 -0.3743 -0.841 3214212 Ald1-H_000592 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(o1)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P03 mock treatment 1721.0 281.56 0.2428 1602.0 84.143 0.0682 0.2199 0.8719 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P04 mock treatment 1395.0 -44.442 -0.0383 1435.0 -82.857 -0.0671 -0.0746 -0.9647 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P05 mock treatment 1630.0 190.56 0.1643 1587.0 69.143 0.056 0.1558 0.8974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P06 mock treatment 1361.0 -78.442 -0.0677 1224.0 -293.86 -0.2381 -0.2162 -0.8735 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P07 mock treatment 316.0 -1123.4 -0.9689 1894.0 376.14 0.3047 -0.4697 -0.4624 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P08 mock treatment 1079.0 -360.44 -0.3109 1194.0 -323.86 -0.2624 -0.4053 -0.9964 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P09 mock treatment 1138.0 -301.44 -0.26 1325.0 -192.86 -0.1562 -0.2943 -0.9703 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P10 mock treatment 1229.0 -210.44 -0.1815 1391.0 -126.86 -0.1028 -0.201 -0.9637 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P11 mock treatment 1295.0 -144.44 -0.1246 1550.0 32.143 0.026 -0.0697 -0.5475 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P12 mock treatment 864.0 -575.44 -0.4963 1071.0 -446.86 -0.362 -0.6069 -0.988 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P13 mock treatment 859.0 -580.44 -0.5006 1168.0 -349.86 -0.2834 -0.5544 -0.9637 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P14 mock treatment 1068.0 -371.44 -0.3204 393.0 -1124.9 -0.9113 -0.8709 -0.9016 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P15 mock treatment 379.0 -1060.4 -0.9146 1077.0 -440.86 -0.3571 -0.8993 -0.9159 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P16 mock treatment 401.0 -1038.4 -0.8956 1000.0 -517.86 -0.4195 -0.9299 -0.9403 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P17 mock treatment 942.0 -497.44 -0.429 1025.0 -492.86 -0.3993 -0.5857 -0.9994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P18 mock treatment 1021.0 -418.44 -0.3609 1027.0 -490.86 -0.3977 -0.5364 -0.9988 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P19 mock treatment 1614.0 174.56 0.1505 1307.0 -210.86 -0.1708 -0.0143 -0.0629 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P20 mock treatment 734.0 -705.44 -0.6084 1305.0 -212.86 -0.1724 -0.5521 -0.8731 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P21 mock treatment 586.0 -853.44 -0.7361 814.0 -703.86 -0.5702 -0.9237 -0.992 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P22 mock treatment 663.0 -776.44 -0.6696 630.0 -887.86 -0.7193 -0.9821 -0.9994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P23 mock treatment 657.0 -782.44 -0.6748 307.0 -1210.9 -0.9809 -1.1708 -0.9833 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2132 P24 mock treatment 688.0 -751.44 -0.6481 223.0 -1294.9 -1.049 -1.2 -0.9732 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A01 compound treatment 1408.0 -342.22 -0.2952 887.0 -1091.5 -0.8842 -0.834 -0.8946 3214214 Ald1-H_000593 NNC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A02 compound treatment 1213.0 -537.22 -0.4633 2895.0 916.49 0.7425 0.1974 0.2255 3214215 Ald1-H_000594 NNC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A03 compound treatment 74.0 -1676.2 -1.4457 70.0 -1908.5 -1.5461 -2.1155 -0.9994 3214216 Ald1-H_000595 ONC(=O)CCCCCC(=O)N/N=C/c1ccccc1OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A04 compound treatment 257.0 -1493.2 -1.2878 0.0 -1978.5 -1.6028 -2.044 -0.9941 3214218 Ald1-H_000596 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccccc2OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A05 compound treatment 17.0 -1733.2 -1.4948 28.0 -1950.5 -1.5801 -2.1743 -0.9996 3214220 Ald1-H_000597 COc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A06 compound treatment 244.0 -1506.2 -1.2991 146.0 -1832.5 -1.4845 -1.9683 -0.9978 3214222 Ald1-H_000598 COc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A07 compound treatment 7.0 -1743.2 -1.5035 11.0 -1967.5 -1.5939 -2.1902 -0.9996 3214224 Ald1-H_000599 ONC(=O)CCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A08 compound treatment 498.0 -1252.2 -1.08 1.0 -1977.5 -1.602 -1.8965 -0.9816 3214226 Ald1-H_000600 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A09 compound treatment 28.0 -1722.2 -1.4853 43.0 -1935.5 -1.568 -2.159 -0.9996 3214228 Ald1-H_000601 ONC(=O)CCCCCC(=O)N/N=C/c1ccc2OCCOc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A10 compound treatment 262.0 -1488.2 -1.2835 36.0 -1942.5 -1.5737 -2.0203 -0.9949 3214230 Ald1-H_000602 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc3OCCOc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A11 compound treatment 827.0 -923.22 -0.7962 614.0 -1364.5 -1.1054 -1.3447 -0.987 3214232 Ald1-H_000603 ONC(=O)CCCCCC(=O)N/N=C/COCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A12 compound treatment 292.0 -1458.2 -1.2577 4.0 -1974.5 -1.5996 -2.0204 -0.9929 3214234 Ald1-H_000604 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/COCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A13 mock treatment 1664.0 -86.224 -0.0744 2223.0 244.49 0.1981 0.0875 0.4134 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A14 mock treatment 985.0 -765.22 -0.66 694.0 -1284.5 -1.0406 -1.2025 -0.9759 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A15 compound treatment 97.0 -1653.2 -1.4258 1.0 -1977.5 -1.602 -2.141 -0.9983 3214236 Ald1-H_000605 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A16 compound treatment 1.0 -1749.2 -1.5086 52.0 -1926.5 -1.5607 -2.1703 -0.9999 3214238 Ald1-H_000606 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A17 compound treatment 4.0 -1746.2 -1.506 5.0 -1973.5 -1.5988 -2.1954 -0.9996 3214240 Ald1-H_000607 ONC(=O)CCCCCC(=O)N/N=C/c1ccccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A18 compound treatment 28.0 -1722.2 -1.4853 123.0 -1855.5 -1.5032 -2.1132 -1.0 3214242 Ald1-H_000608 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccccc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A19 compound treatment 36.0 -1714.2 -1.4784 20.0 -1958.5 -1.5866 -2.1673 -0.9994 3214244 Ald1-H_000609 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A20 compound treatment 588.0 -1162.2 -1.0024 468.0 -1510.5 -1.2237 -1.5741 -0.9951 3214246 Ald1-H_000610 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccc(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A21 compound treatment 0.0 -1750.2 -1.5095 1.0 -1977.5 -1.602 -2.2002 -0.9996 3214248 Ald1-H_000611 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(Br)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A22 compound treatment 276.0 -1474.2 -1.2715 156.0 -1822.5 -1.4764 -1.9431 -0.9972 3214250 Ald1-H_000612 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(Br)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A23 compound treatment 251.0 -1499.2 -1.293 321.0 -1657.5 -1.3428 -1.8638 -0.9998 3214252 Ald1-H_000613 ONC(=O)CCCCCC(=O)N/N=C/C(=C/c1ccccc1)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 A24 compound treatment 25.0 -1725.2 -1.4879 188.0 -1790.5 -1.4505 -2.0778 -0.9999 3214254 Ald1-H_000614 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/C(=C/c2ccccc2)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B01 compound treatment 509.0 -1241.2 -1.0705 500.0 -1478.5 -1.1978 -1.6039 -0.9984 3214256 Ald1-H_000615 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2c(O)ccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B02 compound treatment 661.0 -1089.2 -0.9394 762.0 -1216.5 -0.9855 -1.3611 -0.9997 3214258 Ald1-H_000616 ONC(=O)CCCCCC(=O)N/N=C/c1c(O)ccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B03 compound treatment 1272.0 -478.22 -0.4124 1146.0 -832.51 -0.6744 -0.7685 -0.9722 3214260 Ald1-H_000617 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(O)c3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B04 compound treatment 480.0 -1270.2 -1.0955 613.0 -1365.5 -1.1062 -1.5569 -1.0 3214262 Ald1-H_000618 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(O)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B05 compound treatment 1407.0 -343.22 -0.296 2125.0 146.49 0.1187 -0.1254 -0.3932 3214264 Ald1-H_000619 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc([N+](=O)[O-])c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B06 compound treatment 1148.0 -602.22 -0.5194 1210.0 -768.51 -0.6226 -0.8075 -0.9959 3214266 Ald1-H_000620 ONC(=O)CCCCCC(=O)N/N=C/c1ccc([N+](=O)[O-])c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B07 compound treatment 1719.0 -31.224 -0.0269 1835.0 -143.51 -0.1163 -0.1012 -0.8484 3214268 Ald1-H_000621 Oc1ccc([N+](=O)[O-])c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B08 compound treatment 1049.0 -701.22 -0.6048 1559.0 -419.51 -0.3398 -0.668 -0.9628 3214270 Ald1-H_000622 ONC(=O)CCCCCC(=O)N/N=C/c1cc(O)ccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B09 compound treatment 1016.0 -734.22 -0.6332 919.0 -1059.5 -0.8583 -1.0547 -0.9888 3214272 Ald1-H_000623 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(cc2)n3ccnc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B10 compound treatment 385.0 -1365.2 -1.1774 361.0 -1617.5 -1.3104 -1.7592 -0.9986 3214274 Ald1-H_000624 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)n2ccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B11 compound treatment 547.0 -1203.2 -1.0377 683.0 -1295.5 -1.0495 -1.4759 -1.0 3214276 Ald1-H_000625 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2c[nH]c3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B12 compound treatment 303.0 -1447.2 -1.2482 426.0 -1552.5 -1.2577 -1.7719 -1.0 3214278 Ald1-H_000626 ONC(=O)CCCCCC(=O)N/N=C/c1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B13 mock treatment 1776.0 25.776 0.0222 1568.0 -410.51 -0.3326 -0.2194 -0.6584 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B14 mock treatment 317.0 -1433.2 -1.2361 1269.0 -709.51 -0.5748 -1.2805 -0.9393 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B15 compound treatment 548.0 -1202.2 -1.0369 995.0 -983.51 -0.7968 -1.2966 -0.9915 3214280 Ald1-H_000627 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(I)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B16 compound treatment 3.0 -1747.2 -1.5069 2.0 -1976.5 -1.6012 -2.1978 -0.9995 3214282 Ald1-H_000628 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(I)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B17 compound treatment 1089.0 -661.22 -0.5703 1352.0 -626.51 -0.5075 -0.7621 -0.9983 3214284 Ald1-H_000629 C/C=C(/C)\C=N\NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B18 compound treatment 203.0 -1547.2 -1.3344 385.0 -1593.5 -1.2909 -1.8564 -0.9999 3214286 Ald1-H_000630 C/C=C(/C)\C=N\NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B19 compound treatment 0.0 -1750.2 -1.5095 44.0 -1934.5 -1.5672 -2.1755 -0.9998 3214288 Ald1-H_000631 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccccc2[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B20 compound treatment 12.0 -1738.2 -1.4991 18.0 -1960.5 -1.5882 -2.1831 -0.9996 3214290 Ald1-H_000632 ONC(=O)CCCCCC(=O)N/N=C/c1ccccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B21 compound treatment 244.0 -1506.2 -1.2991 878.0 -1100.5 -0.8915 -1.549 -0.9831 3214292 Ald1-H_000633 Cc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B22 compound treatment 24.0 -1726.2 -1.4888 60.0 -1918.5 -1.5542 -2.1517 -0.9998 3214294 Ald1-H_000634 Cc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B23 compound treatment 774.0 -976.22 -0.842 975.0 -1003.5 -0.813 -1.1702 -0.9998 3214296 Ald1-H_000635 Cc1[nH]cnc1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 B24 compound treatment 101.0 -1649.2 -1.4224 143.0 -1835.5 -1.487 -2.0572 -0.9998 3214298 Ald1-H_000636 Cc1[nH]cnc1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C01 compound treatment 2159.0 408.78 0.3526 2221.0 242.49 0.1964 0.3882 0.9619 3214300 Ald1-H_000637 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(Br)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C02 compound treatment 853.0 -897.22 -0.7738 775.0 -1203.5 -0.975 -1.2366 -0.9934 3214302 Ald1-H_000638 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(Br)o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C03 compound treatment 837.0 -913.22 -0.7876 586.0 -1392.5 -1.1281 -1.3546 -0.9846 3214304 Ald1-H_000639 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C04 compound treatment 412.0 -1338.2 -1.1542 354.0 -1624.5 -1.316 -1.7467 -0.9979 3214306 Ald1-H_000640 Oc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C05 compound treatment 1107.0 -643.22 -0.5548 391.0 -1587.5 -1.2861 -1.3017 -0.9293 3214308 Ald1-H_000641 ONC(=O)CCCCCC(=O)N/N=C/c1cc(O)ccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C06 compound treatment 205.0 -1545.2 -1.3327 204.0 -1774.5 -1.4376 -1.9589 -0.9993 3214310 Ald1-H_000642 Oc1ccc(Br)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C07 compound treatment 1758.0 7.7761 0.0067 2321.0 342.49 0.2775 0.2009 0.724 3214312 Ald1-H_000643 COc1cc(Br)cc(/C=N/NC(=O)CCCCCC(=O)NO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C08 compound treatment 775.0 -975.22 -0.8411 1009.0 -969.51 -0.7854 -1.1501 -0.9994 3214314 Ald1-H_000644 COc1cc(Br)cc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C09 compound treatment 95.0 -1655.2 -1.4276 18.0 -1960.5 -1.5882 -2.1325 -0.9986 3214316 Ald1-H_000645 COc1ccc(Br)c(/C=N/NC(=O)CCCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C10 compound treatment 339.0 -1411.2 -1.2171 393.0 -1585.5 -1.2844 -1.7689 -0.9996 3214318 Ald1-H_000646 COc1ccc(Br)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C11 mock treatment 2159.0 408.78 0.3526 2331.0 352.49 0.2856 0.4512 0.9945 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C12 mock treatment 1488.0 -262.22 -0.2262 1461.0 -517.51 -0.4192 -0.4564 -0.958 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C13 compound treatment 1012.0 -738.22 -0.6367 1178.0 -800.51 -0.6485 -0.9088 -1.0 3214320 Ald1-H_000647 COc1ccc(Br)cc1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C14 compound treatment 569.0 -1181.2 -1.0188 413.0 -1565.5 -1.2682 -1.6172 -0.9941 3214322 Ald1-H_000648 COc1ccc(Br)cc1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C15 mock treatment 1513.0 -237.22 -0.2046 1993.0 14.493 0.0117 -0.1364 -0.6654 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C16 mock treatment 1191.0 -559.22 -0.4823 1593.0 -385.51 -0.3123 -0.5619 -0.9779 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C17 compound treatment 569.0 -1181.2 -1.0188 36.0 -1942.5 -1.5737 -1.8331 -0.9779 3214324 Ald1-H_000649 ONC(=O)CCCCCC(=O)N/N=C/c1cc2OCOc2cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C18 compound treatment 106.0 -1644.2 -1.4181 251.0 -1727.5 -1.3995 -1.9923 -1.0 3214326 Ald1-H_000650 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc3OCOc3cc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C19 compound treatment 108.0 -1642.2 -1.4164 97.0 -1881.5 -1.5242 -2.0793 -0.9993 3214328 Ald1-H_000651 ONC(=O)CCCCCC(=O)N/N=C/c1cccnc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C20 compound treatment 116.0 -1634.2 -1.4095 148.0 -1830.5 -1.4829 -2.0452 -0.9997 3214330 Ald1-H_000652 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccnc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C21 compound treatment 41.0 -1709.2 -1.4741 43.0 -1935.5 -1.568 -2.1511 -0.9995 3214332 Ald1-H_000653 ONC(=O)CCCCCC(=O)N/N=C/c1ccncc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C22 compound treatment 81.0 -1669.2 -1.4396 106.0 -1872.5 -1.5169 -2.0906 -0.9997 3214334 Ald1-H_000654 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccncc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C23 compound treatment 315.0 -1435.2 -1.2378 511.0 -1467.5 -1.1888 -1.7159 -0.9998 3214336 Ald1-H_000655 ONC(=O)CCCCCC(=O)N/N=C/c1cc(Br)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 C24 compound treatment 240.0 -1510.2 -1.3025 379.0 -1599.5 -1.2958 -1.8373 -1.0 3214338 Ald1-H_000656 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc(Br)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D01 compound treatment 773.0 -977.22 -0.8428 925.0 -1053.5 -0.8535 -1.1994 -1.0 3214340 Ald1-H_000657 Cc1ccsc1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D02 compound treatment 46.0 -1704.2 -1.4698 7.0 -1971.5 -1.5971 -2.1687 -0.9991 3214342 Ald1-H_000658 Cc1ccsc1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D03 compound treatment 2199.0 448.78 0.3871 1916.0 -62.507 -0.0506 0.2379 0.6094 3214344 Ald1-H_000659 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)CCCCCC(=O)Nc3ccccc3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D04 compound treatment 71.0 -1679.2 -1.4483 51.0 -1927.5 -1.5615 -2.1282 -0.9993 3214346 Ald1-H_000660 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D05 compound treatment 1253.0 -497.22 -0.4288 934.0 -1044.5 -0.8462 -0.9016 -0.9504 3214348 Ald1-H_000661 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D06 compound treatment 41.0 -1709.2 -1.4741 16.0 -1962.5 -1.5899 -2.1666 -0.9993 3214350 Ald1-H_000662 ONC(=O)CCCCCC(=O)N/N=C/c1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D07 compound treatment 1612.0 -138.22 -0.1192 1603.0 -375.51 -0.3042 -0.2994 -0.9164 3214352 Ald1-H_000663 COc1cc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D08 compound treatment 7.0 -1743.2 -1.5035 7.0 -1971.5 -1.5971 -2.1925 -0.9995 3214354 Ald1-H_000664 COc1cc(/C=N/NC(=O)CCCCCC(=O)NO)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D09 compound treatment 737.0 -1013.2 -0.8739 848.0 -1130.5 -0.9158 -1.2655 -0.9997 3214356 Ald1-H_000665 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc3ccccc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D10 compound treatment 24.0 -1726.2 -1.4888 23.0 -1955.5 -1.5842 -2.1729 -0.9995 3214358 Ald1-H_000666 ONC(=O)CCCCCC(=O)N/N=C/c1ccc2ccccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D11 mock treatment 2627.0 876.78 0.7562 2578.0 599.49 0.4857 0.8781 0.9771 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D12 mock treatment 1796.0 45.776 0.0395 2398.0 419.49 0.3398 0.2682 0.784 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D13 compound treatment 1697.0 -53.224 -0.0459 2339.0 360.49 0.292 0.174 0.5887 3214360 Ald1-H_000667 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(s2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D14 compound treatment 750.0 -1000.2 -0.8627 558.0 -1420.5 -1.1508 -1.4237 -0.9899 3214362 Ald1-H_000668 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(s1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D15 mock treatment 1693.0 -57.224 -0.0494 2277.0 298.49 0.2418 0.1361 0.5514 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D16 mock treatment 1189.0 -561.22 -0.484 1615.0 -363.51 -0.2945 -0.5505 -0.9716 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D17 compound treatment 872.0 -878.22 -0.7574 957.0 -1021.5 -0.8275 -1.1207 -0.999 3214364 Ald1-H_000669 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2c(F)c(F)c(F)c(F)c2F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D18 compound treatment 2.0 -1748.2 -1.5078 1.0 -1977.5 -1.602 -2.1989 -0.9995 3214366 Ald1-H_000670 ONC(=O)CCCCCC(=O)N/N=C/c1c(F)c(F)c(F)c(F)c1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D19 compound treatment 1247.0 -503.22 -0.434 1794.0 -184.51 -0.1495 -0.4126 -0.8988 3214368 Ald1-H_000671 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D20 compound treatment 339.0 -1411.2 -1.2171 323.0 -1655.5 -1.3411 -1.809 -0.9988 3214370 Ald1-H_000672 ONC(=O)CCCCCC(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D21 compound treatment 830.0 -920.22 -0.7937 1113.0 -865.51 -0.7012 -1.057 -0.9981 3214372 Ald1-H_000673 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D22 compound treatment 13.0 -1737.2 -1.4983 2.0 -1976.5 -1.6012 -2.1917 -0.9994 3214374 Ald1-H_000674 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D23 compound treatment 126.0 -1624.2 -1.4008 389.0 -1589.5 -1.2877 -1.9011 -0.9991 3214376 Ald1-H_000675 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccc(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 D24 compound treatment 18.0 -1732.2 -1.494 84.0 -1894.5 -1.5348 -2.1416 -0.9999 3214378 Ald1-H_000676 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E01 mock treatment 2337.0 586.78 0.5061 2027.0 48.493 0.0393 0.3856 0.7597 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E02 mock treatment 2032.0 281.78 0.243 2124.0 145.49 0.1179 0.2552 0.9448 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E03 compound treatment 55.0 -1695.2 -1.4621 31.0 -1947.5 -1.5777 -2.1494 -0.9993 3214380 Ald1-H_000677 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(Br)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E04 compound treatment 1438.0 -312.22 -0.2693 1204.0 -774.51 -0.6274 -0.6341 -0.9287 3214382 Ald1-H_000678 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(Br)s2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E05 compound treatment 1779.0 28.776 0.0248 124.0 -1854.5 -1.5024 -1.0448 -0.6953 3214384 Ald1-H_000679 COc1cc(/C=N/NC(=O)CCCCCC(=O)NO)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E06 compound treatment 404.0 -1346.2 -1.1611 258.0 -1720.5 -1.3938 -1.8066 -0.9959 3214386 Ald1-H_000680 COc1cc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E07 compound treatment 1310.0 -440.22 -0.3797 1756.0 -222.51 -0.1803 -0.3959 -0.942 3214388 Ald1-H_000681 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E08 compound treatment 291.0 -1459.2 -1.2585 288.0 -1690.5 -1.3695 -1.8583 -0.9991 3214390 Ald1-H_000682 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(OCc3ccccc3)cc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E09 mock treatment 1991.0 240.78 0.2077 2859.0 880.49 0.7133 0.6512 0.8766 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E10 mock treatment 2238.0 487.78 0.4207 2622.0 643.49 0.5213 0.6661 0.9943 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E11 compound treatment 289.0 -1461.2 -1.2602 194.0 -1784.5 -1.4457 -1.9134 -0.9977 3214392 Ald1-H_000683 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E12 compound treatment 958.0 -792.22 -0.6833 882.0 -1096.5 -0.8883 -1.1113 -0.9916 3214394 Ald1-H_000684 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E13 compound treatment 879.0 -871.22 -0.7514 348.0 -1630.5 -1.3209 -1.4653 -0.9643 3214396 Ald1-H_000685 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E14 compound treatment 1199.0 -551.22 -0.4754 1536.0 -442.51 -0.3585 -0.5896 -0.9903 3214398 Ald1-H_000686 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E15 compound treatment 163.0 -1587.2 -1.3689 347.0 -1631.5 -1.3217 -1.9026 -0.9998 3214400 Ald1-H_000687 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)CCCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E16 compound treatment 946.0 -804.22 -0.6936 819.0 -1159.5 -0.9393 -1.1547 -0.9889 3214402 Ald1-H_000688 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E17 mock treatment 1989.0 238.78 0.2059 2287.0 308.49 0.2499 0.3223 0.9954 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E18 mock treatment 1248.0 -502.22 -0.4331 455.0 -1523.5 -1.2342 -1.179 -0.9014 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E19 compound treatment 1701.0 -49.224 -0.0425 1597.0 -381.51 -0.3091 -0.2486 -0.7968 3214404 Ald1-H_000689 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E20 compound treatment 1184.0 -566.22 -0.4883 1297.0 -681.51 -0.5521 -0.7357 -0.9981 3214406 Ald1-H_000690 OC(=O)c1cccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E21 compound treatment 1361.0 -389.22 -0.3357 1390.0 -588.51 -0.4768 -0.5745 -0.9853 3214408 Ald1-H_000691 ONC(=O)CCCCCC(=O)N/N=C/c1ccccc1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E22 compound treatment 800.0 -950.22 -0.8195 1053.0 -925.51 -0.7498 -1.1097 -0.999 3214410 Ald1-H_000692 OC(=O)c1ccccc1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E23 compound treatment 1261.0 -489.22 -0.4219 1306.0 -672.51 -0.5448 -0.6836 -0.992 3214412 Ald1-H_000693 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 E24 compound treatment 568.0 -1182.2 -1.0196 563.0 -1415.5 -1.1467 -1.5318 -0.9983 3214414 Ald1-H_000694 OC(=O)c1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F01 mock treatment 2221.0 470.78 0.406 2477.0 498.49 0.4038 0.5727 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F02 mock treatment 1942.0 191.78 0.1654 1723.0 -255.51 -0.207 -0.0294 -0.111 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F03 compound treatment 1080.0 -670.22 -0.578 371.0 -1607.5 -1.3023 -1.3296 -0.9332 3214416 Ald1-H_000695 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cn(c3ccccc23)S(=O)(=O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F04 compound treatment 1258.0 -492.22 -0.4245 873.0 -1105.5 -0.8956 -0.9335 -0.9418 3214418 Ald1-H_000696 ONC(=O)CCCCCC(=O)N/N=C/c1cn(c2ccccc12)S(=O)(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F05 compound treatment 2451.0 700.78 0.6044 1550.0 -428.51 -0.3471 0.1819 0.261 3214420 Ald1-H_000697 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F06 compound treatment 354.0 -1396.2 -1.2042 367.0 -1611.5 -1.3055 -1.7746 -0.9992 3214422 Ald1-H_000698 ONC(=O)CCCCCC(=O)N/N=C/c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F07 compound treatment 2278.0 527.78 0.4552 1763.0 -215.51 -0.1746 0.1984 0.407 3214424 Ald1-H_000699 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F08 compound treatment 493.0 -1257.2 -1.0843 445.0 -1533.5 -1.2423 -1.6452 -0.9977 3214426 Ald1-H_000700 ONC(=O)CCCCCC(=O)N/N=C/c1cccnc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F09 mock treatment 2419.0 668.78 0.5768 3053.0 1074.5 0.8705 1.0234 0.98 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F10 mock treatment 2641.0 890.78 0.7683 1930.0 -48.507 -0.0393 0.5155 0.6701 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F11 compound treatment 2668.0 917.78 0.7915 2138.0 159.49 0.1292 0.6511 0.8118 3214428 Ald1-H_000701 Cc1ncc(CO)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F12 compound treatment 2323.0 572.78 0.494 2455.0 476.49 0.386 0.6223 0.9926 3214430 Ald1-H_000702 Cc1ncc(CO)c(/C=N/NC(=O)CCCCCC(=O)NO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F13 compound treatment 54.0 -1696.2 -1.4629 25.0 -1953.5 -1.5826 -2.1535 -0.9992 3214432 Ald1-H_000703 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc[nH]2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F14 compound treatment 1098.0 -652.22 -0.5625 1531.0 -447.51 -0.3625 -0.6541 -0.9774 3214434 Ald1-H_000704 ONC(=O)CCCCCC(=O)N/N=C/c1ccc[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F15 compound treatment 1503.0 -247.22 -0.2132 1010.0 -968.51 -0.7846 -0.7056 -0.8678 3214436 Ald1-H_000705 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(cc2)N3CCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F16 compound treatment 22.0 -1728.2 -1.4905 247.0 -1731.5 -1.4027 -2.0458 -0.9995 3214438 Ald1-H_000706 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)N2CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F17 mock treatment 2585.0 834.78 0.72 1852.0 -126.51 -0.1025 0.4366 0.6004 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F18 mock treatment 1549.0 -201.22 -0.1735 1574.0 -404.51 -0.3277 -0.3544 -0.9558 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F19 compound treatment 1125.0 -625.22 -0.5392 947.0 -1031.5 -0.8356 -0.9722 -0.9775 3214440 Ald1-H_000707 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F20 compound treatment 74.0 -1676.2 -1.4457 197.0 -1781.5 -1.4432 -2.0428 -1.0 3214442 Ald1-H_000708 ONC(=O)CCCCCC(=O)N/N=C/c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F21 compound treatment 1580.0 -170.22 -0.1468 965.0 -1013.5 -0.8211 -0.6844 -0.8205 3214444 Ald1-H_000709 CCCCCCC/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F22 compound treatment 516.0 -1234.2 -1.0645 314.0 -1664.5 -1.3484 -1.7062 -0.9931 3214446 Ald1-H_000710 CCCCCCC/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F23 compound treatment 1099.0 -651.22 -0.5617 222.0 -1756.5 -1.423 -1.4033 -0.9173 3214448 Ald1-H_000711 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2nccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 F24 compound treatment 34.0 -1716.2 -1.4802 41.0 -1937.5 -1.5696 -2.1565 -0.9996 3214450 Ald1-H_000712 ONC(=O)CCCCCC(=O)N/N=C/c1nccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G01 compound treatment 2.0 -1748.2 -1.5078 115.0 -1863.5 -1.5097 -2.1336 -1.0 3214452 Ald1-H_000713 ONC(=O)CCCCCC(=O)N/N=C/c1ccccc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G02 compound treatment 476.0 -1274.2 -1.099 298.0 -1680.5 -1.3614 -1.7397 -0.9944 3214454 Ald1-H_000714 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccccc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G03 mock treatment 1985.0 234.78 0.2025 1464.0 -514.51 -0.4168 -0.1516 -0.327 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G04 mock treatment 897.0 -853.22 -0.7359 1314.0 -664.51 -0.5383 -0.901 -0.9882 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G05 compound treatment 83.0 -1667.2 -1.4379 123.0 -1855.5 -1.5032 -2.0797 -0.9998 3214456 Ald1-H_000715 ONC(=O)CCCCCC(=O)N/N=C/c1cccnc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G06 compound treatment 16.0 -1734.2 -1.4957 73.0 -1905.5 -1.5437 -2.1492 -0.9999 3214458 Ald1-H_000716 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccnc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G07 compound treatment 1.0 -1749.2 -1.5086 4.0 -1974.5 -1.5996 -2.1978 -0.9996 3214460 Ald1-H_000717 ONC(=O)CCCCCC(=O)N/N=C/C=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G08 compound treatment 83.0 -1667.2 -1.4379 213.0 -1765.5 -1.4303 -2.0281 -1.0 3214462 Ald1-H_000718 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/C=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G09 compound treatment 18.0 -1732.2 -1.494 57.0 -1921.5 -1.5566 -2.1571 -0.9998 3214464 Ald1-H_000719 C[C@H](CCC=C(C)C)C/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G10 compound treatment 72.0 -1678.2 -1.4474 581.0 -1397.5 -1.1321 -1.824 -0.9926 3214466 Ald1-H_000720 C[C@H](CCC=C(C)C)C/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G11 compound treatment 33.0 -1717.2 -1.481 60.0 -1918.5 -1.5542 -2.1462 -0.9997 3214468 Ald1-H_000721 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G12 compound treatment 224.0 -1526.2 -1.3163 443.0 -1535.5 -1.2439 -1.8104 -0.9996 3214469 Ald1-H_000722 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G13 compound treatment 13.0 -1737.2 -1.4983 24.0 -1954.5 -1.5834 -2.1791 -0.9996 3214470 Ald1-H_000723 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(C#N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G14 compound treatment 51.0 -1699.2 -1.4655 311.0 -1667.5 -1.3509 -1.9915 -0.9992 3214472 Ald1-H_000724 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(C#N)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G15 compound treatment 104.0 -1646.2 -1.4198 209.0 -1769.5 -1.4335 -2.0176 -1.0 3214474 Ald1-H_000725 ONC(=O)CCCCCC(=O)N/N=C/C1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G16 compound treatment 598.0 -1152.2 -0.9937 855.0 -1123.5 -0.9102 -1.3463 -0.999 3214476 Ald1-H_000726 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/C2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G17 compound treatment 2.0 -1748.2 -1.5078 11.0 -1967.5 -1.5939 -2.1932 -0.9996 3214478 Ald1-H_000727 COc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G18 compound treatment 89.0 -1661.2 -1.4327 95.0 -1883.5 -1.5259 -2.092 -0.9995 3214480 Ald1-H_000728 COc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G19 mock treatment 981.0 -769.22 -0.6634 1041.0 -937.51 -0.7595 -1.0062 -0.9977 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G20 mock treatment 651.0 -1099.2 -0.948 889.0 -1089.5 -0.8826 -1.2945 -0.9994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G21 compound treatment 239.0 -1511.2 -1.3034 440.0 -1538.5 -1.2464 -1.8029 -0.9998 3214482 Ald1-H_000729 ONC(=O)CCCCCC(=O)N/N=C/c1cc(Br)cc(Br)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G22 compound treatment 9.0 -1741.2 -1.5017 14.0 -1964.5 -1.5915 -2.1872 -0.9996 3214484 Ald1-H_000730 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc(Br)cc(Br)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G23 compound treatment 4.0 -1746.2 -1.506 10.0 -1968.5 -1.5947 -2.1926 -0.9996 3214486 Ald1-H_000731 CCCCN(CCCC)c1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 G24 compound treatment 0.0 -1750.2 -1.5095 3.0 -1975.5 -1.6004 -2.199 -0.9996 3214488 Ald1-H_000732 CCCCN(CCCC)c1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H01 compound treatment 1389.0 -361.22 -0.3115 1163.0 -815.51 -0.6607 -0.6874 -0.9412 3214490 Ald1-H_000733 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H02 compound treatment 32.0 -1718.2 -1.4819 19.0 -1959.5 -1.5874 -2.1703 -0.9994 3214492 Ald1-H_000734 ONC(=O)CCCCCC(=O)N/N=C/c1cccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H03 mock treatment 2887.0 1136.8 0.9804 2569.0 590.49 0.4784 1.0315 0.9456 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H04 mock treatment 1648.0 -102.22 -0.0882 2301.0 322.49 0.2613 0.1224 0.4439 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H05 compound treatment 1458.0 -292.22 -0.252 2093.0 114.49 0.0928 -0.1126 -0.4194 3214494 Ald1-H_000735 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(cc2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H06 compound treatment 26.0 -1724.2 -1.4871 35.0 -1943.5 -1.5745 -2.1648 -0.9996 3214496 Ald1-H_000736 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H07 compound treatment 1779.0 28.776 0.0248 2049.0 70.493 0.0571 0.0579 0.9303 3214498 Ald1-H_000737 Oc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H08 compound treatment 1048.0 -702.22 -0.6056 673.0 -1305.5 -1.0576 -1.1761 -0.965 3214500 Ald1-H_000738 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H09 compound treatment 2369.0 618.78 0.5337 2612.0 633.49 0.5132 0.7402 0.9998 3214502 Ald1-H_000739 Oc1cc(O)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H10 compound treatment 1807.0 56.776 0.049 1816.0 -162.51 -0.1316 -0.0585 -0.4162 3214504 Ald1-H_000740 ONC(=O)CCCCCC(=O)N/N=C/c1c(O)cc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H11 compound treatment 1127.0 -623.22 -0.5375 2870.0 891.49 0.7222 0.1306 0.1451 3214506 Ald1-H_000741 COc1cc(OC)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H12 compound treatment 2029.0 278.78 0.2404 1994.0 15.493 0.0126 0.1789 0.743 3214508 Ald1-H_000742 COc1cc(OC)c(/C=N/NC(=O)CCCCCC(=O)NO)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H13 compound treatment 1542.0 -208.22 -0.1796 2436.0 457.49 0.3706 0.1351 0.328 3214510 Ald1-H_000743 COc1cc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H14 compound treatment 1460.0 -290.22 -0.2503 1741.0 -237.51 -0.1924 -0.313 -0.9916 3214512 Ald1-H_000744 COc1cc(/C=N/NC(=O)CCCCCC(=O)NO)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H15 compound treatment 1954.0 203.78 0.1757 2529.0 550.49 0.446 0.4396 0.9171 3214514 Ald1-H_000745 CC(C)(C)/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H16 compound treatment 1068.0 -682.22 -0.5884 1399.0 -579.51 -0.4695 -0.748 -0.9937 3214516 Ald1-H_000746 CC(C)(C)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H17 compound treatment 408.0 -1342.2 -1.1576 541.0 -1437.5 -1.1645 -1.642 -1.0 3214518 Ald1-H_000747 CC1=C(C/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H18 compound treatment 755.0 -995.22 -0.8583 1212.0 -766.51 -0.621 -1.046 -0.9874 3214520 Ald1-H_000748 CC1=C(C/C=N/NC(=O)CCCCCC(=O)NO)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H19 mock treatment 1520.0 -230.22 -0.1986 1921.0 -57.507 -0.0466 -0.1733 -0.8499 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H20 mock treatment 1050.0 -700.22 -0.6039 1363.0 -615.51 -0.4986 -0.7796 -0.9955 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H21 compound treatment 831.0 -919.22 -0.7928 1017.0 -961.51 -0.7789 -1.1114 -1.0 3214522 Ald1-H_000749 NC(=O)COc1ccccc1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H22 compound treatment 566.0 -1184.2 -1.0213 577.0 -1401.5 -1.1354 -1.525 -0.9986 3214524 Ald1-H_000750 NC(=O)COc1ccccc1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H23 compound treatment 963.0 -787.22 -0.6789 1258.0 -720.51 -0.5837 -0.8928 -0.9972 3214526 Ald1-H_000751 NC(=O)COc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 H24 compound treatment 349.0 -1401.2 -1.2085 431.0 -1547.5 -1.2537 -1.741 -0.9998 3214528 Ald1-H_000752 NC(=O)COc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I01 compound treatment 68.0 -1682.2 -1.4508 94.0 -1884.5 -1.5267 -2.1054 -0.9997 3214530 Ald1-H_000753 COc1cc(Cl)c(/C=N/NC(=O)CCCCCC(=O)NO)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I02 compound treatment 1755.0 4.7761 0.0041 1716.0 -262.51 -0.2127 -0.1475 -0.6933 3214532 Ald1-H_000754 COc1cc(Cl)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I03 compound treatment 2190.0 439.78 0.3793 2543.0 564.49 0.4573 0.5916 0.9957 3214534 Ald1-H_000755 ONC(=O)CCCCCC(=O)N/N=C/c1cc(Cl)cc(Cl)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I04 compound treatment 1284.0 -466.22 -0.4021 1382.0 -596.51 -0.4832 -0.626 -0.9958 3214536 Ald1-H_000756 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc(Cl)cc(Cl)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I05 mock treatment 2622.0 871.78 0.7519 2795.0 816.49 0.6615 0.9994 0.998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I06 mock treatment 2039.0 288.78 0.2491 2395.0 416.49 0.3374 0.4147 0.9888 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I07 compound treatment 2268.0 517.78 0.4466 2926.0 947.49 0.7676 0.8585 0.9668 3214538 Ald1-H_000757 ONC(=O)CCCCCC(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I08 compound treatment 1881.0 130.78 0.1128 2168.0 189.49 0.1535 0.1883 0.9885 3214540 Ald1-H_000758 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I09 compound treatment 184.0 -1566.2 -1.3508 477.0 -1501.5 -1.2164 -1.8153 -0.9986 3214542 Ald1-H_000759 CCN(CC)c1ccc(/C=N/NC(=O)CCCCCC(=O)NO)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I10 compound treatment 23.0 -1727.2 -1.4897 25.0 -1953.5 -1.5826 -2.1724 -0.9995 3214544 Ald1-H_000760 CCN(CC)c1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I11 compound treatment 124.0 -1626.2 -1.4026 90.0 -1888.5 -1.5299 -2.0736 -0.9991 3214546 Ald1-H_000761 ONC(=O)CCCCCC(=O)N/N=C/c1ccc2OCCc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I12 compound treatment 715.0 -1035.2 -0.8928 1104.0 -874.51 -0.7085 -1.1323 -0.9934 3214548 Ald1-H_000762 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc3OCCc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I13 compound treatment 768.0 -982.22 -0.8471 1201.0 -777.51 -0.6299 -1.0444 -0.9894 3214550 Ald1-H_000763 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I14 compound treatment 189.0 -1561.2 -1.3465 499.0 -1479.5 -1.1986 -1.7996 -0.9983 3214552 Ald1-H_000764 Oc1cccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I15 compound treatment 1177.0 -573.22 -0.4944 1832.0 -146.51 -0.1187 -0.4335 -0.8526 3214554 Ald1-H_000765 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I16 compound treatment 705.0 -1045.2 -0.9015 911.0 -1067.5 -0.8648 -1.2489 -0.9998 3214556 Ald1-H_000766 Oc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I17 compound treatment 596.0 -1154.2 -0.9955 1025.0 -953.51 -0.7724 -1.2501 -0.9921 3214558 Ald1-H_000767 ONC(=O)CCCCCC(=O)N/N=C/c1cc(O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I18 compound treatment 161.0 -1589.2 -1.3706 153.0 -1825.5 -1.4789 -2.0149 -0.9993 3214560 Ald1-H_000768 Oc1ccc(O)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I19 compound treatment 626.0 -1124.2 -0.9696 1187.0 -791.51 -0.6412 -1.139 -0.9798 3214562 Ald1-H_000769 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I20 compound treatment 384.0 -1366.2 -1.1783 495.0 -1483.5 -1.2018 -1.683 -1.0 3214564 Ald1-H_000770 Oc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I21 mock treatment 1449.0 -301.22 -0.2598 1908.0 -70.507 -0.0571 -0.2241 -0.8425 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I22 mock treatment 1114.0 -636.22 -0.5487 1145.0 -833.51 -0.6752 -0.8655 -0.9947 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I23 compound treatment 283.0 -1467.2 -1.2654 534.0 -1444.5 -1.1702 -1.7223 -0.9992 3214566 Ald1-H_000771 COc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 I24 compound treatment 157.0 -1593.2 -1.3741 467.0 -1511.5 -1.2245 -1.8375 -0.9983 3214568 Ald1-H_000772 COc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J01 compound treatment 1946.0 195.78 0.1688 2102.0 123.49 0.1 0.1901 0.9688 3214570 Ald1-H_000773 Oc1ccccc1NC(=O)CCCCCC(=O)NN=C2CCCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J02 compound treatment 983.0 -767.22 -0.6617 932.0 -1046.5 -0.8478 -1.0674 -0.9925 3214571 Ald1-H_000774 ONC(=O)CCCCCC(=O)NN=C1CCCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J03 compound treatment 843.0 -907.22 -0.7824 1938.0 -40.507 -0.0328 -0.5765 -0.7361 3214572 Ald1-H_000775 Oc1ccccc1NC(=O)CCCCCC(=O)NN=C2CCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J04 compound treatment 1222.0 -528.22 -0.4556 813.0 -1165.5 -0.9442 -0.9898 -0.9441 3214573 Ald1-H_000776 ONC(=O)CCCCCC(=O)NN=C1CCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J05 mock treatment 2237.0 486.78 0.4198 2414.0 435.49 0.3528 0.5463 0.9963 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J06 mock treatment 1796.0 45.776 0.0395 1489.0 -489.51 -0.3966 -0.2525 -0.6336 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J07 compound treatment 1850.0 99.776 0.0861 2421.0 442.49 0.3585 0.3143 0.8526 3214574 Ald1-H_000777 Oc1ccccc1NC(=O)CCCCCC(=O)NN=C2CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J08 compound treatment 1579.0 -171.22 -0.1477 1246.0 -732.51 -0.5934 -0.524 -0.8569 3214575 Ald1-H_000778 ONC(=O)CCCCCC(=O)NN=C1CCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J09 compound treatment 1668.0 -82.224 -0.0709 2034.0 55.493 0.045 -0.0184 -0.2186 3214215 Ald1-H_000779 NNC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J10 mock treatment 1898.0 147.78 0.1275 2005.0 26.493 0.0215 0.1053 0.8147 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J11 compound treatment 488.0 -1262.2 -1.0886 169.0 -1809.5 -1.4659 -1.8063 -0.9893 3214576 Ald1-H_000780 COc1cc(Br)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J12 compound treatment 1278.0 -472.22 -0.4073 705.0 -1273.5 -1.0317 -1.0175 -0.9174 3214578 Ald1-H_000781 COc1cc(Br)c(/C=N/NC(=O)CCCCCC(=O)NO)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J13 compound treatment 1317.0 -433.22 -0.3736 1300.0 -678.51 -0.5497 -0.6529 -0.9823 3214580 Ald1-H_000782 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/CCC2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J14 compound treatment 429.0 -1321.2 -1.1395 430.0 -1548.5 -1.2545 -1.6928 -0.9988 3214582 Ald1-H_000783 ONC(=O)CCCCCC(=O)N/N=C/CCC1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J15 compound treatment 1604.0 -146.22 -0.1261 1714.0 -264.51 -0.2143 -0.2407 -0.9681 3214584 Ald1-H_000784 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J16 compound treatment 259.0 -1491.2 -1.2861 931.0 -1047.5 -0.8486 -1.5095 -0.9796 3214586 Ald1-H_000785 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J17 compound treatment 1129.0 -621.22 -0.5358 1138.0 -840.51 -0.6809 -0.8603 -0.993 3214588 Ald1-H_000786 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J18 compound treatment 1470.0 -280.22 -0.2417 1159.0 -819.51 -0.6639 -0.6403 -0.9063 3214590 Ald1-H_000787 ONC(=O)CCCCCC(=O)N/N=C/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J19 compound treatment 1673.0 -77.224 -0.0666 1793.0 -185.51 -0.1503 -0.1534 -0.933 3214215 Ald1-H_000788 NNC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J20 mock treatment 496.0 -1254.2 -1.0817 1351.0 -627.51 -0.5084 -1.1243 -0.9407 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J21 mock treatment 1656.0 -94.224 -0.0813 1674.0 -304.51 -0.2467 -0.2319 -0.8928 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J22 mock treatment 1150.0 -600.22 -0.5177 1589.0 -389.51 -0.3155 -0.5892 -0.9718 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J23 compound treatment 1406.0 -344.22 -0.2969 1518.0 -460.51 -0.3731 -0.4737 -0.9936 3214215 Ald1-H_000789 NNC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 J24 mock treatment 1391.0 -359.22 -0.3098 1175.0 -803.51 -0.6509 -0.6794 -0.9424 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K01 compound treatment 1920.0 169.78 0.1464 2358.0 379.49 0.3074 0.3209 0.9425 3214592 Ald1-H_000790 COc1cccc(OC)c1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K02 compound treatment 1680.0 -70.224 -0.0606 1617.0 -361.51 -0.2929 -0.2499 -0.8357 3214594 Ald1-H_000791 COc1cccc(OC)c1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K03 compound treatment 1361.0 -389.22 -0.3357 878.0 -1100.5 -0.8915 -0.8678 -0.9109 3214596 Ald1-H_000792 COc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K04 compound treatment 870.0 -880.22 -0.7592 826.0 -1152.5 -0.9337 -1.197 -0.9947 3214598 Ald1-H_000793 COc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K05 compound treatment 2207.0 456.78 0.394 2437.0 458.49 0.3714 0.5412 0.9996 3214600 Ald1-H_000794 COc1cc(O)cc(OC)c1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K06 compound treatment 1705.0 -45.224 -0.039 1925.0 -53.507 -0.0433 -0.0582 -0.9986 3214602 Ald1-H_000795 COc1cc(O)cc(OC)c1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K07 mock treatment 1904.0 153.78 0.1326 2041.0 62.493 0.0506 0.1296 0.9128 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K08 mock treatment 1693.0 -57.224 -0.0494 1964.0 -14.507 -0.0118 -0.0432 -0.8517 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K09 compound treatment 959.0 -791.22 -0.6824 1610.0 -368.51 -0.2985 -0.6936 -0.9312 3214604 Ald1-H_000796 CC1(C)COC(CCC/C=N/NC(=O)CCCCCC(=O)NO)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K10 compound treatment 1163.0 -587.22 -0.5065 1234.0 -744.51 -0.6031 -0.7846 -0.9962 3214606 Ald1-H_000797 CC1(C)COC(CCC/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K11 compound treatment 2311.0 560.78 0.4836 3262.0 1283.5 1.0398 1.0772 0.9394 3214608 Ald1-H_000798 Cc1nnc(Sc2ccc(/C=N/NC(=O)CCCCCC(=O)NO)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K12 compound treatment 1819.0 68.776 0.0593 1801.0 -177.51 -0.1438 -0.0597 -0.384 3214610 Ald1-H_000799 Cc1nnc(Sc2ccc(/C=N/NC(=O)CCCCCC(=O)Nc3ccccc3O)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K13 compound treatment 33.0 -1717.2 -1.481 23.0 -1955.5 -1.5842 -2.1674 -0.9994 3214612 Ald1-H_000800 ONC(=O)CCCCCC(=O)N/N=C/c1cc(Br)cs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K14 compound treatment 1010.0 -740.22 -0.6384 1071.0 -907.51 -0.7352 -0.9713 -0.9975 3214614 Ald1-H_000801 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc(Br)cs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K15 mock treatment 1927.0 176.78 0.1525 2305.0 326.49 0.2645 0.2948 0.9657 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K16 mock treatment 1887.0 136.78 0.118 2130.0 151.49 0.1227 0.1702 0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K17 compound treatment 2001.0 250.78 0.2163 3013.0 1034.5 0.8381 0.7455 0.8614 3214616 Ald1-H_000802 CC(C)(C)OC(=O)NC/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K18 compound treatment 1299.0 -451.22 -0.3892 878.0 -1100.5 -0.8915 -0.9056 -0.9309 3214618 Ald1-H_000803 CC(C)(C)OC(=O)NC/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K19 compound treatment 0.0 -1750.2 -1.5095 16.0 -1962.5 -1.5899 -2.1916 -0.9997 3214620 Ald1-H_000804 ONC(=O)CCCCCC(=O)N/N=C/c1ccc-2c(Cc3ccccc32)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K20 compound treatment 1012.0 -738.22 -0.6367 715.0 -1263.5 -1.0236 -1.174 -0.9739 3214622 Ald1-H_000805 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc-3c(Cc4ccccc43)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K21 compound treatment 11.0 -1739.2 -1.5 15.0 -1963.5 -1.5907 -2.1854 -0.9996 3214624 Ald1-H_000806 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K22 compound treatment 415.0 -1335.2 -1.1516 547.0 -1431.5 -1.1597 -1.6343 -1.0 3214626 Ald1-H_000807 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(F)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K23 mock treatment 1614.0 -136.22 -0.1175 1830.0 -148.51 -0.1203 -0.1681 -0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 K24 mock treatment 1299.0 -451.22 -0.3892 789.0 -1189.5 -0.9636 -0.9566 -0.9204 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L01 compound treatment 2600.0 849.78 0.7329 2383.0 404.49 0.3277 0.7499 0.9341 3214628 Ald1-H_000808 OC[C@@H](O)[C@@H](O)[C@H](O)/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L02 compound treatment 1273.0 -477.22 -0.4116 1415.0 -563.51 -0.4565 -0.6138 -0.9987 3214630 Ald1-H_000809 OC[C@@H](O)[C@@H](O)[C@H](O)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L03 compound treatment 3000.0 1249.8 1.0779 2320.0 341.49 0.2766 0.9578 0.8607 3214632 Ald1-H_000810 C[C@@H](O)[C@@H](O)[C@@H](O)C/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L04 compound treatment 1427.0 -323.22 -0.2788 1819.0 -159.51 -0.1292 -0.2885 -0.9389 3214634 Ald1-H_000811 C[C@@H](O)[C@@H](O)[C@@H](O)C/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L05 compound treatment 2579.0 828.78 0.7148 2974.0 995.49 0.8065 1.0757 0.9982 3214636 Ald1-H_000812 OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L06 compound treatment 1951.0 200.78 0.1732 2246.0 267.49 0.2167 0.2757 0.9938 3214638 Ald1-H_000813 OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L07 mock treatment 2433.0 682.78 0.5889 2525.0 546.49 0.4427 0.7294 0.9901 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L08 mock treatment 2008.0 257.78 0.2223 2488.0 509.49 0.4127 0.4491 0.9579 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L09 compound treatment 2375.0 624.78 0.5388 1972.0 -6.5075 -0.0053 0.3773 0.7002 3214640 Ald1-H_000814 OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L10 compound treatment 1484.0 -266.22 -0.2296 1925.0 -53.507 -0.0433 -0.193 -0.826 3214641 Ald1-H_000815 OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L11 compound treatment 2178.0 427.78 0.3689 2825.0 846.49 0.6858 0.7458 0.9577 3214642 Ald1-H_000816 OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L12 compound treatment 2357.0 606.78 0.5233 2396.0 417.49 0.3382 0.6092 0.9777 3214643 Ald1-H_000817 OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L13 compound treatment 2681.0 930.78 0.8028 2977.0 998.49 0.8089 1.1396 1.0 3214644 Ald1-H_000818 C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L14 compound treatment 1304.0 -446.22 -0.3848 1423.0 -555.51 -0.45 -0.5903 -0.997 3214646 Ald1-H_000819 C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L15 mock treatment 2132.0 381.78 0.3293 2793.0 814.49 0.6598 0.6994 0.9484 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L16 mock treatment 1682.0 -68.224 -0.0588 2444.0 465.49 0.3771 0.225 0.5896 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L17 compound treatment 1229.0 -521.22 -0.4495 1429.0 -549.51 -0.4452 -0.6326 -1.0 3214648 Ald1-H_000820 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(Oc3ccccc3)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L18 compound treatment 41.0 -1709.2 -1.4741 128.0 -1850.5 -1.4991 -2.1024 -1.0 3214650 Ald1-H_000821 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(Oc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L19 compound treatment 1516.0 -234.22 -0.202 2002.0 23.493 0.019 -0.1294 -0.6377 3214652 Ald1-H_000822 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc[n+]([O-])cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L20 compound treatment 1760.0 9.7761 0.0084 2039.0 60.493 0.049 0.0406 0.8168 3214654 Ald1-H_000823 ONC(=O)CCCCCC(=O)N/N=C/c1cc[n+]([O-])cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L21 compound treatment 789.0 -961.22 -0.829 832.0 -1146.5 -0.9288 -1.243 -0.9984 3214656 Ald1-H_000824 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc3ccccc3n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L22 compound treatment 6.0 -1744.2 -1.5043 24.0 -1954.5 -1.5834 -2.1833 -0.9997 3214658 Ald1-H_000825 ONC(=O)CCCCCC(=O)N/N=C/c1ccc2ccccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L23 mock treatment 1327.0 -423.22 -0.365 1434.0 -544.51 -0.4411 -0.57 -0.9956 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 L24 mock treatment 1125.0 -625.22 -0.5392 1899.0 -79.507 -0.0644 -0.4268 -0.786 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M01 compound treatment 1328.0 -422.22 -0.3642 1187.0 -791.51 -0.6412 -0.7109 -0.9641 3214660 Ald1-H_000826 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(O)c(F)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M02 compound treatment 1821.0 70.776 0.061 1850.0 -128.51 -0.1041 -0.0305 -0.2523 3214662 Ald1-H_000827 Oc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M03 compound treatment 416.0 -1334.2 -1.1507 142.0 -1836.5 -1.4878 -1.8657 -0.9919 3214664 Ald1-H_000828 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(F)c(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M04 compound treatment 693.0 -1057.2 -0.9118 391.0 -1587.5 -1.2861 -1.5541 -0.9858 3214666 Ald1-H_000829 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(F)c(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M05 compound treatment 393.0 -1357.2 -1.1705 513.0 -1465.5 -1.1872 -1.6672 -1.0 3214668 Ald1-H_000830 ONC(=O)CCCCCC(=O)N/N=C/c1cc(F)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M06 compound treatment 1277.0 -473.22 -0.4081 598.0 -1380.5 -1.1184 -1.0794 -0.9067 3214670 Ald1-H_000831 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc(F)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M07 compound treatment 2020.0 269.78 0.2327 2292.0 313.49 0.254 0.3441 0.999 3214672 Ald1-H_000832 ONC(=O)CCCCCC(=O)N/N=C/c1coc2ccccc2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M08 compound treatment 1754.0 3.7761 0.0033 1489.0 -489.51 -0.3966 -0.2781 -0.7013 3214674 Ald1-H_000833 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2coc3ccccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M09 mock treatment 2065.0 314.78 0.2715 2905.0 926.49 0.7506 0.7227 0.9055 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M10 mock treatment 1868.0 117.78 0.1016 2025.0 46.493 0.0377 0.0985 0.9088 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M11 compound treatment 130.0 -1620.2 -1.3974 161.0 -1817.5 -1.4724 -2.0292 -0.9997 3214676 Ald1-H_000834 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M12 compound treatment 237.0 -1513.2 -1.3051 232.0 -1746.5 -1.4149 -1.9233 -0.9992 3214678 Ald1-H_000835 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M13 mock treatment 2570.0 819.78 0.707 2862.0 883.49 0.7157 1.006 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M14 mock treatment 1623.0 -127.22 -0.1097 2312.0 333.49 0.2702 0.1134 0.3891 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M15 compound treatment 1759.0 8.7761 0.0076 1957.0 -21.507 -0.0174 -0.007 -0.3668 3214680 Ald1-H_000836 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(c1)B(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M16 compound treatment 1857.0 106.78 0.0921 1632.0 -346.51 -0.2807 -0.1334 -0.4515 3214682 Ald1-H_000837 OB(O)c1cccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M17 compound treatment 183.0 -1567.2 -1.3517 512.0 -1466.5 -1.188 -1.7958 -0.9979 3214684 Ald1-H_000838 ONC(=O)CCCCCC(=O)N/N=C/c1ccco1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M18 compound treatment 1287.0 -463.22 -0.3995 1670.0 -308.51 -0.2499 -0.4592 -0.9745 3214686 Ald1-H_000839 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccco2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M19 compound treatment 177.0 -1573.2 -1.3568 248.0 -1730.5 -1.4019 -1.9507 -0.9999 3214688 Ald1-H_000840 ONC(=O)CCCCCC(=O)N/N=C/c1ccoc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M20 compound treatment 1123.0 -627.22 -0.541 956.0 -1022.5 -0.8283 -0.9682 -0.9787 3214690 Ald1-H_000841 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccoc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M21 compound treatment 368.0 -1382.2 -1.1921 641.0 -1337.5 -1.0835 -1.6091 -0.9989 3214692 Ald1-H_000842 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M22 compound treatment 400.0 -1350.2 -1.1645 431.0 -1547.5 -1.2537 -1.7099 -0.9993 3214694 Ald1-H_000843 Oc1cccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M23 compound treatment 141.0 -1609.2 -1.3879 230.0 -1748.5 -1.4165 -1.983 -0.9999 3214696 Ald1-H_000844 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 M24 compound treatment 719.0 -1031.2 -0.8894 627.0 -1351.5 -1.0949 -1.4031 -0.9947 3214698 Ald1-H_000845 Oc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N01 compound treatment 1553.0 -197.22 -0.1701 1220.0 -758.51 -0.6145 -0.5548 -0.8701 3214700 Ald1-H_000846 Cc1ccccc1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N02 compound treatment 22.0 -1728.2 -1.4905 19.0 -1959.5 -1.5874 -2.1764 -0.9995 3214702 Ald1-H_000847 Cc1ccccc1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N03 compound treatment 2056.0 305.78 0.2637 2208.0 229.49 0.1859 0.3179 0.9854 3214704 Ald1-H_000848 COc1cc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N04 compound treatment 1280.0 -470.22 -0.4055 759.0 -1219.5 -0.9879 -0.9853 -0.9227 3214706 Ald1-H_000849 COc1cc(/C=N/NC(=O)CCCCCC(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N05 compound treatment 2360.0 609.78 0.5259 2797.0 818.49 0.6631 0.8407 0.9934 3214708 Ald1-H_000850 O[C@@H](/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N06 compound treatment 2262.0 511.78 0.4414 1998.0 19.493 0.0158 0.3233 0.7319 3214710 Ald1-H_000851 ONC(=O)CCCCCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N07 compound treatment 2441.0 690.78 0.5958 2389.0 410.49 0.3325 0.6564 0.9621 3214712 Ald1-H_000852 OC[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N08 compound treatment 1173.0 -577.22 -0.4978 1804.0 -174.51 -0.1414 -0.452 -0.8734 3214713 Ald1-H_000853 OC[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N09 mock treatment 1821.0 70.776 0.061 2595.0 616.49 0.4994 0.3963 0.7877 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N10 mock treatment 1991.0 240.78 0.2077 2096.0 117.49 0.0952 0.2141 0.9374 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N11 compound treatment 1514.0 -236.22 -0.2037 1153.0 -825.51 -0.6688 -0.6169 -0.8825 3214714 Ald1-H_000854 COc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N12 compound treatment 1761.0 10.776 0.0093 1022.0 -956.51 -0.7749 -0.5414 -0.6986 3214716 Ald1-H_000855 COc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N13 mock treatment 2671.0 920.78 0.7941 2761.0 782.49 0.6339 1.0098 0.9938 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N14 mock treatment 2453.0 702.78 0.6061 2655.0 676.49 0.548 0.8161 0.9987 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N15 compound treatment 1257.0 -493.22 -0.4254 1587.0 -391.51 -0.3172 -0.5251 -0.9895 3214718 Ald1-H_000856 CCOc1cccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N16 compound treatment 10.0 -1740.2 -1.5009 37.0 -1941.5 -1.5728 -2.1734 -0.9997 3214720 Ald1-H_000857 CCOc1cccc(/C=N/NC(=O)CCCCCC(=O)NO)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N17 compound treatment 1101.0 -649.22 -0.5599 1739.0 -239.51 -0.194 -0.5331 -0.8997 3214722 Ald1-H_000858 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc(I)cc(I)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N18 compound treatment 1600.0 -150.22 -0.1296 1811.0 -167.51 -0.1357 -0.1876 -0.9997 3214724 Ald1-H_000859 ONC(=O)CCCCCC(=O)N/N=C/c1cc(I)cc(I)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N19 compound treatment 1513.0 -237.22 -0.2046 1843.0 -135.51 -0.1098 -0.2223 -0.9574 3214726 Ald1-H_000860 CN(C)c1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N20 compound treatment 179.0 -1571.2 -1.3551 41.0 -1937.5 -1.5696 -2.0681 -0.9973 3214728 Ald1-H_000861 CN(C)c1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N21 compound treatment 1605.0 -145.22 -0.1252 1894.0 -84.507 -0.0685 -0.137 -0.9596 3214730 Ald1-H_000862 CCn1c2ccccc2c3cc(/C=N/NC(=O)CCCCCC(=O)Nc4ccccc4O)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N22 compound treatment 66.0 -1684.2 -1.4526 52.0 -1926.5 -1.5607 -2.1307 -0.9994 3214732 Ald1-H_000863 CCn1c2ccccc2c3cc(/C=N/NC(=O)CCCCCC(=O)NO)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N23 compound treatment 637.0 -1113.2 -0.9601 894.0 -1084.5 -0.8786 -1.3001 -0.999 3214734 Ald1-H_000864 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(c(F)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 N24 compound treatment 4.0 -1746.2 -1.506 2.0 -1976.5 -1.6012 -2.1972 -0.9995 3214736 Ald1-H_000865 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(c(F)c1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O01 compound treatment 1799.0 48.776 0.0421 1424.0 -554.51 -0.4492 -0.2879 -0.6381 3214738 Ald1-H_000866 OCCOc1ccccc1/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O02 compound treatment 1314.0 -436.22 -0.3762 1131.0 -847.51 -0.6866 -0.7515 -0.9599 3214740 Ald1-H_000867 OCCOc1ccccc1/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O03 compound treatment 1907.0 156.78 0.1352 1524.0 -454.51 -0.3682 -0.1647 -0.42 3214742 Ald1-H_000868 OCCOc1cccc(/C=N/NC(=O)CCCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O04 compound treatment 946.0 -804.22 -0.6936 816.0 -1162.5 -0.9418 -1.1564 -0.9887 3214744 Ald1-H_000869 OCCOc1cccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O05 compound treatment 580.0 -1170.2 -1.0093 33.0 -1945.5 -1.5761 -1.8281 -0.9768 3214746 Ald1-H_000870 OCCOc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O06 compound treatment 1584.0 -166.22 -0.1434 1278.0 -700.51 -0.5675 -0.5026 -0.8588 3214748 Ald1-H_000871 OCCOc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O07 compound treatment 789.0 -961.22 -0.829 782.0 -1196.5 -0.9693 -1.2716 -0.997 3214750 Ald1-H_000872 COc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O08 compound treatment 854.0 -896.22 -0.773 701.0 -1277.5 -1.0349 -1.2784 -0.9897 3214752 Ald1-H_000873 COc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O09 compound treatment 534.0 -1216.2 -1.0489 1047.0 -931.51 -0.7546 -1.2753 -0.9869 3214754 Ald1-H_000874 COc1ccc(O)c(/C=N/NC(=O)CCCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O10 compound treatment 1027.0 -723.22 -0.6238 650.0 -1328.5 -1.0762 -1.2021 -0.9664 3214756 Ald1-H_000875 COc1ccc(O)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O11 mock treatment 1813.0 62.776 0.0541 2461.0 482.49 0.3909 0.3147 0.7974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O12 mock treatment 1670.0 -80.224 -0.0692 2139.0 160.49 0.13 0.043 0.292 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O13 compound treatment 1269.0 -481.22 -0.415 1381.0 -597.51 -0.484 -0.6357 -0.9971 3214758 Ald1-H_000876 COc1cc(/C=C/C=N/NC(=O)CCCCCC(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O14 compound treatment 1144.0 -606.22 -0.5228 1085.0 -893.51 -0.7238 -0.8815 -0.9873 3214760 Ald1-H_000877 COc1cc(/C=C/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O15 compound treatment 127.0 -1623.2 -1.4 375.0 -1603.5 -1.299 -1.9085 -0.9993 3214762 Ald1-H_000878 Cc1ccc(O)c(/C=N/NC(=O)CCCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O16 compound treatment 743.0 -1007.2 -0.8687 1196.0 -782.51 -0.6339 -1.0625 -0.988 3214764 Ald1-H_000879 Cc1ccc(O)c(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O17 compound treatment 759.0 -991.22 -0.8549 1432.0 -546.51 -0.4427 -0.9176 -0.9531 3214766 Ald1-H_000880 OCc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O18 compound treatment 1905.0 154.78 0.1335 1761.0 -217.51 -0.1762 -0.0302 -0.1366 3214768 Ald1-H_000881 OCc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O19 compound treatment 886.0 -864.22 -0.7454 1154.0 -824.51 -0.6679 -0.9994 -0.9985 3214770 Ald1-H_000882 ONC(=O)CCCCCC(=O)N/N=C/c1ccc2ccccc2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O20 compound treatment 882.0 -868.22 -0.7488 339.0 -1639.5 -1.3282 -1.4687 -0.9632 3214772 Ald1-H_000883 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc3ccccc3c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O21 compound treatment 64.0 -1686.2 -1.4543 94.0 -1884.5 -1.5267 -2.1079 -0.9997 3214774 Ald1-H_000884 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(o1)c2cccc(Cl)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O22 compound treatment 575.0 -1175.2 -1.0136 182.0 -1796.5 -1.4554 -1.7458 -0.9844 3214776 Ald1-H_000885 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(o2)c3cccc(Cl)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O23 compound treatment 255.0 -1495.2 -1.2896 1408.0 -570.51 -0.4622 -1.2387 -0.9042 3214778 Ald1-H_000886 ONC(=O)CCCCCC(=O)N/N=C/c1cc(Br)c(O)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 O24 compound treatment 298.0 -1452.2 -1.2525 273.0 -1705.5 -1.3817 -1.8626 -0.9988 3214780 Ald1-H_000887 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cc(Br)c(O)c(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P01 compound treatment 2204.0 453.78 0.3914 1741.0 -237.51 -0.1924 0.1407 0.3226 3214782 Ald1-H_000888 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(o2)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P02 compound treatment 788.0 -962.22 -0.8299 1238.0 -740.51 -0.5999 -1.011 -0.9873 3214784 Ald1-H_000889 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(o1)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P03 compound treatment 1270.0 -480.22 -0.4142 842.0 -1136.5 -0.9207 -0.9439 -0.935 3214786 Ald1-H_000890 Cn1cc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P04 compound treatment 0.0 -1750.2 -1.5095 57.0 -1921.5 -1.5566 -2.1681 -0.9999 3214788 Ald1-H_000891 Cn1cc(/C=N/NC(=O)CCCCCC(=O)NO)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P05 compound treatment 644.0 -1106.2 -0.9541 407.0 -1571.5 -1.2731 -1.5748 -0.9899 3214790 Ald1-H_000892 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cn(Cc3ccccc3)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P06 compound treatment 76.0 -1674.2 -1.4439 330.0 -1648.5 -1.3355 -1.9654 -0.9992 3214792 Ald1-H_000893 ONC(=O)CCCCCC(=O)N/N=C/c1cn(Cc2ccccc2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P07 compound treatment 1068.0 -682.22 -0.5884 1018.0 -960.51 -0.7781 -0.9663 -0.9905 3214794 Ald1-H_000894 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/C2=CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P08 compound treatment 19.0 -1731.2 -1.4931 29.0 -1949.5 -1.5793 -2.1725 -0.9996 3214796 Ald1-H_000895 ONC(=O)CCCCCC(=O)N/N=C/C1=CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P09 compound treatment 1323.0 -427.22 -0.3685 1631.0 -347.51 -0.2815 -0.4596 -0.9912 3214798 Ald1-H_000896 OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P10 compound treatment 935.0 -815.22 -0.7031 1181.0 -797.51 -0.6461 -0.954 -0.9991 3214799 Ald1-H_000897 OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P11 mock treatment 1315.0 -435.22 -0.3754 1766.0 -212.51 -0.1722 -0.3872 -0.9375 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P12 mock treatment 1317.0 -433.22 -0.3736 1556.0 -422.51 -0.3423 -0.5062 -0.999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P13 compound treatment 1437.0 -313.22 -0.2701 2375.0 396.49 0.3212 0.0361 0.086 3214800 Ald1-H_000898 OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P14 compound treatment 1390.0 -360.22 -0.3107 2211.0 232.49 0.1883 -0.0865 -0.2381 3214802 Ald1-H_000899 OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P15 compound treatment 1342.0 -408.22 -0.3521 1587.0 -391.51 -0.3172 -0.4732 -0.9986 3214804 Ald1-H_000900 OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)[C@H](O)[C@@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P16 compound treatment 499.0 -1251.2 -1.0791 1329.0 -649.51 -0.5262 -1.1351 -0.9455 3214806 Ald1-H_000901 OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCCC(=O)NO)[C@H](O)[C@@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P17 compound treatment 1128.0 -622.22 -0.5366 1211.0 -767.51 -0.6218 -0.8191 -0.9973 3214808 Ald1-H_000902 C/C(=N\NC(=O)CCCCCC(=O)Nc1ccccc1O)/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P18 compound treatment 1154.0 -596.22 -0.5142 1398.0 -580.51 -0.4703 -0.6961 -0.999 3214810 Ald1-H_000903 C/C(=N\NC(=O)CCCCCC(=O)NO)/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P19 compound treatment 232.0 -1518.2 -1.3094 311.0 -1667.5 -1.3509 -1.8811 -0.9999 3214812 Ald1-H_000904 CN(C)CCCOc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P20 compound treatment 8.0 -1742.2 -1.5026 48.0 -1930.5 -1.5639 -2.1684 -0.9998 3214814 Ald1-H_000905 CN(C)CCCOc1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P21 compound treatment 426.0 -1324.2 -1.1421 821.0 -1157.5 -0.9377 -1.4706 -0.9952 3214816 Ald1-H_000906 CCOc1cc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P22 compound treatment 613.0 -1137.2 -0.9808 620.0 -1358.5 -1.1005 -1.4717 -0.9983 3214818 Ald1-H_000907 CCOc1cc(/C=N/NC(=O)CCCCCC(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P23 compound treatment 732.0 -1018.2 -0.8782 1037.0 -941.51 -0.7627 -1.1603 -0.9975 3214820 Ald1-H_000908 CN(CCO)c1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2133 P24 compound treatment 163.0 -1587.2 -1.3689 125.0 -1853.5 -1.5016 -2.0297 -0.9989 3214822 Ald1-H_000909 CN(CCO)c1ccc(/C=N/NC(=O)CCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A01 compound treatment 70.0 -1564.3 -1.3492 1306.0 -260.63 -0.2111 -1.1033 -0.8079 3214824 Ald1-H_000910 NNC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A02 compound treatment 2693.0 1058.7 0.9131 1312.0 -254.63 -0.2063 0.4998 0.5339 3214825 Ald1-H_000911 COC(=O)CCCCCCC(=O)NN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A03 compound treatment 22.0 -1612.3 -1.3906 108.0 -1458.6 -1.1817 -1.8188 -0.9967 3214826 Ald1-H_000912 ONC(=O)CCCCC(=O)N/N=C/c1ccccc1OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A04 compound treatment 1109.0 -525.32 -0.4531 0.0 -1566.6 -1.2691 -1.2178 -0.9037 3214828 Ald1-H_000913 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A05 compound treatment 22.0 -1612.3 -1.3906 1200.0 -366.63 -0.297 -1.1933 -0.8392 3214830 Ald1-H_000914 COc1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A06 compound treatment 1707.0 72.683 0.0627 423.0 -1143.6 -0.9265 -0.6108 -0.6578 3214832 Ald1-H_000915 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OC)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A07 compound treatment 25.0 -1609.3 -1.388 184.0 -1382.6 -1.1201 -1.7735 -0.9943 3214834 Ald1-H_000916 ONC(=O)CCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A08 compound treatment 1075.0 -559.32 -0.4824 218.0 -1348.6 -1.0925 -1.1136 -0.9325 3214836 Ald1-H_000917 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A09 compound treatment 161.0 -1473.3 -1.2707 550.0 -1016.6 -0.8236 -1.4809 -0.978 3214838 Ald1-H_000918 ONC(=O)CCCCC(=O)N/N=C/c1ccc2OCCOc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A10 compound treatment 2344.0 709.68 0.6121 833.0 -733.63 -0.5943 0.0126 0.0147 3214840 Ald1-H_000919 COC(=O)CCCCCCC(=O)N/N=C/c1ccc2OCCOc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A11 compound treatment 1106.0 -528.32 -0.4557 1232.0 -334.63 -0.2711 -0.5139 -0.9692 3214842 Ald1-H_000920 ONC(=O)CCCCC(=O)N/N=C/COCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A12 compound treatment 1022.0 -612.32 -0.5281 539.0 -1027.6 -0.8325 -0.9621 -0.9759 3214844 Ald1-H_000921 COC(=O)CCCCCCC(=O)N/N=C/COCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A13 mock treatment 1022.0 -612.32 -0.5281 1932.0 365.37 0.296 -0.1641 -0.2711 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A14 mock treatment 1928.0 293.68 0.2533 1502.0 -64.629 -0.0524 0.1421 0.5493 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A15 compound treatment 2.0 -1632.3 -1.4078 56.0 -1510.6 -1.2238 -1.8608 -0.9976 3214846 Ald1-H_000922 ONC(=O)CCCCC(=O)N/N=C/c1ccc(cc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A16 compound treatment 916.0 -718.32 -0.6195 11.0 -1555.6 -1.2602 -1.3292 -0.9465 3214848 Ald1-H_000923 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A17 compound treatment 3.0 -1631.3 -1.4069 2.0 -1564.6 -1.2675 -1.8911 -0.9986 3214850 Ald1-H_000924 ONC(=O)CCCCC(=O)N/N=C/c1ccccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A18 compound treatment 1061.0 -573.32 -0.4945 962.0 -604.63 -0.4898 -0.696 -1.0 3214852 Ald1-H_000925 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A19 compound treatment 1.0 -1633.3 -1.4087 267.0 -1299.6 -1.0528 -1.7406 -0.9897 3214854 Ald1-H_000926 ONC(=O)CCCCC(=O)N/N=C/c1cccc(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A20 compound treatment 952.0 -682.32 -0.5885 0.0 -1566.6 -1.2691 -1.3135 -0.9389 3214856 Ald1-H_000927 COC(=O)CCCCCCC(=O)N/N=C/c1cccc(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A21 compound treatment 24.0 -1610.3 -1.3888 104.0 -1462.6 -1.1849 -1.8199 -0.9969 3214858 Ald1-H_000928 ONC(=O)CCCCC(=O)N/N=C/c1ccc(Br)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A22 compound treatment 736.0 -898.32 -0.7748 970.0 -596.63 -0.4833 -0.8896 -0.9742 3214860 Ald1-H_000929 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(Br)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A23 compound treatment 147.0 -1487.3 -1.2827 416.0 -1150.6 -0.9321 -1.5662 -0.9877 3214862 Ald1-H_000930 ONC(=O)CCCCC(=O)N/N=C/C(=C/c1ccccc1)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 A24 compound treatment 289.0 -1345.3 -1.1603 11.0 -1555.6 -1.2602 -1.7116 -0.9991 3214864 Ald1-H_000931 COC(=O)CCCCCCC(=O)N/N=C/C(=C/c1ccccc1)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B01 compound treatment 1420.0 -214.32 -0.1848 421.0 -1145.6 -0.9281 -0.787 -0.8316 3214866 Ald1-H_000932 COC(=O)CCCCCCC(=O)N/N=C/c1c(O)ccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B02 compound treatment 599.0 -1035.3 -0.8929 547.0 -1019.6 -0.826 -1.2155 -0.9992 3214868 Ald1-H_000933 ONC(=O)CCCCC(=O)N/N=C/c1c(O)ccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B03 compound treatment 1838.0 203.68 0.1757 1582.0 15.371 0.0125 0.133 0.7553 3214870 Ald1-H_000934 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B04 compound treatment 767.0 -867.32 -0.748 836.0 -730.63 -0.5919 -0.9475 -0.9933 3214872 Ald1-H_000935 ONC(=O)CCCCC(=O)N/N=C/c1ccc(O)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B05 compound treatment 1898.0 263.68 0.2274 1886.0 319.37 0.2587 0.3438 0.9979 3214874 Ald1-H_000936 COC(=O)CCCCCCC(=O)N/N=C/c1ccc([N+](=O)[O-])c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B06 compound treatment 1356.0 -278.32 -0.24 1720.0 153.37 0.1242 -0.0819 -0.3029 3214876 Ald1-H_000937 ONC(=O)CCCCC(=O)N/N=C/c1ccc([N+](=O)[O-])c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B07 compound treatment 1314.0 -320.32 -0.2763 2156.0 589.37 0.4775 0.1423 0.2579 3214878 Ald1-H_000938 COC(=O)CCCCCCC(=O)N/N=C/c1cc(O)ccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B08 compound treatment 945.0 -689.32 -0.5945 1097.0 -469.63 -0.3805 -0.6894 -0.9767 3214880 Ald1-H_000939 ONC(=O)CCCCC(=O)N/N=C/c1cc(O)ccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B09 compound treatment 1729.0 94.683 0.0817 1611.0 44.371 0.0359 0.0832 0.9321 3214882 Ald1-H_000940 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)n2ccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B10 compound treatment 1174.0 -460.32 -0.397 1185.0 -381.63 -0.3092 -0.4993 -0.9924 3214884 Ald1-H_000941 ONC(=O)CCCCC(=O)N/N=C/c1ccc(cc1)n2ccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B11 compound treatment 1323.0 -311.32 -0.2685 1392.0 -174.63 -0.1415 -0.2899 -0.9552 3214886 Ald1-H_000942 COC(=O)CCCCCCC(=O)N/N=C/c1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B12 compound treatment 372.0 -1262.3 -1.0887 470.0 -1096.6 -0.8884 -1.398 -0.9949 3214888 Ald1-H_000943 ONC(=O)CCCCC(=O)N/N=C/c1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B13 mock treatment 1859.0 224.68 0.1938 1487.0 -79.629 -0.0645 0.0914 0.4476 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B14 mock treatment 1441.0 -193.32 -0.1667 1270.0 -296.63 -0.2403 -0.2878 -0.9841 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B15 compound treatment 1280.0 -354.32 -0.3056 1318.0 -248.63 -0.2014 -0.3585 -0.9795 3214890 Ald1-H_000944 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(I)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B16 compound treatment 57.0 -1577.3 -1.3604 72.0 -1494.6 -1.2108 -1.8181 -0.9983 3214892 Ald1-H_000945 ONC(=O)CCCCC(=O)N/N=C/c1ccc(I)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B17 compound treatment 1113.0 -521.32 -0.4496 1279.0 -287.63 -0.233 -0.4827 -0.9532 3214894 Ald1-H_000946 COC(=O)CCCCCCC(=O)N/N=C/C(=C\C)/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B18 compound treatment 521.0 -1113.3 -0.9602 728.0 -838.63 -0.6794 -1.1594 -0.9856 3214896 Ald1-H_000947 C/C=C(/C)\C=N\NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B19 compound treatment 451.0 -1183.3 -1.0206 349.0 -1217.6 -0.9864 -1.4191 -0.9999 3214898 Ald1-H_000948 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B20 compound treatment 248.0 -1386.3 -1.1956 171.0 -1395.6 -1.1306 -1.6449 -0.9996 3214900 Ald1-H_000949 ONC(=O)CCCCC(=O)N/N=C/c1ccccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B21 compound treatment 783.0 -851.32 -0.7342 1181.0 -385.63 -0.3124 -0.7401 -0.9275 3214902 Ald1-H_000950 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(C)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B22 compound treatment 390.0 -1244.3 -1.0732 408.0 -1158.6 -0.9386 -1.4226 -0.9978 3214904 Ald1-H_000951 Cc1ccc(/C=N/NC(=O)CCCCC(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B23 compound treatment 720.0 -914.32 -0.7886 1068.0 -498.63 -0.4039 -0.8432 -0.9517 3214906 Ald1-H_000952 COC(=O)CCCCCCC(=O)N/N=C/c1nc[nH]c1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 B24 compound treatment 355.0 -1279.3 -1.1034 279.0 -1287.6 -1.0431 -1.5178 -0.9996 3214908 Ald1-H_000953 Cc1[nH]cnc1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C01 compound treatment 1596.0 -38.317 -0.033 1676.0 109.37 0.0886 0.0393 0.4154 3214910 Ald1-H_000954 ONC(=O)CCCCC(=O)N/N=C/c1ccc(Br)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C02 compound treatment 1060.0 -574.32 -0.4953 998.0 -568.63 -0.4607 -0.676 -0.9993 3214912 Ald1-H_000955 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(Br)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C03 compound treatment 173.0 -1461.3 -1.2603 209.0 -1357.6 -1.0998 -1.6689 -0.9977 3214914 Ald1-H_000956 ONC(=O)CCCCC(=O)N/N=C/c1ccc(O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C04 compound treatment 732.0 -902.32 -0.7782 720.0 -846.63 -0.6859 -1.0353 -0.998 3214916 Ald1-H_000957 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C05 compound treatment 224.0 -1410.3 -1.2163 168.0 -1398.6 -1.133 -1.6613 -0.9994 3214918 Ald1-H_000958 ONC(=O)CCCCC(=O)N/N=C/c1cc(O)ccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C06 compound treatment 628.0 -1006.3 -0.8679 773.0 -793.63 -0.6429 -1.0683 -0.9891 3214920 Ald1-H_000959 COC(=O)CCCCCCC(=O)N/N=C/c1cc(O)ccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C07 compound treatment 2006.0 371.68 0.3206 1590.0 23.371 0.0189 0.2401 0.7476 3214922 Ald1-H_000960 COc1cc(Br)cc(/C=N/NC(=O)CCCCC(=O)NO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C08 compound treatment 523.0 -1111.3 -0.9585 1369.0 -197.63 -0.1601 -0.7909 -0.8139 3214924 Ald1-H_000961 COC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)cc(OC)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C09 compound treatment 5.0 -1629.3 -1.4052 3.0 -1563.6 -1.2667 -1.8893 -0.9987 3214926 Ald1-H_000962 COc1ccc(Br)c(/C=N/NC(=O)CCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C10 compound treatment 1157.0 -477.32 -0.4117 1161.0 -405.63 -0.3286 -0.5235 -0.9938 3214928 Ald1-H_000963 COC(=O)CCCCCCC(=O)N/N=C/c1cc(OC)ccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C11 mock treatment 1843.0 208.68 0.18 2082.0 515.37 0.4175 0.4225 0.9293 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C12 mock treatment 1294.0 -340.32 -0.2935 1352.0 -214.63 -0.1739 -0.3305 -0.9688 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C13 compound treatment 47.0 -1587.3 -1.369 47.0 -1519.6 -1.2311 -1.8385 -0.9986 3214930 Ald1-H_000964 COc1ccc(Br)cc1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C14 compound treatment 1089.0 -545.32 -0.4703 1242.0 -324.63 -0.263 -0.5185 -0.9623 3214932 Ald1-H_000965 COC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)ccc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C15 mock treatment 1660.0 25.683 0.0222 1757.0 190.37 0.1542 0.1247 0.8005 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C16 mock treatment 1157.0 -477.32 -0.4117 1164.0 -402.63 -0.3262 -0.5217 -0.9934 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C17 compound treatment 6.0 -1628.3 -1.4044 743.0 -823.63 -0.6672 -1.4648 -0.9421 3214934 Ald1-H_000966 ONC(=O)CCCCC(=O)N/N=C/c1cc2OCOc2cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C18 compound treatment 840.0 -794.32 -0.6851 805.0 -761.63 -0.617 -0.9207 -0.9986 3214936 Ald1-H_000967 COC(=O)CCCCCCC(=O)N/N=C/c1cc2OCOc2cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C19 compound treatment 78.0 -1556.3 -1.3423 120.0 -1446.6 -1.1719 -1.7778 -0.9977 3214938 Ald1-H_000968 ONC(=O)CCCCC(=O)N/N=C/c1cccnc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C20 compound treatment 639.0 -995.32 -0.8584 667.0 -899.63 -0.7288 -1.1223 -0.9967 3214940 Ald1-H_000969 COC(=O)CCCCCCC(=O)N/N=C/c1cccnc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C21 compound treatment 30.0 -1604.3 -1.3837 20.0 -1546.6 -1.2529 -1.8644 -0.9988 3214942 Ald1-H_000970 ONC(=O)CCCCC(=O)N/N=C/c1ccncc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C22 compound treatment 487.0 -1147.3 -0.9895 549.0 -1017.6 -0.8244 -1.2826 -0.9959 3214944 Ald1-H_000971 COC(=O)CCCCCCC(=O)N/N=C/c1ccncc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C23 compound treatment 376.0 -1258.3 -1.0852 442.0 -1124.6 -0.9111 -1.4116 -0.9962 3214946 Ald1-H_000972 ONC(=O)CCCCC(=O)N/N=C/c1cc(Br)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 C24 compound treatment 545.0 -1089.3 -0.9395 440.0 -1126.6 -0.9127 -1.3097 -0.9999 3214948 Ald1-H_000973 COC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D01 compound treatment 2027.0 392.68 0.3387 2184.0 617.37 0.5001 0.5931 0.982 3214950 Ald1-H_000974 COC(=O)CCCCCCC(=O)N/N=C/c1sccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D02 compound treatment 54.0 -1580.3 -1.363 48.0 -1518.6 -1.2303 -1.8337 -0.9987 3214952 Ald1-H_000975 Cc1ccsc1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D03 compound treatment 2011.0 376.68 0.3249 2723.0 1156.4 0.9368 0.8921 0.8998 3214954 Ald1-H_000976 COC(=O)CCCCCCC(=O)N/N=C/C1=CC[C@H]2C[C@@H]1C2(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D04 compound treatment 1186.0 -448.32 -0.3867 1121.0 -445.63 -0.361 -0.5287 -0.9994 3214956 Ald1-H_000977 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D05 compound treatment 2062.0 427.68 0.3689 2284.0 717.37 0.5812 0.6718 0.9759 3214958 Ald1-H_000978 COC(=O)CCCCCCC(=O)N/N=C/c1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D06 compound treatment 4.0 -1630.3 -1.4061 4.0 -1562.6 -1.2659 -1.8894 -0.9986 3214960 Ald1-H_000979 ONC(=O)CCCCC(=O)N/N=C/c1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D07 compound treatment 2150.0 515.68 0.4448 2833.0 1266.4 1.0259 1.0399 0.93 3214962 Ald1-H_000980 COC(=O)CCCCCCC(=O)N/N=C/c1cc(OC)c(OC)cc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D08 compound treatment 109.0 -1525.3 -1.3155 170.0 -1396.6 -1.1314 -1.7303 -0.9972 3214964 Ald1-H_000981 COc1cc(/C=N/NC(=O)CCCCC(=O)NO)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D09 compound treatment 1689.0 54.683 0.0472 1703.0 136.37 0.1105 0.1115 0.9279 3214966 Ald1-H_000982 COC(=O)CCCCCCC(=O)N/N=C/c1ccc2ccccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D10 compound treatment 66.0 -1568.3 -1.3526 72.0 -1494.6 -1.2108 -1.8126 -0.9985 3214968 Ald1-H_000983 ONC(=O)CCCCC(=O)N/N=C/c1ccc2ccccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D11 mock treatment 2075.0 440.68 0.3801 2018.0 451.37 0.3657 0.5273 0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D12 mock treatment 1375.0 -259.32 -0.2237 1618.0 51.371 0.0416 -0.1287 -0.5658 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D13 compound treatment 1388.0 -246.32 -0.2124 1850.0 283.37 0.2296 0.0121 0.0387 3214970 Ald1-H_000984 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(s1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D14 compound treatment 882.0 -752.32 -0.6488 740.0 -826.63 -0.6697 -0.9323 -0.9999 3214972 Ald1-H_000985 ONC(=O)CCCCC(=O)N/N=C/c1ccc(s1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D15 mock treatment 1457.0 -177.32 -0.1529 1386.0 -180.63 -0.1463 -0.2116 -0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D16 mock treatment 945.0 -689.32 -0.5945 1107.0 -459.63 -0.3724 -0.6837 -0.9746 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D17 compound treatment 1673.0 38.683 0.0334 1645.0 78.371 0.0635 0.0685 0.9549 3214974 Ald1-H_000986 COC(=O)CCCCCCC(=O)N/N=C/c1c(F)c(F)c(F)c(F)c1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D18 compound treatment 1270.0 -364.32 -0.3142 639.0 -927.63 -0.7515 -0.7536 -0.9251 3214976 Ald1-H_000987 ONC(=O)CCCCC(=O)N/N=C/c1c(F)c(F)c(F)c(F)c1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D19 compound treatment 1407.0 -227.32 -0.1961 1324.0 -242.63 -0.1966 -0.2776 -1.0 3214978 Ald1-H_000988 COC(=O)CCCCCCC(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D20 compound treatment 793.0 -841.32 -0.7256 795.0 -771.63 -0.6251 -0.9551 -0.9972 3214980 Ald1-H_000989 ONC(=O)CCCCC(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D21 compound treatment 694.0 -940.32 -0.811 1112.0 -454.63 -0.3683 -0.8339 -0.9362 3214982 Ald1-H_000990 COC(=O)CCCCCCC(=O)N/N=C/C1=CC[C@H](CC1)C(=C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D22 compound treatment 202.0 -1432.3 -1.2353 250.0 -1316.6 -1.0666 -1.6277 -0.9973 3214984 Ald1-H_000991 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D23 compound treatment 606.0 -1028.3 -0.8869 879.0 -687.63 -0.5571 -1.021 -0.9749 3214986 Ald1-H_000992 COC(=O)CCCCCCC(=O)N/N=C/c1cccc(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 D24 compound treatment 88.0 -1546.3 -1.3336 98.0 -1468.6 -1.1898 -1.7843 -0.9984 3214988 Ald1-H_000993 ONC(=O)CCCCC(=O)N/N=C/c1cccc(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E01 mock treatment 2190.0 555.68 0.4793 4353.0 2786.4 2.2573 1.935 0.8385 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E02 mock treatment 1444.0 -190.32 -0.1641 1826.0 259.37 0.2101 0.0325 0.1219 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E03 compound treatment 248.0 -1386.3 -1.1956 171.0 -1395.6 -1.1306 -1.6449 -0.9996 3214990 Ald1-H_000994 ONC(=O)CCCCC(=O)N/N=C/c1ccc(Br)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E04 compound treatment 2201.0 566.68 0.4887 3.0 -1563.6 -1.2667 -0.5501 -0.4052 3214992 Ald1-H_000995 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(Br)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E05 compound treatment 1157.0 -477.32 -0.4117 1167.0 -399.63 -0.3237 -0.52 -0.9929 3214994 Ald1-H_000996 COc1cc(/C=N/NC(=O)CCCCC(=O)NO)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E06 compound treatment 758.0 -876.32 -0.7558 642.0 -924.63 -0.7491 -1.0641 -1.0 3214996 Ald1-H_000997 COC(=O)CCCCCCC(=O)N/N=C/c1cc(OC)c(O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E07 compound treatment 1922.0 287.68 0.2481 1533.0 -33.629 -0.0272 0.1562 0.6257 3214998 Ald1-H_000998 ONC(=O)CCCCC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E08 compound treatment 2667.0 1032.7 0.8906 1372.0 -194.63 -0.1577 0.5183 0.573 3215000 Ald1-H_000999 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E09 mock treatment 3088.0 1453.7 1.2537 1567.0 0.37097 3.0E-4 0.8867 0.7073 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E10 mock treatment 1882.0 247.68 0.2136 3.0 -1563.6 -1.2667 -0.7447 -0.5797 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E11 compound treatment 2064.0 429.68 0.3706 1319.0 -247.63 -0.2006 0.1202 0.2852 3215002 Ald1-H_001000 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E12 compound treatment 1851.0 216.68 0.1869 1839.0 272.37 0.2207 0.2882 0.9966 3215004 Ald1-H_001001 COC(=O)CCCCCCC(=O)N/N=C/C1(CCCC1)NC(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E13 compound treatment 1780.0 145.68 0.1256 2250.0 683.37 0.5536 0.4803 0.8461 3215006 Ald1-H_001002 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E14 compound treatment 1434.0 -200.32 -0.1728 2008.0 441.37 0.3576 0.1307 0.3291 3215008 Ald1-H_001003 COC(=O)CCCCCCC(=O)N/N=C/[C@@H]1CCCN1C(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E15 compound treatment 749.0 -885.32 -0.7635 841.0 -725.63 -0.5878 -0.9556 -0.9917 3215010 Ald1-H_001004 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)CCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E16 compound treatment 1574.0 -60.317 -0.052 1159.0 -407.63 -0.3302 -0.2703 -0.8085 3215012 Ald1-H_001005 COC(=O)CCCCCCC(=O)N/N=C/c1cccc(NC(=O)OC(C)(C)C)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E17 mock treatment 1572.0 -62.317 -0.0537 1456.0 -110.63 -0.0896 -0.1014 -0.9701 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E18 mock treatment 1116.0 -518.32 -0.447 1263.0 -303.63 -0.246 -0.49 -0.9604 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E19 compound treatment 1320.0 -314.32 -0.2711 1217.0 -349.63 -0.2832 -0.392 -0.9998 3215014 Ald1-H_001006 ONC(=O)CCCCC(=O)N/N=C/c1cccc(c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E20 compound treatment 1000.0 -634.32 -0.5471 1068.0 -498.63 -0.4039 -0.6725 -0.9889 3215016 Ald1-H_001007 COC(=O)CCCCCCC(=O)N/N=C/c1cccc(c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E21 compound treatment 1245.0 -389.32 -0.3358 994.0 -572.63 -0.4639 -0.5654 -0.9874 3215018 Ald1-H_001008 ONC(=O)CCCCC(=O)N/N=C/c1ccccc1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E22 compound treatment 1605.0 -29.317 -0.0253 573.0 -993.63 -0.805 -0.5871 -0.729 3215020 Ald1-H_001009 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E23 compound treatment 946.0 -688.32 -0.5936 1205.0 -361.63 -0.293 -0.6269 -0.947 3215022 Ald1-H_001010 ONC(=O)CCCCC(=O)N/N=C/c1ccc(cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 E24 compound treatment 583.0 -1051.3 -0.9067 419.0 -1147.6 -0.9297 -1.2986 -0.9999 3215024 Ald1-H_001011 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F01 mock treatment 1475.0 -159.32 -0.1374 1688.0 121.37 0.0983 -0.0276 -0.1636 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F02 mock treatment 1846.0 211.68 0.1826 1265.0 -301.63 -0.2444 -0.0437 -0.1432 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F03 compound treatment 1511.0 -123.32 -0.1064 1474.0 -92.629 -0.075 -0.1283 -0.9854 3215026 Ald1-H_001012 COC(=O)CCCCCCC(=O)N/N=C/c1cn(c2ccccc12)S(=O)(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F04 compound treatment 352.0 -1282.3 -1.1059 389.0 -1177.6 -0.954 -1.4566 -0.9973 3215028 Ald1-H_001013 ONC(=O)CCCCC(=O)N/N=C/c1cn(c2ccccc12)S(=O)(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F05 compound treatment 2240.0 605.68 0.5224 2238.0 671.37 0.5439 0.754 0.9998 3215030 Ald1-H_001014 COC(=O)CCCCCCC(=O)N/N=C/c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F06 compound treatment 1339.0 -295.32 -0.2547 1414.0 -152.63 -0.1236 -0.2675 -0.9449 3215032 Ald1-H_001015 ONC(=O)CCCCC(=O)N/N=C/c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F07 compound treatment 2164.0 529.68 0.4568 2803.0 1236.4 1.0016 1.0313 0.9368 3215034 Ald1-H_001016 COC(=O)CCCCCCC(=O)N/N=C/c1cccnc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F08 compound treatment 1914.0 279.68 0.2412 1277.0 -289.63 -0.2346 0.0047 0.0138 3215036 Ald1-H_001017 ONC(=O)CCCCC(=O)N/N=C/c1cccnc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F09 mock treatment 2511.0 876.68 0.7561 2163.0 596.37 0.4831 0.8763 0.9766 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F10 mock treatment 3349.0 1714.7 1.4788 1852.0 285.37 0.2312 1.2092 0.8078 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F11 compound treatment 3565.0 1930.7 1.6651 1995.0 428.37 0.347 1.4228 0.8365 3215038 Ald1-H_001018 COC(=O)CCCCCCC(=O)N/N=C/c1c(O)c(C)ncc1CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F12 compound treatment 1985.0 350.68 0.3024 1841.0 274.37 0.2223 0.371 0.9885 3215040 Ald1-H_001019 Cc1ncc(CO)c(/C=N/NC(=O)CCCCC(=O)NO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F13 compound treatment 1469.0 -165.32 -0.1426 837.0 -729.63 -0.5911 -0.5188 -0.8532 3215042 Ald1-H_001020 COC(=O)CCCCCCC(=O)N/N=C/c1ccc[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F14 compound treatment 2960.0 1325.7 1.1433 1466.0 -100.63 -0.0815 0.7508 0.655 3215044 Ald1-H_001021 ONC(=O)CCCCC(=O)N/N=C/c1ccc[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F15 compound treatment 612.0 -1022.3 -0.8817 691.0 -875.63 -0.7094 -1.1251 -0.9942 3215046 Ald1-H_001022 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)N2CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F16 compound treatment 360.0 -1274.3 -1.099 336.0 -1230.6 -0.9969 -1.4821 -0.9988 3215048 Ald1-H_001023 ONC(=O)CCCCC(=O)N/N=C/c1ccc(cc1)N2CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F17 mock treatment 2349.0 714.68 0.6164 1839.0 272.37 0.2207 0.5919 0.9041 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F18 mock treatment 1445.0 -189.32 -0.1633 1814.0 247.37 0.2004 0.0262 0.1015 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F19 compound treatment 1462.0 -172.32 -0.1486 1350.0 -216.63 -0.1755 -0.2292 -0.9966 3215050 Ald1-H_001024 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F20 compound treatment 364.0 -1270.3 -1.0956 181.0 -1385.6 -1.1225 -1.5684 -0.9999 3215052 Ald1-H_001025 ONC(=O)CCCCC(=O)N/N=C/c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F21 compound treatment 1541.0 -93.317 -0.0805 912.0 -654.63 -0.5303 -0.4319 -0.8052 3215054 Ald1-H_001026 CCCCCCC/C=N/NC(=O)CCCCCCC(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F22 compound treatment 907.0 -727.32 -0.6273 808.0 -758.63 -0.6146 -0.8781 -0.9999 3215056 Ald1-H_001027 CCCCCCC/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F23 compound treatment 1167.0 -467.32 -0.403 1313.0 -253.63 -0.2055 -0.4303 -0.9511 3215058 Ald1-H_001028 COC(=O)CCCCCCC(=O)N/N=C/c1nccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 F24 compound treatment 540.0 -1094.3 -0.9438 275.0 -1291.6 -1.0464 -1.4073 -0.9987 3215060 Ald1-H_001029 ONC(=O)CCCCC(=O)N/N=C/c1nccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G01 compound treatment 11.0 -1623.3 -1.4 2026.0 459.37 0.3721 -0.7268 -0.5017 3215062 Ald1-H_001030 ONC(=O)CCCCC(=O)N/N=C/c1ccccc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G02 compound treatment 1123.0 -511.32 -0.441 1141.0 -425.63 -0.3448 -0.5556 -0.9926 3215064 Ald1-H_001031 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G03 mock treatment 1343.0 -291.32 -0.2512 1614.0 47.371 0.0384 -0.1505 -0.5922 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G04 mock treatment 1098.0 -536.32 -0.4626 1017.0 -549.63 -0.4453 -0.6419 -0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G05 compound treatment 225.0 -1409.3 -1.2155 192.0 -1374.6 -1.1136 -1.6469 -0.999 3215066 Ald1-H_001032 ONC(=O)CCCCC(=O)N/N=C/c1cccnc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G06 compound treatment 1064.0 -570.32 -0.4919 543.0 -1023.6 -0.8293 -0.9342 -0.9689 3215068 Ald1-H_001033 COC(=O)CCCCCCC(=O)N/N=C/c1cccnc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G07 compound treatment 250.0 -1384.3 -1.1939 180.0 -1386.6 -1.1233 -1.6385 -0.9995 3215070 Ald1-H_001034 ONC(=O)CCCCC(=O)N/N=C/C=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G08 compound treatment 832.0 -802.32 -0.692 780.0 -786.63 -0.6373 -0.9399 -0.9992 3215072 Ald1-H_001035 COC(=O)CCCCCCC(=O)N/N=C/C=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G09 compound treatment 1172.0 -462.32 -0.3987 992.0 -574.63 -0.4655 -0.6111 -0.997 3215074 Ald1-H_001036 C[C@H](CCC=C(C)C)C/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G10 compound treatment 1120.0 -514.32 -0.4436 654.0 -912.63 -0.7393 -0.8364 -0.9701 3215076 Ald1-H_001037 COC(=O)CCCCCCC(=O)N/N=C/C[C@H](C)CCC=C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G11 compound treatment 1039.0 -595.32 -0.5134 967.0 -599.63 -0.4858 -0.7065 -0.9996 3215078 Ald1-H_001038 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G12 compound treatment 840.0 -794.32 -0.6851 398.0 -1168.6 -0.9467 -1.1538 -0.9874 3215079 Ald1-H_001039 COC(=O)CCCCCCC(=O)N/N=C/C[C@@H](C)CCC=C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G13 compound treatment 576.0 -1058.3 -0.9128 732.0 -834.63 -0.6761 -1.1235 -0.9891 3215080 Ald1-H_001040 ONC(=O)CCCCC(=O)N/N=C/c1ccc(C#N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G14 compound treatment 949.0 -685.32 -0.5911 1153.0 -413.63 -0.3351 -0.6549 -0.9639 3215082 Ald1-H_001041 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(C#N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G15 compound treatment 1028.0 -606.32 -0.5229 914.0 -652.63 -0.5287 -0.7436 -1.0 3215084 Ald1-H_001042 ONC(=O)CCCCC(=O)N/N=C/C1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G16 compound treatment 846.0 -788.32 -0.6799 809.0 -757.63 -0.6138 -0.9148 -0.9987 3215086 Ald1-H_001043 COC(=O)CCCCCCC(=O)N/N=C/C1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G17 compound treatment 212.0 -1422.3 -1.2267 299.0 -1267.6 -1.0269 -1.5935 -0.9961 3215088 Ald1-H_001044 COc1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G18 compound treatment 819.0 -815.32 -0.7032 532.0 -1034.6 -0.8382 -1.0899 -0.9962 3215090 Ald1-H_001045 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OC)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G19 mock treatment 925.0 -709.32 -0.6118 1052.0 -514.63 -0.4169 -0.7274 -0.9825 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G20 mock treatment 669.0 -965.32 -0.8325 734.0 -832.63 -0.6745 -1.0657 -0.9945 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G21 compound treatment 469.0 -1165.3 -1.005 548.0 -1018.6 -0.8252 -1.2942 -0.9952 3215092 Ald1-H_001046 ONC(=O)CCCCC(=O)N/N=C/c1cc(Br)cc(Br)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G22 compound treatment 739.0 -895.32 -0.7722 405.0 -1161.6 -0.9411 -1.2114 -0.9952 3215094 Ald1-H_001047 COC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)cc(Br)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G23 compound treatment 4.0 -1630.3 -1.4061 6.0 -1560.6 -1.2643 -1.8882 -0.9986 3215096 Ald1-H_001048 CCCCN(CCCC)c1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 G24 compound treatment 0.0 -1634.3 -1.4095 1.0 -1565.6 -1.2683 -1.8935 -0.9986 3215098 Ald1-H_001049 CCCCN(CCCC)c1ccc(/C=N/NC(=O)CCCCCCC(=O)OC)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H01 compound treatment 2068.0 433.68 0.374 2251.0 684.37 0.5544 0.6565 0.9816 3215100 Ald1-H_001050 COC(=O)CCCCCCC(=O)N/N=C/c1cccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H02 compound treatment 800.0 -834.32 -0.7196 774.0 -792.63 -0.6421 -0.9629 -0.9984 3215102 Ald1-H_001051 ONC(=O)CCCCC(=O)N/N=C/c1cccs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H03 mock treatment 2751.0 1116.7 0.9631 2151.0 584.37 0.4734 1.0158 0.9465 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H04 mock treatment 2010.0 375.68 0.324 1628.0 61.371 0.0497 0.2643 0.8062 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H05 compound treatment 2148.0 513.68 0.443 1834.0 267.37 0.2166 0.4664 0.9458 3215104 Ald1-H_001052 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H06 compound treatment 356.0 -1278.3 -1.1025 1028.0 -538.63 -0.4364 -1.0881 -0.9177 3215106 Ald1-H_001053 ONC(=O)CCCCC(=O)N/N=C/c1ccc(cc1)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H07 compound treatment 2123.0 488.68 0.4215 2049.0 482.37 0.3908 0.5743 0.9993 3215108 Ald1-H_001054 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H08 compound treatment 598.0 -1036.3 -0.8938 203.0 -1363.6 -1.1047 -1.4131 -0.9945 3215110 Ald1-H_001055 ONC(=O)CCCCC(=O)N/N=C/c1ccc(O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H09 compound treatment 2016.0 381.68 0.3292 1687.0 120.37 0.0975 0.3017 0.8788 3215112 Ald1-H_001056 COC(=O)CCCCCCC(=O)N/N=C/c1c(O)cc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H10 compound treatment 2135.0 500.68 0.4318 1670.0 103.37 0.0837 0.3646 0.8288 3215114 Ald1-H_001057 ONC(=O)CCCCC(=O)N/N=C/c1c(O)cc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H11 compound treatment 1599.0 -35.317 -0.0305 1607.0 40.371 0.0327 0.0016 0.0355 3215116 Ald1-H_001058 COC(=O)CCCCCCC(=O)N/N=C/c1c(OC)cc(OC)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H12 compound treatment 1416.0 -218.32 -0.1883 1782.0 215.37 0.1745 -0.0098 -0.0381 3215118 Ald1-H_001059 COc1cc(OC)c(/C=N/NC(=O)CCCCC(=O)NO)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H13 compound treatment 1955.0 320.68 0.2766 2210.0 643.37 0.5212 0.5641 0.9561 3215120 Ald1-H_001060 COC(=O)CCCCCCC(=O)N/N=C/c1cc(OC)c(OC)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H14 compound treatment 1090.0 -544.32 -0.4695 1355.0 -211.63 -0.1714 -0.4532 -0.9068 3215122 Ald1-H_001061 COc1cc(/C=N/NC(=O)CCCCC(=O)NO)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H15 compound treatment 1694.0 59.683 0.0515 1558.0 -8.629 -0.007 0.0315 0.6055 3215124 Ald1-H_001062 COC(=O)CCCCCCC(=O)N/N=C/C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H16 compound treatment 1212.0 -422.32 -0.3642 1354.0 -212.63 -0.1723 -0.3794 -0.9415 3215126 Ald1-H_001063 CC(C)(C)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H17 compound treatment 918.0 -716.32 -0.6178 879.0 -687.63 -0.5571 -0.8307 -0.9987 3215128 Ald1-H_001064 COC(=O)CCCCCCC(=O)N/N=C/CC1=C(C)CCCC1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H18 compound treatment 1059.0 -575.32 -0.4962 1171.0 -395.63 -0.3205 -0.5775 -0.9776 3215130 Ald1-H_001065 CC1=C(C/C=N/NC(=O)CCCCC(=O)NO)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H19 mock treatment 1463.0 -171.32 -0.1478 1772.0 205.37 0.1664 0.0132 0.0592 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H20 mock treatment 795.0 -839.32 -0.7239 1300.0 -266.63 -0.216 -0.6646 -0.8798 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H21 compound treatment 956.0 -678.32 -0.585 1152.0 -414.63 -0.3359 -0.6512 -0.9653 3215132 Ald1-H_001066 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1OCC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H22 compound treatment 641.0 -993.32 -0.8567 677.0 -889.63 -0.7207 -1.1154 -0.9963 3215134 Ald1-H_001067 NC(=O)COc1ccccc1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H23 compound treatment 1230.0 -404.32 -0.3487 1416.0 -150.63 -0.122 -0.3329 -0.901 3215136 Ald1-H_001068 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OCC(=O)N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 H24 compound treatment 828.0 -806.32 -0.6954 547.0 -1019.6 -0.826 -1.0758 -0.9963 3215138 Ald1-H_001069 NC(=O)COc1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I01 compound treatment 150.0 -1484.3 -1.2802 213.0 -1353.6 -1.0966 -1.6806 -0.997 3215140 Ald1-H_001070 COc1cc(Cl)c(/C=N/NC(=O)CCCCC(=O)NO)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I02 compound treatment 2010.0 375.68 0.324 1443.0 -123.63 -0.1002 0.1583 0.4667 3215142 Ald1-H_001071 COC(=O)CCCCCCC(=O)N/N=C/c1c(Cl)cc(OC)c(OC)c1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I03 compound treatment 2388.0 753.68 0.65 3421.0 1854.4 1.5023 1.5219 0.9298 3215144 Ald1-H_001072 ONC(=O)CCCCC(=O)N/N=C/c1cc(Cl)cc(Cl)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I04 compound treatment 1152.0 -482.32 -0.416 1402.0 -164.63 -0.1334 -0.3884 -0.8892 3215146 Ald1-H_001073 COC(=O)CCCCCCC(=O)N/N=C/c1cc(Cl)cc(Cl)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I05 mock treatment 2245.0 610.68 0.5267 2173.0 606.37 0.4912 0.7198 0.9994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I06 mock treatment 1974.0 339.68 0.293 1580.0 13.371 0.0108 0.2148 0.7328 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I07 compound treatment 2691.0 1056.7 0.9113 2395.0 828.37 0.6711 1.1189 0.9887 3215148 Ald1-H_001074 ONC(=O)CCCCC(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I08 compound treatment 1626.0 -8.3175 -0.0072 1891.0 324.37 0.2628 0.1807 0.6875 3215150 Ald1-H_001075 COC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I09 compound treatment 215.0 -1419.3 -1.2241 1168.0 -398.63 -0.3229 -1.0939 -0.8641 3215152 Ald1-H_001076 CCN(CC)c1ccc(/C=N/NC(=O)CCCCC(=O)NO)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I10 compound treatment 945.0 -689.32 -0.5945 696.0 -870.63 -0.7053 -0.9191 -0.9964 3215154 Ald1-H_001077 CCN(CC)c1ccc(/C=N/NC(=O)CCCCCCC(=O)OC)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I11 compound treatment 970.0 -664.32 -0.5729 794.0 -772.63 -0.6259 -0.8477 -0.999 3215156 Ald1-H_001078 ONC(=O)CCCCC(=O)N/N=C/c1ccc2OCCc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I12 compound treatment 1489.0 -145.32 -0.1253 1799.0 232.37 0.1882 0.0445 0.1967 3215158 Ald1-H_001079 COC(=O)CCCCCCC(=O)N/N=C/c1ccc2OCCc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I13 compound treatment 602.0 -1032.3 -0.8903 976.0 -590.63 -0.4785 -0.9679 -0.9576 3215160 Ald1-H_001080 ONC(=O)CCCCC(=O)N/N=C/c1cccc(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I14 compound treatment 109.0 -1525.3 -1.3155 169.0 -1397.6 -1.1322 -1.7308 -0.9972 3215162 Ald1-H_001081 COC(=O)CCCCCCC(=O)N/N=C/c1cccc(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I15 compound treatment 1320.0 -314.32 -0.2711 1155.0 -411.63 -0.3335 -0.4275 -0.9947 3215164 Ald1-H_001082 ONC(=O)CCCCC(=O)N/N=C/c1ccc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I16 compound treatment 426.0 -1208.3 -1.0421 410.0 -1156.6 -0.937 -1.3995 -0.9986 3215166 Ald1-H_001083 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I17 compound treatment 985.0 -649.32 -0.56 996.0 -570.63 -0.4623 -0.7229 -0.9955 3215168 Ald1-H_001084 ONC(=O)CCCCC(=O)N/N=C/c1cc(O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I18 compound treatment 11.0 -1623.3 -1.4 9.0 -1557.6 -1.2619 -1.8822 -0.9987 3215170 Ald1-H_001085 COC(=O)CCCCCCC(=O)N/N=C/c1cc(O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I19 compound treatment 659.0 -975.32 -0.8412 732.0 -834.63 -0.6761 -1.0729 -0.9941 3215172 Ald1-H_001086 ONC(=O)CCCCC(=O)N/N=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I20 compound treatment 90.0 -1544.3 -1.3319 146.0 -1420.6 -1.1509 -1.7556 -0.9974 3215174 Ald1-H_001087 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I21 mock treatment 1187.0 -447.32 -0.3858 1180.0 -386.63 -0.3132 -0.4943 -0.9947 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I22 mock treatment 973.0 -661.32 -0.5704 957.0 -609.63 -0.4939 -0.7525 -0.9974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I23 compound treatment 536.0 -1098.3 -0.9473 703.0 -863.63 -0.6996 -1.1645 -0.9889 3215176 Ald1-H_001088 COc1ccc(/C=N/NC(=O)CCCCC(=O)NO)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 I24 compound treatment 631.0 -1003.3 -0.8653 756.0 -810.63 -0.6567 -1.0762 -0.9907 3215178 Ald1-H_001089 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OC)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J01 compound treatment 1962.0 327.68 0.2826 1754.0 187.37 0.1518 0.3072 0.9575 3215180 Ald1-H_001090 COC(=O)CCCCCCC(=O)NN=C1CCCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J02 compound treatment 1353.0 -281.32 -0.2426 1280.0 -286.63 -0.2322 -0.3358 -0.9998 3215181 Ald1-H_001091 ONC(=O)CCCCC(=O)NN=C1CCCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J03 compound treatment 2374.0 739.68 0.6379 1943.0 376.37 0.3049 0.6667 0.9429 3215182 Ald1-H_001092 COC(=O)CCCCCCC(=O)NN=C1CCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J04 compound treatment 1360.0 -274.32 -0.2366 1151.0 -415.63 -0.3367 -0.4054 -0.9851 3215183 Ald1-H_001093 ONC(=O)CCCCC(=O)NN=C1CCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J05 mock treatment 1962.0 327.68 0.2826 1913.0 346.37 0.2806 0.3983 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J06 mock treatment 1892.0 257.68 0.2222 1427.0 -139.63 -0.1131 0.0772 0.3094 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J07 compound treatment 1890.0 255.68 0.2205 1698.0 131.37 0.1064 0.2312 0.9442 3215184 Ald1-H_001094 COC(=O)CCCCCCC(=O)NN=C1CCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J08 compound treatment 1824.0 189.68 0.1636 1392.0 -174.63 -0.1415 0.0156 0.0723 3215185 Ald1-H_001095 ONC(=O)CCCCC(=O)NN=C1CCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J09 compound treatment 1894.0 259.68 0.224 1759.0 192.37 0.1558 0.2686 0.9843 3214825 Ald1-H_001096 COC(=O)CCCCCCC(=O)NN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J10 compound treatment 1665.0 30.683 0.0265 1333.0 -233.63 -0.1893 -0.1151 -0.6024 3214824 Ald1-H_001097 NNC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J11 compound treatment 1768.0 133.68 0.1153 1545.0 -21.629 -0.0175 0.0691 0.5928 3215186 Ald1-H_001098 COC(=O)CCCCCCC(=O)N/N=C/c1cc(OC)c(OC)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J12 compound treatment 196.0 -1438.3 -1.2405 39.0 -1527.6 -1.2376 -1.7522 -1.0 3215188 Ald1-H_001099 COc1cc(Br)c(/C=N/NC(=O)CCCCC(=O)NO)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J13 compound treatment 2346.0 711.68 0.6138 1676.0 109.37 0.0886 0.4967 0.8009 3215190 Ald1-H_001100 COC(=O)CCCCCCC(=O)N/N=C/CCC1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J14 compound treatment 956.0 -678.32 -0.585 1303.0 -263.63 -0.2136 -0.5647 -0.9067 3215192 Ald1-H_001101 ONC(=O)CCCCC(=O)N/N=C/CCC1CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J15 compound treatment 1694.0 59.683 0.0515 1201.0 -365.63 -0.2962 -0.173 -0.5756 3215194 Ald1-H_001102 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J16 compound treatment 1380.0 -254.32 -0.2193 1033.0 -533.63 -0.4323 -0.4608 -0.9505 3215196 Ald1-H_001103 ONC(=O)CCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J17 compound treatment 150.0 -1484.3 -1.2802 154.0 -1412.6 -1.1444 -1.7144 -0.9984 3215198 Ald1-H_001104 COC(=O)CCCCCCC(=O)N/N=C/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J18 compound treatment 892.0 -742.32 -0.6402 479.0 -1087.6 -0.8811 -1.0757 -0.9877 3215200 Ald1-H_001105 ONC(=O)CCCCC(=O)N/N=C/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J19 compound treatment 1617.0 -17.317 -0.0149 1611.0 44.371 0.0359 0.0149 0.3817 3214825 Ald1-H_001106 COC(=O)CCCCCCC(=O)NN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J20 compound treatment 1070.0 -564.32 -0.4867 834.0 -732.63 -0.5935 -0.7638 -0.9951 3214824 Ald1-H_001107 NNC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J21 mock treatment 1352.0 -282.32 -0.2435 1541.0 -25.629 -0.0208 -0.1869 -0.7646 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J22 mock treatment 1360.0 -274.32 -0.2366 1369.0 -197.63 -0.1601 -0.2805 -0.9819 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J23 compound treatment 1314.0 -320.32 -0.2763 1262.0 -304.63 -0.2468 -0.3698 -0.9984 3214825 Ald1-H_001108 COC(=O)CCCCCCC(=O)NN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 J24 compound treatment 1065.0 -569.32 -0.491 1199.0 -367.63 -0.2978 -0.5578 -0.9713 3214824 Ald1-H_001109 NNC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K01 compound treatment 1967.0 332.68 0.2869 1980.0 413.37 0.3349 0.4397 0.997 3215202 Ald1-H_001110 COc1cccc(OC)c1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K02 compound treatment 1629.0 -5.3175 -0.0046 1472.0 -94.629 -0.0767 -0.0574 -0.7481 3215204 Ald1-H_001111 COC(=O)CCCCCCC(=O)N/N=C/c1c(OC)cccc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K03 compound treatment 2011.0 376.68 0.3249 1726.0 159.37 0.1291 0.321 0.9183 3215206 Ald1-H_001112 COc1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K04 compound treatment 1436.0 -198.32 -0.171 1557.0 -9.629 -0.0078 -0.1265 -0.7386 3215208 Ald1-H_001113 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OC)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K05 compound treatment 2288.0 653.68 0.5638 2113.0 546.37 0.4426 0.7116 0.9928 3215210 Ald1-H_001114 COc1cc(O)cc(OC)c1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K06 compound treatment 1212.0 -422.32 -0.3642 1147.0 -419.63 -0.3399 -0.4979 -0.9994 3215212 Ald1-H_001115 COC(=O)CCCCCCC(=O)N/N=C/c1c(OC)cc(O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K07 mock treatment 1708.0 73.683 0.0635 1701.0 134.37 0.1089 0.1219 0.9672 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K08 mock treatment 1884.0 249.68 0.2153 1302.0 -264.63 -0.2144 7.0E-4 0.0022 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K09 compound treatment 1291.0 -343.32 -0.2961 1408.0 -158.63 -0.1285 -0.3002 -0.9302 3215214 Ald1-H_001116 CC1(C)COC(CCC/C=N/NC(=O)CCCCC(=O)NO)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K10 compound treatment 1625.0 -9.3175 -0.008 1132.0 -434.63 -0.3521 -0.2547 -0.7231 3215216 Ald1-H_001117 COC(=O)CCCCCCC(=O)N/N=C/CCCC1OCC(C)(C)CO1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K11 compound treatment 1803.0 168.68 0.1455 1852.0 285.37 0.2312 0.2663 0.9751 3215218 Ald1-H_001118 Cc1nnc(Sc2ccc(/C=N/NC(=O)CCCCC(=O)NO)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K12 compound treatment 1783.0 148.68 0.1282 1601.0 34.371 0.0278 0.1104 0.841 3215220 Ald1-H_001119 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(Sc2nnc(C)n2C)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K13 compound treatment 532.0 -1102.3 -0.9507 215.0 -1351.6 -1.095 -1.4465 -0.9975 3215222 Ald1-H_001120 ONC(=O)CCCCC(=O)N/N=C/c1cc(Br)cs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K14 compound treatment 1561.0 -73.317 -0.0632 1862.0 295.37 0.2393 0.1245 0.503 3215224 Ald1-H_001121 COC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)cs1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K15 mock treatment 1463.0 -171.32 -0.1478 1492.0 -74.629 -0.0605 -0.1472 -0.9222 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K16 mock treatment 1650.0 15.683 0.0135 1696.0 129.37 0.1048 0.0837 0.7918 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K17 compound treatment 2097.0 462.68 0.399 1783.0 216.37 0.1753 0.4061 0.9318 3215226 Ald1-H_001122 CC(C)(C)OC(=O)NC/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K18 compound treatment 992.0 -642.32 -0.554 1085.0 -481.63 -0.3902 -0.6676 -0.9853 3215228 Ald1-H_001123 COC(=O)CCCCCCC(=O)N/N=C/CNC(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K19 compound treatment 42.0 -1592.3 -1.3733 9.0 -1557.6 -1.2619 -1.8633 -0.9991 3215230 Ald1-H_001124 ONC(=O)CCCCC(=O)N/N=C/c1ccc-2c(Cc3ccccc32)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K20 compound treatment 1146.0 -488.32 -0.4212 1361.0 -205.63 -0.1666 -0.4156 -0.9176 3215232 Ald1-H_001125 COC(=O)CCCCCCC(=O)N/N=C/c1ccc-2c(Cc3ccccc32)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K21 compound treatment 448.0 -1186.3 -1.0231 556.0 -1010.6 -0.8187 -1.3024 -0.9939 3215234 Ald1-H_001126 ONC(=O)CCCCC(=O)N/N=C/c1ccc(F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K22 compound treatment 1340.0 -294.32 -0.2538 1185.0 -381.63 -0.3092 -0.3981 -0.9952 3215236 Ald1-H_001127 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K23 mock treatment 1281.0 -353.32 -0.3047 969.0 -597.63 -0.4841 -0.5578 -0.9751 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 K24 mock treatment 1246.0 -388.32 -0.3349 1214.0 -352.63 -0.2857 -0.4388 -0.9969 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L01 compound treatment 2058.0 423.68 0.3654 2287.0 720.37 0.5836 0.671 0.9746 3215238 Ald1-H_001128 COC(=O)CCCCCCC(=O)N/N=C/[C@@H](O)[C@H](O)[C@H](O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L02 compound treatment 1682.0 47.683 0.0411 1664.0 97.371 0.0789 0.0849 0.9539 3215240 Ald1-H_001129 OC[C@@H](O)[C@@H](O)[C@H](O)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L03 compound treatment 2012.0 377.68 0.3257 2172.0 605.37 0.4904 0.5771 0.9802 3215242 Ald1-H_001130 COC(=O)CCCCCCC(=O)N/N=C/C[C@H](O)[C@H](O)[C@@H](C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L04 compound treatment 1632.0 -2.3175 -0.002 1630.0 63.371 0.0513 0.0349 0.6791 3215244 Ald1-H_001131 C[C@@H](O)[C@@H](O)[C@@H](O)C/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L05 compound treatment 2402.0 767.68 0.6621 1961.0 394.37 0.3195 0.6941 0.9441 3215246 Ald1-H_001132 COC(=O)CCCCCCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L06 compound treatment 2007.0 372.68 0.3214 1737.0 170.37 0.138 0.3249 0.9287 3215248 Ald1-H_001133 OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L07 mock treatment 2179.0 544.68 0.4698 2279.0 712.37 0.5771 0.7402 0.9948 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L08 mock treatment 2213.0 578.68 0.4991 2199.0 632.37 0.5123 0.7152 0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L09 compound treatment 2345.0 710.68 0.6129 3314.0 1747.4 1.4156 1.4344 0.9299 3215250 Ald1-H_001134 COC(=O)CCCCCCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L10 compound treatment 1878.0 243.68 0.2102 611.0 -955.63 -0.7742 -0.3988 -0.4972 3215251 Ald1-H_001135 OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L11 compound treatment 1878.0 243.68 0.2102 2165.0 598.37 0.4847 0.4914 0.93 3215252 Ald1-H_001136 COC(=O)CCCCCCC(=O)N/N=C/[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L12 compound treatment 1997.0 362.68 0.3128 2181.0 614.37 0.4977 0.5731 0.9749 3215253 Ald1-H_001137 OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L13 compound treatment 2041.0 406.68 0.3507 2237.0 670.37 0.5431 0.632 0.9776 3215254 Ald1-H_001138 COC(=O)CCCCCCC(=O)N/N=C/[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L14 compound treatment 1515.0 -119.32 -0.1029 1238.0 -328.63 -0.2662 -0.261 -0.9145 3215256 Ald1-H_001139 C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L15 mock treatment 1707.0 72.683 0.0627 1695.0 128.37 0.104 0.1179 0.9706 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L16 mock treatment 1958.0 323.68 0.2792 1485.0 -81.629 -0.0661 0.1506 0.5251 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L17 compound treatment 1469.0 -165.32 -0.1426 1586.0 19.371 0.0157 -0.0897 -0.6255 3215258 Ald1-H_001140 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(Oc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L18 compound treatment 1097.0 -537.32 -0.4634 1445.0 -121.63 -0.0985 -0.3974 -0.8387 3215260 Ald1-H_001141 ONC(=O)CCCCC(=O)N/N=C/c1ccc(Oc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L19 compound treatment 1866.0 231.68 0.1998 1914.0 347.37 0.2814 0.3403 0.9859 3215262 Ald1-H_001142 COC(=O)CCCCCCC(=O)N/N=C/c1cc[n+]([O-])cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L20 compound treatment 1698.0 63.683 0.0549 1805.0 238.37 0.1931 0.1754 0.8736 3215264 Ald1-H_001143 ONC(=O)CCCCC(=O)N/N=C/c1cc[n+]([O-])cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L21 compound treatment 1289.0 -345.32 -0.2978 1267.0 -299.63 -0.2427 -0.3822 -0.9948 3215266 Ald1-H_001144 COC(=O)CCCCCCC(=O)N/N=C/c1ccc2ccccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L22 compound treatment 283.0 -1351.3 -1.1655 373.0 -1193.6 -0.967 -1.5079 -0.9957 3215268 Ald1-H_001145 ONC(=O)CCCCC(=O)N/N=C/c1ccc2ccccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L23 mock treatment 1251.0 -383.32 -0.3306 589.0 -977.63 -0.792 -0.7938 -0.9249 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 L24 mock treatment 877.0 -757.32 -0.6532 1137.0 -429.63 -0.348 -0.708 -0.9566 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M01 compound treatment 1915.0 280.68 0.2421 2037.0 470.37 0.3811 0.4406 0.976 3215270 Ald1-H_001146 ONC(=O)CCCCC(=O)N/N=C/c1ccc(O)c(F)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M02 compound treatment 1627.0 -7.3175 -0.0063 1251.0 -315.63 -0.2557 -0.1853 -0.7243 3215272 Ald1-H_001147 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c(F)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M03 compound treatment 1349.0 -285.32 -0.2461 993.0 -573.63 -0.4647 -0.5026 -0.9558 3215274 Ald1-H_001148 ONC(=O)CCCCC(=O)N/N=C/c1ccc(F)c(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M04 compound treatment 1677.0 42.683 0.0368 1303.0 -263.63 -0.2136 -0.125 -0.5767 3215276 Ald1-H_001149 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(F)c(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M05 compound treatment 1670.0 35.683 0.0308 1056.0 -510.63 -0.4137 -0.2707 -0.6527 3215278 Ald1-H_001150 ONC(=O)CCCCC(=O)N/N=C/c1cc(F)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M06 compound treatment 1420.0 -214.32 -0.1848 1516.0 -50.629 -0.041 -0.1597 -0.8435 3215280 Ald1-H_001151 COC(=O)CCCCCCC(=O)N/N=C/c1cc(F)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M07 compound treatment 2146.0 511.68 0.4413 1846.0 279.37 0.2263 0.4721 0.9519 3215282 Ald1-H_001152 ONC(=O)CCCCC(=O)N/N=C/c1coc2ccccc2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M08 compound treatment 1754.0 119.68 0.1032 1600.0 33.371 0.027 0.0921 0.8632 3215284 Ald1-H_001153 COC(=O)CCCCCCC(=O)N/N=C/c1coc2ccccc2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M09 mock treatment 1964.0 329.68 0.2843 2114.0 547.37 0.4434 0.5146 0.9769 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M10 mock treatment 1849.0 214.68 0.1852 1734.0 167.37 0.1356 0.2268 0.9883 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M11 compound treatment 491.0 -1143.3 -0.9861 550.0 -1016.6 -0.8236 -1.2796 -0.996 3215286 Ald1-H_001154 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M12 compound treatment 477.0 -1157.3 -0.9981 617.0 -949.63 -0.7693 -1.2498 -0.9917 3215288 Ald1-H_001155 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(NC(=O)OC(C)(C)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M13 mock treatment 1923.0 288.68 0.249 2426.0 859.37 0.6962 0.6683 0.9039 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M14 mock treatment 1496.0 -138.32 -0.1193 1500.0 -66.629 -0.054 -0.1225 -0.9357 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M15 compound treatment 1267.0 -367.32 -0.3168 1254.0 -312.63 -0.2533 -0.4031 -0.9938 3215290 Ald1-H_001156 ONC(=O)CCCCC(=O)N/N=C/c1cccc(c1)B(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M16 compound treatment 1375.0 -259.32 -0.2237 1704.0 137.37 0.1113 -0.0795 -0.3181 3215292 Ald1-H_001157 COC(=O)CCCCCCC(=O)N/N=C/c1cccc(c1)B(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M17 compound treatment 1279.0 -355.32 -0.3064 1576.0 9.371 0.0076 -0.2113 -0.6894 3215294 Ald1-H_001158 ONC(=O)CCCCC(=O)N/N=C/c1ccco1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M18 compound treatment 1097.0 -537.32 -0.4634 1547.0 -19.629 -0.0159 -0.3389 -0.7309 3215296 Ald1-H_001159 COC(=O)CCCCCCC(=O)N/N=C/c1ccco1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M19 compound treatment 1413.0 -221.32 -0.1909 1507.0 -59.629 -0.0483 -0.1691 -0.859 3215298 Ald1-H_001160 ONC(=O)CCCCC(=O)N/N=C/c1ccoc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M20 compound treatment 1278.0 -356.32 -0.3073 1340.0 -226.63 -0.1836 -0.3471 -0.9697 3215300 Ald1-H_001161 COC(=O)CCCCCCC(=O)N/N=C/c1ccoc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M21 compound treatment 770.0 -864.32 -0.7454 809.0 -757.63 -0.6138 -0.9611 -0.9953 3215302 Ald1-H_001162 ONC(=O)CCCCC(=O)N/N=C/c1cccc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M22 compound treatment 841.0 -793.32 -0.6842 2172.0 605.37 0.4904 -0.137 -0.1628 3215304 Ald1-H_001163 COC(=O)CCCCCCC(=O)N/N=C/c1cccc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M23 compound treatment 706.0 -928.32 -0.8006 889.0 -677.63 -0.549 -0.9543 -0.9831 3215306 Ald1-H_001164 ONC(=O)CCCCC(=O)N/N=C/c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 M24 compound treatment 388.0 -1246.3 -1.0749 1703.0 136.37 0.1105 -0.6819 -0.6311 3215308 Ald1-H_001165 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N01 compound treatment 1913.0 278.68 0.2404 2274.0 707.37 0.5731 0.5752 0.9256 3215310 Ald1-H_001166 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N02 compound treatment 71.0 -1563.3 -1.3483 87.0 -1479.6 -1.1987 -1.801 -0.9983 3215312 Ald1-H_001167 Cc1ccccc1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N03 compound treatment 2043.0 408.68 0.3525 2008.0 441.37 0.3576 0.5021 1.0 3215314 Ald1-H_001168 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N04 compound treatment 1379.0 -255.32 -0.2202 1677.0 110.37 0.0894 -0.0925 -0.3891 3215316 Ald1-H_001169 COc1cc(/C=N/NC(=O)CCCCC(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N05 compound treatment 2042.0 407.68 0.3516 2178.0 611.37 0.4953 0.5988 0.9859 3215318 Ald1-H_001170 COC(=O)CCCCCCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N06 compound treatment 1682.0 47.683 0.0411 1651.0 84.371 0.0684 0.0774 0.9704 3215320 Ald1-H_001171 ONC(=O)CCCCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N07 compound treatment 2293.0 658.68 0.5681 2218.0 651.37 0.5277 0.7748 0.9993 3215322 Ald1-H_001172 COC(=O)CCCCCCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@H](O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N08 compound treatment 1933.0 298.68 0.2576 2526.0 959.37 0.7772 0.7317 0.8937 3215323 Ald1-H_001173 OC[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N09 mock treatment 1671.0 36.683 0.0316 2439.0 872.37 0.7067 0.5221 0.738 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N10 mock treatment 1679.0 44.683 0.0385 2391.0 824.37 0.6678 0.4995 0.7467 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N11 compound treatment 2050.0 415.68 0.3585 1988.0 421.37 0.3414 0.4949 0.9997 3215324 Ald1-H_001174 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OC)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N12 compound treatment 2255.0 620.68 0.5353 1961.0 394.37 0.3195 0.6044 0.9696 3215326 Ald1-H_001175 COc1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N13 mock treatment 1925.0 290.68 0.2507 3323.0 1756.4 1.4229 1.1834 0.8191 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N14 mock treatment 2482.0 847.68 0.7311 2345.0 778.37 0.6306 0.9628 0.9973 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N15 compound treatment 1812.0 177.68 0.1532 1868.0 301.37 0.2441 0.281 0.9748 3215328 Ald1-H_001176 CCOc1cccc(/C=N/NC(=O)CCCCCCC(=O)OC)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N16 compound treatment 81.0 -1553.3 -1.3397 434.0 -1132.6 -0.9176 -1.5961 -0.983 3215330 Ald1-H_001177 CCOc1cccc(/C=N/NC(=O)CCCCC(=O)NO)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N17 compound treatment 1018.0 -616.32 -0.5315 1572.0 5.371 0.0044 -0.3728 -0.7013 3215332 Ald1-H_001178 COC(=O)CCCCCCC(=O)N/N=C/c1cc(I)cc(I)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N18 compound treatment 1775.0 140.68 0.1213 2189.0 622.37 0.5042 0.4423 0.8529 3215334 Ald1-H_001179 ONC(=O)CCCCC(=O)N/N=C/c1cc(I)cc(I)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N19 compound treatment 1260.0 -374.32 -0.3228 2375.0 808.37 0.6549 0.2348 0.3216 3215336 Ald1-H_001180 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N20 compound treatment 499.0 -1135.3 -0.9792 624.0 -942.63 -0.7636 -1.2323 -0.9924 3215338 Ald1-H_001181 CN(C)c1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N21 compound treatment 1411.0 -223.32 -0.1926 1640.0 73.371 0.0594 -0.0942 -0.4671 3215340 Ald1-H_001182 CCn1c2ccccc2c3cc(/C=N/NC(=O)CCCCCCC(=O)OC)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N22 compound treatment 65.0 -1569.3 -1.3535 82.0 -1484.6 -1.2027 -1.8075 -0.9983 3215342 Ald1-H_001183 CCn1c2ccccc2c3cc(/C=N/NC(=O)CCCCC(=O)NO)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N23 compound treatment 1402.0 -232.32 -0.2004 1559.0 -7.629 -0.0062 -0.146 -0.7286 3215344 Ald1-H_001184 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(c(F)c1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 N24 compound treatment 83.0 -1551.3 -1.3379 144.0 -1422.6 -1.1525 -1.761 -0.9972 3215346 Ald1-H_001185 ONC(=O)CCCCC(=O)N/N=C/c1ccc(c(F)c1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O01 compound treatment 1867.0 232.68 0.2007 2032.0 465.37 0.377 0.4085 0.9564 3215348 Ald1-H_001186 OCCOc1ccccc1/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O02 compound treatment 1693.0 58.683 0.0506 1572.0 5.371 0.0044 0.0389 0.7651 3215350 Ald1-H_001187 COC(=O)CCCCCCC(=O)N/N=C/c1ccccc1OCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O03 compound treatment 1929.0 294.68 0.2542 1746.0 179.37 0.1453 0.2825 0.9648 3215352 Ald1-H_001188 OCCOc1cccc(/C=N/NC(=O)CCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O04 compound treatment 1378.0 -256.32 -0.2211 1526.0 -40.629 -0.0329 -0.1796 -0.8035 3215354 Ald1-H_001189 COC(=O)CCCCCCC(=O)N/N=C/c1cccc(OCCO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O05 compound treatment 1983.0 348.68 0.3007 1737.0 170.37 0.138 0.3102 0.9376 3215356 Ald1-H_001190 OCCOc1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O06 compound treatment 1656.0 21.683 0.0187 1481.0 -85.629 -0.0694 -0.0358 -0.4987 3215358 Ald1-H_001191 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OCCO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O07 compound treatment 1771.0 136.68 0.1179 1632.0 65.371 0.053 0.1208 0.9348 3215360 Ald1-H_001192 COc1ccc(/C=N/NC(=O)CCCCC(=O)NO)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O08 compound treatment 1493.0 -141.32 -0.1219 1360.0 -206.63 -0.1674 -0.2045 -0.9878 3215362 Ald1-H_001193 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OC)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O09 compound treatment 1036.0 -598.32 -0.516 2096.0 529.37 0.4289 -0.0616 -0.0919 3215364 Ald1-H_001194 COc1ccc(O)c(/C=N/NC(=O)CCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O10 compound treatment 1268.0 -366.32 -0.3159 944.0 -622.63 -0.5044 -0.5801 -0.9746 3215366 Ald1-H_001195 COC(=O)CCCCCCC(=O)N/N=C/c1cc(OC)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O11 mock treatment 1421.0 -213.32 -0.184 1571.0 4.371 0.0035 -0.1276 -0.6934 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O12 mock treatment 1665.0 30.683 0.0265 1341.0 -225.63 -0.1828 -0.1105 -0.5985 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O13 compound treatment 1147.0 -487.32 -0.4203 1102.0 -464.63 -0.3764 -0.5633 -0.9985 3215368 Ald1-H_001196 COc1cc(/C=C/C=N/NC(=O)CCCCC(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O14 compound treatment 1058.0 -576.32 -0.4971 965.0 -601.63 -0.4874 -0.6961 -1.0 3215370 Ald1-H_001197 COC(=O)CCCCCCC(=O)N/N=C/C=C/c1ccc(O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O15 compound treatment 233.0 -1401.3 -1.2086 282.0 -1284.6 -1.0407 -1.5905 -0.9972 3215372 Ald1-H_001198 Cc1ccc(O)c(/C=N/NC(=O)CCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O16 compound treatment 1118.0 -516.32 -0.4453 948.0 -618.63 -0.5012 -0.6692 -0.9983 3215374 Ald1-H_001199 COC(=O)CCCCCCC(=O)N/N=C/c1cc(C)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O17 compound treatment 1318.0 -316.32 -0.2728 1382.0 -184.63 -0.1496 -0.2987 -0.96 3215376 Ald1-H_001200 OCc1ccc(/C=N/NC(=O)CCCCC(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O18 compound treatment 1437.0 -197.32 -0.1702 1720.0 153.37 0.1242 -0.0325 -0.1541 3215378 Ald1-H_001201 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(CO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O19 compound treatment 698.0 -936.32 -0.8075 1117.0 -449.63 -0.3643 -0.8286 -0.9353 3215380 Ald1-H_001202 ONC(=O)CCCCC(=O)N/N=C/c1ccc2ccccc2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O20 compound treatment 752.0 -882.32 -0.761 900.0 -666.63 -0.54 -0.92 -0.9859 3215382 Ald1-H_001203 COC(=O)CCCCCCC(=O)N/N=C/c1ccc2ccccc2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O21 compound treatment 74.0 -1560.3 -1.3457 97.0 -1469.6 -1.1906 -1.7934 -0.9981 3215384 Ald1-H_001204 ONC(=O)CCCCC(=O)N/N=C/c1ccc(o1)c2cccc(Cl)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O22 compound treatment 1174.0 -460.32 -0.397 1123.0 -443.63 -0.3594 -0.5349 -0.9988 3215386 Ald1-H_001205 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(o1)c2cccc(Cl)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O23 compound treatment 788.0 -846.32 -0.7299 1057.0 -509.63 -0.4129 -0.8081 -0.9636 3215388 Ald1-H_001206 ONC(=O)CCCCC(=O)N/N=C/c1cc(Br)c(O)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 O24 compound treatment 1004.0 -630.32 -0.5436 1107.0 -459.63 -0.3724 -0.6477 -0.983 3215390 Ald1-H_001207 COC(=O)CCCCCCC(=O)N/N=C/c1cc(Br)c(O)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P01 compound treatment 1645.0 10.683 0.0092 2328.0 761.37 0.6168 0.4427 0.7176 3215392 Ald1-H_001208 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(o1)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P02 compound treatment 1513.0 -121.32 -0.1046 1285.0 -281.63 -0.2282 -0.2353 -0.9375 3215394 Ald1-H_001209 ONC(=O)CCCCC(=O)N/N=C/c1ccc(o1)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P03 compound treatment 1916.0 281.68 0.2429 1946.0 379.37 0.3073 0.3891 0.9932 3215396 Ald1-H_001210 COC(=O)CCCCCCC(=O)N/N=C/c1cn(C)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P04 compound treatment 302.0 -1332.3 -1.1491 112.0 -1454.6 -1.1784 -1.6458 -0.9999 3215398 Ald1-H_001211 Cn1cc(/C=N/NC(=O)CCCCC(=O)NO)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P05 compound treatment 1897.0 262.68 0.2266 1378.0 -188.63 -0.1528 0.0521 0.1908 3215400 Ald1-H_001212 COC(=O)CCCCCCC(=O)N/N=C/c1cn(Cc2ccccc2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P06 compound treatment 41.0 -1593.3 -1.3742 27.0 -1539.6 -1.2473 -1.8536 -0.9988 3215402 Ald1-H_001213 ONC(=O)CCCCC(=O)N/N=C/c1cn(Cc2ccccc2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P07 compound treatment 3079.0 1444.7 1.246 1506.0 -60.629 -0.0491 0.8463 0.6787 3215404 Ald1-H_001214 COC(=O)CCCCCCC(=O)N/N=C/C1=CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P08 compound treatment 489.0 -1145.3 -0.9878 1093.0 -473.63 -0.3837 -0.9698 -0.9152 3215406 Ald1-H_001215 ONC(=O)CCCCC(=O)N/N=C/C1=CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P09 compound treatment 1348.0 -286.32 -0.2469 1659.0 92.371 0.0748 -0.1217 -0.4716 3215408 Ald1-H_001216 COC(=O)CCCCCCC(=O)N/N=C/[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P10 compound treatment 1429.0 -205.32 -0.1771 1156.0 -410.63 -0.3327 -0.3604 -0.9564 3215409 Ald1-H_001217 OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P11 mock treatment 1309.0 -325.32 -0.2806 1651.0 84.371 0.0684 -0.1501 -0.5197 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P12 mock treatment 1188.0 -446.32 -0.3849 1042.0 -524.63 -0.425 -0.5727 -0.9988 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P13 compound treatment 1160.0 -474.32 -0.4091 1819.0 252.37 0.2044 -0.1447 -0.3164 3215410 Ald1-H_001218 COC(=O)CCCCCCC(=O)N/N=C/[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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P14 compound treatment 1264.0 -370.32 -0.3194 1435.0 -131.63 -0.1066 -0.3012 -0.8946 3215412 Ald1-H_001219 OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P15 compound treatment 1108.0 -526.32 -0.4539 1123.0 -443.63 -0.3594 -0.5751 -0.9933 3215414 Ald1-H_001220 COC(=O)CCCCCCC(=O)N/N=C/[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P16 compound treatment 987.0 -647.32 -0.5583 1666.0 99.371 0.0805 -0.3378 -0.599 3215416 Ald1-H_001221 OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)CCCCC(=O)NO)[C@H](O)[C@@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P17 compound treatment 890.0 -744.32 -0.6419 1067.0 -499.63 -0.4048 -0.7401 -0.9753 3215418 Ald1-H_001222 COC(=O)CCCCCCC(=O)N/N=C(\C)/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P18 compound treatment 1102.0 -532.32 -0.4591 1319.0 -247.63 -0.2006 -0.4665 -0.9311 3215420 Ald1-H_001223 C/C(=N\NC(=O)CCCCC(=O)NO)/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P19 compound treatment 1174.0 -460.32 -0.397 1004.0 -562.63 -0.4558 -0.603 -0.9976 3215422 Ald1-H_001224 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(OCCCN(C)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P20 compound treatment 641.0 -993.32 -0.8567 630.0 -936.63 -0.7588 -1.1423 -0.9982 3215424 Ald1-H_001225 CN(C)CCCOc1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P21 compound treatment 653.0 -981.32 -0.8463 683.0 -883.63 -0.7158 -1.1046 -0.9965 3215426 Ald1-H_001226 CCOc1cc(/C=N/NC(=O)CCCCCCC(=O)OC)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P22 compound treatment 901.0 -733.32 -0.6325 981.0 -585.63 -0.4744 -0.7827 -0.99 3215428 Ald1-H_001227 CCOc1cc(/C=N/NC(=O)CCCCC(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P23 compound treatment 910.0 -724.32 -0.6247 1029.0 -537.63 -0.4355 -0.7497 -0.9845 3215430 Ald1-H_001228 COC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)N(C)CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2134 P24 compound treatment 821.0 -813.32 -0.7015 667.0 -899.63 -0.7288 -1.0113 -0.9998 3215432 Ald1-H_001229 CN(CCO)c1ccc(/C=N/NC(=O)CCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A01 compound treatment 1484.0 -821.98 -0.7089 1623.0 -522.1 -0.423 -0.8004 -0.9695 1006361 Ald2.1-H_000001 NNC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A02 compound treatment 4.0 -2302.0 -1.9854 32.0 -2113.1 -1.7118 -2.6143 -0.9973 3552205 Ald2.1-H_000002 Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccccc3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A03 compound treatment 1642.0 -663.98 -0.5727 38.0 -2107.1 -1.707 -1.612 -0.8953 3551925 Ald2.1-H_000003 Oc1ccccc1C(=O)N/N=C/c2ccccc2OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A04 compound treatment 30.0 -2276.0 -1.9629 2034.0 -111.1 -0.09 -1.4516 -0.7388 3552209 Ald2.1-H_000004 Oc1ccccc1C(=O)N/N=C/c2ccc(O)c3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A05 compound treatment 3083.0 777.02 0.6701 30.0 -2115.1 -1.7135 -0.7377 -0.401 1913714 Ald2.1-H_000005 COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A06 compound treatment 13.0 -2293.0 -1.9776 1302.0 -843.1 -0.683 -1.8813 -0.8992 3552211 Ald2.1-H_000006 Oc1ccccc1C(=O)N/N=C/c2ccc([N+](=O)[O-])c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A07 compound treatment 1144.0 -1162.0 -1.0022 1187.0 -958.1 -0.7762 -1.2575 -0.992 3551931 Ald2.1-H_000007 Oc1ccccc1C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A08 compound treatment 25.0 -2281.0 -1.9673 99.0 -2046.1 -1.6576 -2.5631 -0.9964 3552215 Ald2.1-H_000008 Oc1ccc([N+](=O)[O-])c(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A09 compound treatment 1830.0 -475.98 -0.4105 44.0 -2101.1 -1.7021 -1.4939 -0.8532 3551934 Ald2.1-H_000009 Oc1ccccc1C(=O)N/N=C/c2ccc3OCCOc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A10 compound treatment 2.0 -2304.0 -1.9871 1710.0 -435.1 -0.3525 -1.6543 -0.8197 3552219 Ald2.1-H_000010 Oc1ccccc1C(=O)N/N=C/c2ccc(cc2)n3ccnc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A11 compound treatment 1351.0 -954.98 -0.8236 1303.0 -842.1 -0.6822 -1.0648 -0.9956 3551938 Ald2.1-H_000011 Oc1ccccc1C(=O)N/N=C/COCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A12 compound treatment 267.0 -2039.0 -1.7585 1490.0 -655.1 -0.5307 -1.6187 -0.8812 3552223 Ald2.1-H_000012 Oc1ccccc1C(=O)N/N=C/c2c[nH]c3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A13 mock treatment 2260.0 -45.984 -0.0397 1574.0 -571.1 -0.4627 -0.3552 -0.7649 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A14 mock treatment 8.0 -2298.0 -1.9819 1516.0 -629.1 -0.5096 -1.7618 -0.8609 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A15 compound treatment 1068.0 -1238.0 -1.0677 1594.0 -551.1 -0.4464 -1.0707 -0.9252 3551942 Ald2.1-H_000013 Oc1ccccc1C(=O)N/N=C/c2ccc(cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A16 compound treatment 14.0 -2292.0 -1.9767 1032.0 -1113.1 -0.9017 -2.0354 -0.9368 1922439 Ald2.1-H_000014 Oc1ccccc1C(=O)N/N=C/c2ccc(I)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A17 compound treatment 7306.0 5000.0 4.3123 35.0 -2110.1 -1.7094 1.8405 0.3968 3551946 Ald2.1-H_000015 Oc1ccccc1C(=O)N/N=C/c2ccccc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A18 compound treatment 8.0 -2298.0 -1.9819 725.0 -1420.1 -1.1504 -2.2149 -0.9665 3552228 Ald2.1-H_000016 C/C=C(/C)\C=N\NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A19 compound treatment 935.0 -1371.0 -1.1824 4.0 -2141.1 -1.7345 -2.0626 -0.9826 3551950 Ald2.1-H_000017 Oc1ccccc1C(=O)N/N=C/c2cccc(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A20 compound treatment 13.0 -2293.0 -1.9776 415.0 -1730.1 -1.4016 -2.3894 -0.9858 3552232 Ald2.1-H_000018 Oc1ccccc1C(=O)N/N=C/c2ccc(s2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A21 compound treatment 1010.0 -1296.0 -1.1177 13.0 -2132.1 -1.7272 -2.0117 -0.9778 3551953 Ald2.1-H_000019 Oc1ccccc1C(=O)N/N=C/c2ccc(Br)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A22 compound treatment 59.0 -2247.0 -1.9379 0.0 -2145.1 -1.7378 -2.5991 -0.9985 1912639 Ald2.1-H_000020 Cc1ccc(/C=N/NC(=O)c2ccccc2O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A23 compound treatment 5.0 -2301.0 -1.9845 11.0 -2134.1 -1.7289 -2.6257 -0.9976 3551957 Ald2.1-H_000021 Oc1ccccc1C(=O)N/N=C/C(=C/c2ccccc2)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 A24 compound treatment 9.0 -2297.0 -1.9811 63.0 -2082.1 -1.6867 -2.5935 -0.9968 3552237 Ald2.1-H_000022 Cc1[nH]cnc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B01 compound treatment 2746.0 440.02 0.3795 2878.0 732.9 0.5937 0.6882 0.9766 1047348 Ald2.1-H_000023 NNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B02 compound treatment 1170.0 -1136.0 -0.9797 1671.0 -474.1 -0.3841 -0.9644 -0.9164 3552713 Ald2.1-H_000024 Oc1ccc2ccccc2c1/C=N/NC(=O)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B03 compound treatment 1369.0 -936.98 -0.8081 2941.0 795.9 0.6448 -0.1155 -0.1117 3552424 Ald2.1-H_000025 C=CCOc1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B04 compound treatment 2400.0 94.016 0.0811 2733.0 587.9 0.4763 0.3941 0.8158 3552716 Ald2.1-H_000026 Oc1ccc(/C=N/NC(=O)c2ccccn2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B05 compound treatment 2409.0 103.02 0.0888 2614.0 468.9 0.3799 0.3314 0.8496 3552426 Ald2.1-H_000027 COc1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B06 compound treatment 2212.0 -93.984 -0.0811 2392.0 246.9 0.2 0.0841 0.3898 3552720 Ald2.1-H_000028 Oc1cc(/C=N/NC(=O)c2ccccn2)ccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B07 compound treatment 2574.0 268.02 0.2312 2638.0 492.9 0.3993 0.4458 0.9662 3552428 Ald2.1-H_000029 O=C(N/N=C/c1ccccc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B08 compound treatment 2262.0 -43.984 -0.0379 1831.0 -314.1 -0.2545 -0.2067 -0.8036 1936929 Ald2.1-H_000030 Oc1ccc([N+](=O)[O-])c(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B09 compound treatment 2649.0 343.02 0.2958 2179.0 33.905 0.0275 0.2286 0.7694 3552430 Ald2.1-H_000031 O=C(N/N=C/c1ccc2OCCOc2c1)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B10 compound treatment 2238.0 -67.984 -0.0586 1673.0 -472.1 -0.3825 -0.3119 -0.8061 3552725 Ald2.1-H_000032 O=C(N/N=C/c1ccc(cc1)n2ccnc2)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B11 compound treatment 2314.0 8.0161 0.0069 2207.0 61.905 0.0501 0.0403 0.797 3552432 Ald2.1-H_000033 O=C(N/N=C/COCc1ccccc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B12 compound treatment 1316.0 -989.98 -0.8538 1672.0 -473.1 -0.3833 -0.8747 -0.9347 3552730 Ald2.1-H_000034 O=C(N/N=C/c1c[nH]c2ccccc12)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B13 mock treatment 2368.0 62.016 0.0535 2533.0 387.9 0.3142 0.26 0.8157 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B14 mock treatment 1908.0 -397.98 -0.3432 1943.0 -202.1 -0.1637 -0.3585 -0.9426 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B15 compound treatment 2284.0 -21.984 -0.019 1861.0 -284.1 -0.2301 -0.1761 -0.7628 3552436 Ald2.1-H_000035 O=C(N/N=C/c1ccc(cc1)c2ccccc2)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B16 compound treatment 2119.0 -186.98 -0.1613 1915.0 -230.1 -0.1864 -0.2458 -0.9974 3552734 Ald2.1-H_000036 Ic1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B17 compound treatment 2124.0 -181.98 -0.157 1925.0 -220.1 -0.1783 -0.2371 -0.998 3552440 Ald2.1-H_000037 Brc1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B18 compound treatment 1683.0 -622.98 -0.5373 1413.0 -732.1 -0.5931 -0.7993 -0.9988 3552737 Ald2.1-H_000038 C/C=C(/C)\C=N\NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B19 compound treatment 2166.0 -139.98 -0.1207 1589.0 -556.1 -0.4505 -0.4039 -0.866 3552445 Ald2.1-H_000039 Brc1cccc(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B20 compound treatment 1741.0 -564.98 -0.4873 1390.0 -755.1 -0.6117 -0.7771 -0.9937 3552741 Ald2.1-H_000040 [O-][N+](=O)c1ccc(/C=N/NC(=O)c2ccccn2)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B21 compound treatment 2544.0 238.02 0.2053 1684.0 -461.1 -0.3735 -0.119 -0.2791 3552449 Ald2.1-H_000041 Brc1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B22 compound treatment 2000.0 -305.98 -0.2639 1572.0 -573.1 -0.4643 -0.5149 -0.9642 3552745 Ald2.1-H_000042 Cc1ccc(/C=N/NC(=O)c2ccccn2)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B23 compound treatment 34.0 -2272.0 -1.9595 43.0 -2102.1 -1.7029 -2.5897 -0.9976 3552453 Ald2.1-H_000043 Br/C(=C\c1ccccc1)/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 B24 compound treatment 1188.0 -1118.0 -0.9642 465.0 -1680.1 -1.3611 -1.6442 -0.9857 3552749 Ald2.1-H_000044 Cc1[nH]cnc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C01 compound treatment 1908.0 -397.98 -0.3432 2089.0 -56.095 -0.0454 -0.2748 -0.7938 3551960 Ald2.1-H_000045 Oc1ccccc1C(=O)N/N=C/c2ccc(Br)o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C02 compound treatment 1528.0 -777.98 -0.671 2214.0 68.905 0.0558 -0.435 -0.646 3552241 Ald2.1-H_000046 Cc1ccsc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C03 compound treatment 1731.0 -574.98 -0.4959 2266.0 120.9 0.0979 -0.2814 -0.5567 3551964 Ald2.1-H_000047 Oc1ccc(/C=N/NC(=O)c2ccccc2O)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C04 compound treatment 2259.0 -46.984 -0.0405 2186.0 40.905 0.0331 -0.0052 -0.0997 3552245 Ald2.1-H_000048 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)c3ccccc3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C05 compound treatment 1800.0 -505.98 -0.4364 2001.0 -144.1 -0.1167 -0.3911 -0.8658 3551968 Ald2.1-H_000049 Oc1ccc(Br)c(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C06 compound treatment 2790.0 484.02 0.4174 2055.0 -90.095 -0.073 0.2436 0.5748 3552249 Ald2.1-H_000050 Oc1ccccc1C(=O)N/N=C/c2cccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C07 compound treatment 621.0 -1685.0 -1.4532 323.0 -1822.1 -1.4761 -2.0714 -1.0 3551973 Ald2.1-H_000051 COc1cc(Br)cc(/C=N/NC(=O)c2ccccc2O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C08 compound treatment 2420.0 114.02 0.0983 2084.0 -61.095 -0.0495 0.0345 0.3137 3552253 Ald2.1-H_000052 Oc1ccccc1C(=O)N/N=C/c2ccc3ccccc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C09 compound treatment 2803.0 497.02 0.4287 2291.0 145.9 0.1182 0.3867 0.8696 3551976 Ald2.1-H_000053 COc1ccc(Br)c(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C10 compound treatment 846.0 -1460.0 -1.2592 673.0 -1472.1 -1.1926 -1.7336 -0.9996 1918554 Ald2.1-H_000054 Oc1ccccc1C(=O)N/N=C/c2ccccc2[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C11 mock treatment 3520.0 1214.0 1.047 2700.0 554.9 0.4495 1.0582 0.9287 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C12 mock treatment 2905.0 599.02 0.5166 2872.0 726.9 0.5889 0.7817 0.9979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C13 compound treatment 3122.0 816.02 0.7038 2214.0 68.905 0.0558 0.5371 0.7608 3551980 Ald2.1-H_000055 COc1ccc(Br)cc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C14 compound treatment 1347.0 -958.98 -0.8271 912.0 -1233.1 -0.9989 -1.2912 -0.9956 1919338 Ald2.1-H_000056 COc1cc(/C=N/NC(=O)c2ccccc2O)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C15 mock treatment 2878.0 572.02 0.4933 1266.0 -879.1 -0.7122 -0.1547 -0.1786 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C16 mock treatment 2353.0 47.016 0.0405 2085.0 -60.095 -0.0487 -0.0058 -0.0908 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C17 compound treatment 3100.0 794.02 0.6848 1717.0 -428.1 -0.3468 0.239 0.3114 1922614 Ald2.1-H_000057 Oc1ccccc1C(=O)N/N=C/c2cc3OCOc3cc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C18 compound treatment 1658.0 -647.98 -0.5589 1090.0 -1055.1 -0.8547 -0.9996 -0.9788 3552261 Ald2.1-H_000058 Oc1ccccc1C(=O)N/N=C/c2c(F)c(F)c(F)c(F)c2F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C19 compound treatment 1981.0 -324.98 -0.2803 1104.0 -1041.1 -0.8434 -0.7946 -0.894 3551985 Ald2.1-H_000059 Oc1ccccc1C(=O)N/N=C/c2cccnc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C20 compound treatment 1779.0 -526.98 -0.4545 1362.0 -783.1 -0.6344 -0.77 -0.9866 3552264 Ald2.1-H_000060 Oc1ccccc1C(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C21 compound treatment 2678.0 372.02 0.3208 1455.0 -690.1 -0.5591 -0.1684 -0.2613 3551989 Ald2.1-H_000061 Oc1ccccc1C(=O)N/N=C/c2ccncc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C22 compound treatment 2254.0 -51.984 -0.0448 858.0 -1287.1 -1.0427 -0.769 -0.7368 3552269 Ald2.1-H_000062 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C23 compound treatment 1492.0 -813.98 -0.702 608.0 -1537.1 -1.2452 -1.3769 -0.9632 3551993 Ald2.1-H_000063 Oc1ccc(Br)cc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 C24 compound treatment 1654.0 -651.98 -0.5623 862.0 -1283.1 -1.0395 -1.1326 -0.9584 3552272 Ald2.1-H_000064 Oc1ccccc1C(=O)N/N=C/c2cccc(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D01 compound treatment 1876.0 -429.98 -0.3708 2759.0 613.9 0.4973 0.0894 0.1442 3552455 Ald2.1-H_000065 Brc1ccc(/C=N/NC(=O)c2ccccn2)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D02 compound treatment 2162.0 -143.98 -0.1242 2657.0 511.9 0.4147 0.2054 0.4745 3552753 Ald2.1-H_000066 Cc1ccsc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D03 compound treatment 1448.0 -857.98 -0.74 2108.0 -37.095 -0.0301 -0.5445 -0.7352 3552459 Ald2.1-H_000067 Oc1ccc(/C=N/NC(=O)c2ccccn2)c(Br)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D04 compound treatment 1889.0 -416.98 -0.3596 2296.0 150.9 0.1223 -0.1679 -0.4419 3552755 Ald2.1-H_000068 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D05 compound treatment 1719.0 -586.98 -0.5062 2462.0 316.9 0.2567 -0.1764 -0.3108 3552463 Ald2.1-H_000069 Oc1ccc(Br)c(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D06 compound treatment 2233.0 -72.984 -0.0629 2493.0 347.9 0.2818 0.1548 0.536 3552757 Ald2.1-H_000070 O=C(N/N=C/c1cccc2ccccc12)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D07 compound treatment 1354.0 -951.98 -0.821 1266.0 -879.1 -0.7122 -1.0841 -0.9975 3552467 Ald2.1-H_000071 COc1cc(Br)cc(/C=N/NC(=O)c2ccccn2)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D08 compound treatment 1987.0 -318.98 -0.2751 1799.0 -346.1 -0.2804 -0.3928 -1.0 3552759 Ald2.1-H_000072 O=C(N/N=C/c1ccc2ccccc2c1)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D09 compound treatment 2525.0 219.02 0.1889 2091.0 -54.095 -0.0438 0.1026 0.529 3552471 Ald2.1-H_000073 COc1ccc(Br)c(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D10 compound treatment 2432.0 126.02 0.1087 2438.0 292.9 0.2373 0.2446 0.9373 3552761 Ald2.1-H_000074 [O-][N+](=O)c1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D11 mock treatment 2423.0 117.02 0.1009 2321.0 175.9 0.1425 0.1721 0.9857 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D12 mock treatment 2247.0 -58.984 -0.0509 2186.0 40.905 0.0331 -0.0125 -0.2065 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D13 compound treatment 1952.0 -353.98 -0.3053 1922.0 -223.1 -0.1807 -0.3437 -0.9687 3552475 Ald2.1-H_000075 COc1ccc(Br)cc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D14 compound treatment 2488.0 182.02 0.157 2129.0 -16.095 -0.013 0.1018 0.6461 3552763 Ald2.1-H_000076 COc1cc(/C=N/NC(=O)c2ccccn2)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D15 mock treatment 2756.0 450.02 0.3881 2427.0 281.9 0.2284 0.4359 0.968 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D16 mock treatment 2297.0 -8.9839 -0.0077 2221.0 75.905 0.0615 0.038 0.6132 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D17 compound treatment 2005.0 -300.98 -0.2596 2276.0 130.9 0.106 -0.1086 -0.3872 3552479 Ald2.1-H_000077 Brc1cc2OCOc2cc1/C=N/NC(=O)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D18 compound treatment 1651.0 -654.98 -0.5649 1804.0 -341.1 -0.2763 -0.5948 -0.9459 3552765 Ald2.1-H_000078 Fc1c(F)c(F)c(/C=N/NC(=O)c2ccccn2)c(F)c1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D19 compound treatment 2395.0 89.016 0.0768 1719.0 -426.1 -0.3452 -0.1898 -0.5367 3552483 Ald2.1-H_000079 Brc1ncccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D20 compound treatment 1904.0 -401.98 -0.3467 1590.0 -555.1 -0.4497 -0.5631 -0.9917 3552767 Ald2.1-H_000080 C=CCC/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D21 compound treatment 2554.0 248.02 0.2139 1555.0 -590.1 -0.478 -0.1868 -0.3566 3552486 Ald2.1-H_000081 Brc1cnccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D22 compound treatment 1450.0 -855.98 -0.7383 1290.0 -855.1 -0.6927 -1.0119 -0.9995 3552769 Ald2.1-H_000082 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D23 compound treatment 2170.0 -135.98 -0.1173 1471.0 -674.1 -0.5461 -0.4691 -0.8398 3552490 Ald2.1-H_000083 Oc1ccc(Br)cc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 D24 compound treatment 1825.0 -480.98 -0.4148 815.0 -1330.1 -1.0775 -1.0553 -0.9139 3552771 Ald2.1-H_000084 O=C(N/N=C/c1cccc(Oc2ccccc2)c1)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E01 mock treatment 3027.0 721.02 0.6218 4096.0 1950.9 1.5805 1.5573 0.9169 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E02 mock treatment 1572.0 -733.98 -0.633 1937.0 -208.1 -0.1686 -0.5668 -0.8653 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E03 compound treatment 839.0 -1467.0 -1.2652 640.0 -1505.1 -1.2193 -1.7568 -0.9998 3551996 Ald2.1-H_000085 Oc1ccccc1C(=O)N/N=C/c2ccc(Br)s2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E04 compound treatment 1006.0 -1300.0 -1.1212 534.0 -1611.1 -1.3052 -1.7157 -0.9971 3552276 Ald2.1-H_000086 Oc1ccccc1C(=O)N/N=C/c2cn(c3ccccc23)S(=O)(=O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E05 compound treatment 1598.0 -707.98 -0.6106 2682.0 536.9 0.435 -0.1242 -0.1657 3552001 Ald2.1-H_000087 COc1cc(/C=N/NC(=O)c2ccccc2O)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E06 compound treatment 489.0 -1817.0 -1.5671 134.0 -2011.1 -1.6292 -2.2601 -0.9998 3552280 Ald2.1-H_000088 Oc1ccccc1C(=O)N/N=C/c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E07 compound treatment 535.0 -1771.0 -1.5274 308.0 -1837.1 -1.4883 -2.1324 -0.9999 3552005 Ald2.1-H_000089 Oc1ccccc1C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E08 compound treatment 2189.0 -116.98 -0.1009 1260.0 -885.1 -0.717 -0.5784 -0.7987 1912699 Ald2.1-H_000090 Oc1ccccc1C(=O)N/N=C/c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E09 mock treatment 2341.0 35.016 0.0302 3514.0 1368.9 1.109 0.8055 0.7261 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E10 mock treatment 1973.0 -332.98 -0.2872 2044.0 -101.1 -0.0819 -0.261 -0.8739 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E11 compound treatment 2357.0 51.016 0.044 1634.0 -511.1 -0.414 -0.2617 -0.6284 3552009 Ald2.1-H_000091 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E12 compound treatment 1879.0 -426.98 -0.3683 1712.0 -433.1 -0.3509 -0.5085 -0.9997 3552285 Ald2.1-H_000092 Cc1ncc(CO)c(/C=N/NC(=O)c2ccccc2O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E13 compound treatment 2464.0 158.02 0.1363 2808.0 662.9 0.537 0.4761 0.8593 3552013 Ald2.1-H_000093 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E14 compound treatment 1585.0 -720.98 -0.6218 1064.0 -1081.1 -0.8758 -1.059 -0.9859 1917465 Ald2.1-H_000094 Oc1ccccc1C(=O)N/N=C/c2ccc[nH]2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E15 compound treatment 2077.0 -228.98 -0.1975 1019.0 -1126.1 -0.9123 -0.7847 -0.8407 3552017 Ald2.1-H_000095 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E16 compound treatment 2572.0 266.02 0.2294 1520.0 -625.1 -0.5064 -0.1958 -0.3523 3552291 Ald2.1-H_000096 Oc1ccccc1C(=O)N/N=C/c2ccc(cc2)N3CCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E17 mock treatment 2900.0 594.02 0.5123 2398.0 252.9 0.2049 0.5071 0.9191 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E18 mock treatment 2097.0 -208.98 -0.1802 1172.0 -973.1 -0.7883 -0.6849 -0.8469 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E19 compound treatment 1184.0 -1122.0 -0.9677 897.0 -1248.1 -1.0111 -1.3992 -0.9998 3552021 Ald2.1-H_000097 OC(=O)c1cccc(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E20 compound treatment 37.0 -2269.0 -1.9569 22.0 -2123.1 -1.7199 -2.5999 -0.9979 2119509 Ald2.1-H_000098 Oc1ccccc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E21 compound treatment 2086.0 -219.98 -0.1897 705.0 -1440.1 -1.1666 -0.9591 -0.8114 3552026 Ald2.1-H_000099 OC(=O)c1ccccc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E22 compound treatment 1285.0 -1021.0 -0.8806 856.0 -1289.1 -1.0443 -1.3611 -0.9964 3552296 Ald2.1-H_000100 CCCCCCC/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E23 compound treatment 1067.0 -1239.0 -1.0686 1210.0 -935.1 -0.7575 -1.2913 -0.9858 3552029 Ald2.1-H_000101 OC(=O)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 E24 compound treatment 350.0 -1956.0 -1.687 587.0 -1558.1 -1.2622 -2.0854 -0.9898 3552300 Ald2.1-H_000102 Oc1ccccc1C(=O)N/N=C/c2nccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F01 mock treatment 2533.0 227.02 0.1958 2106.0 -39.095 -0.0317 0.1161 0.5851 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F02 mock treatment 1698.0 -607.98 -0.5244 2358.0 212.9 0.1725 -0.2488 -0.4508 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F03 compound treatment 2603.0 297.02 0.2562 3402.0 1256.9 1.0182 0.9011 0.8583 3552494 Ald2.1-H_000103 Brc1ccc(/C=N/NC(=O)c2ccccn2)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F04 compound treatment 1405.0 -900.98 -0.7771 648.0 -1497.1 -1.2128 -1.4071 -0.9769 3552773 Ald2.1-H_000104 O=C(N/N=C/c1cn(c2ccccc12)S(=O)(=O)c3ccccc3)c4ccccn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F05 compound treatment 2536.0 230.02 0.1984 2434.0 288.9 0.234 0.3058 0.9966 3552498 Ald2.1-H_000105 COc1cc(/C=N/NC(=O)c2ccccn2)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F06 compound treatment 2475.0 169.02 0.1458 2508.0 362.9 0.294 0.311 0.9476 3552775 Ald2.1-H_000106 O=C(N/N=C/c1ccccn1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F07 compound treatment 386.0 -1920.0 -1.6559 462.0 -1683.1 -1.3635 -2.135 -0.9953 3552502 Ald2.1-H_000107 Oc1cc(OCc2ccccc2)ccc1/C=N/NC(=O)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F08 compound treatment 1898.0 -407.98 -0.3519 2513.0 367.9 0.298 -0.0381 -0.0825 3552777 Ald2.1-H_000108 O=C(N/N=C/c1cccnc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F09 mock treatment 2596.0 290.02 0.2501 2783.0 637.9 0.5168 0.5423 0.9445 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F10 mock treatment 1950.0 -355.98 -0.307 2373.0 227.9 0.1846 -0.0865 -0.2416 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F11 compound treatment 2041.0 -264.98 -0.2285 2356.0 210.9 0.1709 -0.0408 -0.1429 3552506 Ald2.1-H_000109 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F12 compound treatment 2388.0 82.016 0.0707 2156.0 10.905 0.0088 0.0563 0.7893 3552779 Ald2.1-H_000110 Cc1ncc(CO)c(/C=N/NC(=O)c2ccccn2)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F13 compound treatment 2944.0 638.02 0.5503 2632.0 486.9 0.3944 0.668 0.9867 3552509 Ald2.1-H_000111 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F14 compound treatment 203.0 -2103.0 -1.8137 238.0 -1907.1 -1.545 -2.375 -0.9968 1936582 Ald2.1-H_000112 O=C(N/N=C/c1ccc[nH]1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F15 compound treatment 2547.0 241.02 0.2079 2880.0 734.9 0.5954 0.568 0.9007 3552513 Ald2.1-H_000113 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F16 compound treatment 1530.0 -775.98 -0.6693 2381.0 235.9 0.1911 -0.3381 -0.4858 3552781 Ald2.1-H_000114 O=C(N/N=C/c1ccc(cc1)N2CCCC2)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F17 mock treatment 1752.0 -553.98 -0.4778 2538.0 392.9 0.3183 -0.1128 -0.1964 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F18 mock treatment 1449.0 -856.98 -0.7391 2556.0 410.9 0.3329 -0.2873 -0.3544 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F19 compound treatment 2107.0 -198.98 -0.1716 1901.0 -244.1 -0.1977 -0.2612 -0.9975 3552517 Ald2.1-H_000115 OC(=O)c1cccc(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F20 compound treatment 590.0 -1716.0 -1.48 10.0 -2135.1 -1.7297 -2.2696 -0.997 3552783 Ald2.1-H_000116 Oc1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F21 compound treatment 1390.0 -915.98 -0.79 1504.0 -641.1 -0.5194 -0.9259 -0.9793 3552521 Ald2.1-H_000117 OC(=O)c1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F22 compound treatment 1213.0 -1093.0 -0.9427 1265.0 -880.1 -0.713 -1.1707 -0.9905 3552785 Ald2.1-H_000118 CCCCCCC/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F23 compound treatment 1894.0 -411.98 -0.3553 1040.0 -1105.1 -0.8953 -0.8843 -0.9181 3552525 Ald2.1-H_000119 OC(=O)c1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 F24 compound treatment 259.0 -2047.0 -1.7654 0.0 -2145.1 -1.7378 -2.4771 -1.0 3552787 Ald2.1-H_000120 O=C(N/N=C/c1nccs1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G01 compound treatment 404.0 -1902.0 -1.6404 403.0 -1742.1 -1.4113 -2.1579 -0.9972 3552033 Ald2.1-H_000121 Oc1ccccc1C(=O)N/N=C/c2ccccc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G02 compound treatment 85.0 -2221.0 -1.9155 774.0 -1371.1 -1.1107 -2.1399 -0.9664 1918398 Ald2.1-H_000122 Oc1ccccc1C(=O)N/N=C/c2cccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G03 mock treatment 1227.0 -1079.0 -0.9306 1326.0 -819.1 -0.6636 -1.1272 -0.9863 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G04 mock treatment 1355.0 -950.98 -0.8202 976.0 -1169.1 -0.9471 -1.2497 -0.9974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G05 compound treatment 643.0 -1663.0 -1.4343 544.0 -1601.1 -1.2971 -1.9313 -0.9987 3552037 Ald2.1-H_000123 Oc1ccccc1C(=O)N/N=C/c2cccnc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G06 compound treatment 453.0 -1853.0 -1.5981 85.0 -2060.1 -1.6689 -2.3101 -0.9998 3552305 Ald2.1-H_000124 Oc1ccccc1C(=O)N/N=C/c2ccc(cc2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G07 compound treatment 57.0 -2249.0 -1.9397 116.0 -2029.1 -1.6438 -2.5339 -0.9966 3552041 Ald2.1-H_000125 Oc1ccccc1C(=O)N/N=C/C=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G08 compound treatment 201.0 -2105.0 -1.8155 9.0 -2136.1 -1.7305 -2.5074 -0.9997 3552309 Ald2.1-H_000126 Oc1ccc(/C=N/NC(=O)c2ccccc2O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G09 compound treatment 171.0 -2135.0 -1.8413 111.0 -2034.1 -1.6478 -2.4672 -0.9985 3552044 Ald2.1-H_000127 C[C@H](CCC=C(C)C)C/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G10 compound treatment 197.0 -2109.0 -1.8189 45.0 -2100.1 -1.7013 -2.4892 -0.9994 3552313 Ald2.1-H_000128 Oc1cc(O)c(/C=N/NC(=O)c2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G11 compound treatment 487.0 -1819.0 -1.5688 206.0 -1939.1 -1.5709 -2.2201 -1.0 3552048 Ald2.1-H_000129 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G12 compound treatment 397.0 -1909.0 -1.6464 246.0 -1899.1 -1.5385 -2.2521 -0.9994 3552317 Ald2.1-H_000130 COc1cc(OC)c(/C=N/NC(=O)c2ccccc2O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G13 compound treatment 708.0 -1598.0 -1.3782 980.0 -1165.1 -0.9439 -1.6419 -0.983 3552051 Ald2.1-H_000131 Oc1ccccc1C(=O)N/N=C/c2ccc(C#N)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G14 compound treatment 500.0 -1806.0 -1.5576 53.0 -2092.1 -1.6948 -2.2998 -0.9991 3552321 Ald2.1-H_000132 COc1cc(/C=N/NC(=O)c2ccccc2O)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G15 compound treatment 579.0 -1727.0 -1.4895 322.0 -1823.1 -1.4769 -2.0975 -1.0 3552054 Ald2.1-H_000133 Oc1ccccc1C(=O)N/N=C/C2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G16 compound treatment 666.0 -1640.0 -1.4144 300.0 -1845.1 -1.4947 -2.0571 -0.9996 3552325 Ald2.1-H_000134 CC(C)(C)/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G17 compound treatment 497.0 -1809.0 -1.5602 138.0 -2007.1 -1.626 -2.2529 -0.9998 3552058 Ald2.1-H_000135 COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G18 compound treatment 296.0 -2010.0 -1.7335 141.0 -2004.1 -1.6235 -2.3738 -0.9995 3552329 Ald2.1-H_000136 CC1=C(C/C=N/NC(=O)c2ccccc2O)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G19 mock treatment 1033.0 -1273.0 -1.0979 754.0 -1391.1 -1.1269 -1.5732 -0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G20 mock treatment 1123.0 -1183.0 -1.0203 594.0 -1551.1 -1.2566 -1.61 -0.9947 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G21 compound treatment 15.0 -2291.0 -1.9759 14.0 -2131.1 -1.7264 -2.6179 -0.9977 3552062 Ald2.1-H_000137 Oc1ccccc1C(=O)N/N=C/c2cc(Br)cc(Br)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G22 compound treatment 261.0 -2045.0 -1.7637 30.0 -2115.1 -1.7135 -2.4587 -0.9999 3552333 Ald2.1-H_000138 NC(=O)COc1ccccc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G23 compound treatment 7.0 -2299.0 -1.9828 2.0 -2143.1 -1.7362 -2.6297 -0.9978 3552065 Ald2.1-H_000139 CCCCN(CCCC)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 G24 compound treatment 379.0 -1927.0 -1.6619 218.0 -1927.1 -1.5612 -2.2791 -0.9995 3552337 Ald2.1-H_000140 NC(=O)COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H01 compound treatment 488.0 -1818.0 -1.5679 3019.0 873.9 0.708 -0.6081 -0.3535 1936274 Ald2.1-H_000141 Clc1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H02 compound treatment 1540.0 -765.98 -0.6606 2442.0 296.9 0.2405 -0.2971 -0.4225 3552789 Ald2.1-H_000142 O=C(N/N=C/c1cccs1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H03 mock treatment 2292.0 -13.984 -0.0121 3420.0 1274.9 1.0328 0.7218 0.6988 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H04 mock treatment 1872.0 -433.98 -0.3743 2807.0 661.9 0.5362 0.1145 0.1751 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H05 compound treatment 2045.0 -260.98 -0.2251 3239.0 1093.9 0.8862 0.4675 0.5113 3552530 Ald2.1-H_000143 Clc1ncccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H06 compound treatment 2418.0 112.02 0.0966 2233.0 87.905 0.0712 0.1187 0.9887 3552791 Ald2.1-H_000144 FC(F)(F)c1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H07 compound treatment 2207.0 -98.984 -0.0854 2491.0 345.9 0.2802 0.1378 0.4703 3552534 Ald2.1-H_000145 O=C(N/N=C/C=C/c1ccccc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H08 compound treatment 1411.0 -894.98 -0.7719 1375.0 -770.1 -0.6239 -0.9869 -0.9944 3552793 Ald2.1-H_000146 Oc1ccc(/C=N/NC(=O)c2ccccn2)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H09 compound treatment 1791.0 -514.98 -0.4442 2132.0 -13.095 -0.0106 -0.3216 -0.7238 3552538 Ald2.1-H_000147 C[C@H](CCC=C(C)C)C/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H10 compound treatment 2197.0 -108.98 -0.094 1852.0 -293.1 -0.2374 -0.2344 -0.9177 3552795 Ald2.1-H_000148 Oc1cc(O)c(/C=N/NC(=O)c2ccccn2)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H11 compound treatment 1184.0 -1122.0 -0.9677 2410.0 264.9 0.2146 -0.5325 -0.5372 3552543 Ald2.1-H_000149 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H12 compound treatment 2172.0 -133.98 -0.1156 2251.0 105.9 0.0858 -0.021 -0.1462 3552797 Ald2.1-H_000150 COc1cc(OC)c(/C=N/NC(=O)c2ccccn2)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H13 compound treatment 3313.0 1007.0 0.8685 2913.0 767.9 0.6221 1.054 0.9866 3552545 Ald2.1-H_000151 O=C(N/N=C/c1ccc(C#N)cc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H14 compound treatment 2143.0 -162.98 -0.1406 2533.0 387.9 0.3142 0.1228 0.3567 3552839 Ald2.1-H_000152 COc1cc(/C=N/NC(=O)c2ccccn2)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H15 compound treatment 3178.0 872.02 0.7521 2554.0 408.9 0.3313 0.766 0.9321 3552548 Ald2.1-H_000153 O=C(N/N=C/C1CCCCC1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H16 compound treatment 1893.0 -412.98 -0.3562 2039.0 -106.1 -0.0859 -0.3126 -0.8532 3552842 Ald2.1-H_000154 CC(C)(C)/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H17 compound treatment 1591.0 -714.98 -0.6166 1784.0 -361.1 -0.2925 -0.6429 -0.9419 3552552 Ald2.1-H_000155 COc1ccc(/C=N/NC(=O)c2ccccn2)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H18 compound treatment 737.0 -1569.0 -1.3532 1152.0 -993.1 -0.8045 -1.5257 -0.9692 3552846 Ald2.1-H_000156 CC1=C(C/C=N/NC(=O)c2ccccn2)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H19 mock treatment 2032.0 -273.98 -0.2363 2689.0 543.9 0.4406 0.1445 0.289 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H20 mock treatment 2060.0 -245.98 -0.2122 2589.0 443.9 0.3596 0.1043 0.2497 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H21 compound treatment 1980.0 -325.98 -0.2811 1886.0 -259.1 -0.2099 -0.3472 -0.9896 3552556 Ald2.1-H_000157 Oc1c(Br)cc(Br)cc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H22 compound treatment 1944.0 -361.98 -0.3122 1767.0 -378.1 -0.3063 -0.4373 -1.0 3552850 Ald2.1-H_000158 NC(=O)COc1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H23 compound treatment 40.0 -2266.0 -1.9543 43.0 -2102.1 -1.7029 -2.5861 -0.9976 3552561 Ald2.1-H_000159 CCCCN(CCCC)c1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 H24 compound treatment 1665.0 -640.98 -0.5528 4698.0 2552.9 2.0681 1.0715 0.5005 3552855 Ald2.1-H_000160 NC(=O)COc1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I01 compound treatment 1444.0 -861.98 -0.7434 3070.0 924.9 0.7493 0.0041 0.0039 3552070 Ald2.1-H_000161 COc1cc(Cl)c(/C=N/NC(=O)c2ccccc2O)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I02 compound treatment 1845.0 -460.98 -0.3976 2347.0 201.9 0.1636 -0.1655 -0.3849 1918345 Ald2.1-H_000162 Oc1ccccc1C(=O)NN=C2CCCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I03 compound treatment 356.0 -1950.0 -1.6818 734.0 -1411.1 -1.1431 -1.9975 -0.9823 2082285 Ald2.1-H_000163 Oc1ccccc1C(=O)N/N=C/c2cc(Cl)cc(Cl)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I04 compound treatment 2219.0 -86.984 -0.075 2734.0 588.9 0.4771 0.2843 0.5887 3554225 Ald2.1-H_000164 Oc1ccccc1C(=O)NN=C2CCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I05 mock treatment 2865.0 559.02 0.4821 3008.0 862.9 0.6991 0.8352 0.9836 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I06 mock treatment 2493.0 187.02 0.1613 2867.0 721.9 0.5848 0.5276 0.8697 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I07 compound treatment 1806.0 -499.98 -0.4312 1451.0 -694.1 -0.5623 -0.7025 -0.9914 3552075 Ald2.1-H_000165 Oc1ccccc1C(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I08 compound treatment 1694.0 -611.98 -0.5278 820.0 -1325.1 -1.0735 -1.1323 -0.9466 3552414 Ald2.1-H_000166 Oc1ccccc1C(=O)N/N=C/Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I09 compound treatment 30.0 -2276.0 -1.9629 41.0 -2104.1 -1.7046 -2.5933 -0.9975 3552079 Ald2.1-H_000167 CCN(CC)c1ccc(/C=N/NC(=O)c2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I10 compound treatment 2216.0 -89.984 -0.0776 1635.0 -510.1 -0.4132 -0.3471 -0.8255 3552416 Ald2.1-H_000168 COC(=O)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I11 compound treatment 2178.0 -127.98 -0.1104 1670.0 -475.1 -0.3849 -0.3502 -0.8746 3552083 Ald2.1-H_000169 Oc1ccccc1C(=O)N/N=C/c2ccc3OCCc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I12 compound treatment 2175.0 -130.98 -0.113 1029.0 -1116.1 -0.9042 -0.7192 -0.7893 3552341 Ald2.1-H_000170 COc1cc(Br)c(/C=N/NC(=O)c2ccccc2O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I13 compound treatment 78.0 -2228.0 -1.9215 60.0 -2085.1 -1.6892 -2.5532 -0.9979 3552087 Ald2.1-H_000171 Oc1cccc(/C=N/NC(=O)c2ccccc2O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I14 compound treatment 1642.0 -663.98 -0.5727 1264.0 -881.1 -0.7138 -0.9097 -0.994 3552418 Ald2.1-H_000172 Oc1ccccc1C(=O)N/N=C/c2cc3ccccc3n2S(=O)(=O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I15 compound treatment 122.0 -2184.0 -1.8836 87.0 -2058.1 -1.6673 -2.5109 -0.9981 3552091 Ald2.1-H_000173 Oc1ccc(/C=N/NC(=O)c2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I16 compound treatment 2089.0 -216.98 -0.1871 1498.0 -647.1 -0.5242 -0.503 -0.9037 3552345 Ald2.1-H_000174 Oc1ccccc1C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I17 compound treatment 81.0 -2225.0 -1.919 78.0 -2067.1 -1.6746 -2.541 -0.9977 3552095 Ald2.1-H_000175 Oc1ccc(O)c(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I18 compound treatment 173.0 -2133.0 -1.8396 949.0 -1196.1 -0.969 -1.986 -0.9552 3552349 Ald2.1-H_000176 Oc1ccccc1C(=O)N/N=C/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I19 compound treatment 476.0 -1830.0 -1.5783 536.0 -1609.1 -1.3036 -2.0378 -0.9955 3552098 Ald2.1-H_000177 Oc1ccc(/C=N/NC(=O)c2ccccc2O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I20 compound treatment 1456.0 -849.98 -0.7331 1795.0 -350.1 -0.2836 -0.7189 -0.9146 3552420 Ald2.1-H_000178 OB(O)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I21 mock treatment 2541.0 235.02 0.2027 1878.0 -267.1 -0.2164 -0.0097 -0.0326 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I22 mock treatment 1808.0 -497.98 -0.4295 1883.0 -262.1 -0.2123 -0.4538 -0.9472 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I23 compound treatment 2198.0 -107.98 -0.0931 1502.0 -643.1 -0.521 -0.4342 -0.8205 1922557 Ald2.1-H_000179 COc1ccc(/C=N/NC(=O)c2ccccc2O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 I24 compound treatment 1584.0 -721.98 -0.6227 1442.0 -703.1 -0.5696 -0.8431 -0.999 3552422 Ald2.1-H_000180 Oc1ccccc1C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J01 compound treatment 1685.0 -620.98 -0.5356 2734.0 588.9 0.4771 -0.0414 -0.0577 3552565 Ald2.1-H_000181 COc1cc(Cl)c(/C=N/NC(=O)c2ccccn2)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J02 compound treatment 2356.0 50.016 0.0431 2515.0 369.9 0.2997 0.2424 0.8006 3554230 Ald2.1-H_000182 O=C(NN=C1CCCCCCC1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J03 compound treatment 1769.0 -536.98 -0.4631 3113.0 967.9 0.7841 0.227 0.2492 3552569 Ald2.1-H_000183 Oc1c(Cl)cc(Cl)cc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J04 compound treatment 2646.0 340.02 0.2932 2542.0 396.9 0.3215 0.4347 0.9989 3554228 Ald2.1-H_000184 O=C(NN=C1CCCCCC1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J05 mock treatment 2674.0 368.02 0.3174 3419.0 1273.9 1.032 0.9542 0.8837 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J06 mock treatment 2862.0 556.02 0.4795 2929.0 783.9 0.6351 0.7881 0.9904 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J07 compound treatment 3229.0 923.02 0.7961 3626.0 1480.9 1.1997 1.4112 0.9802 3552573 Ald2.1-H_000185 Oc1c(/C=N/NC(=O)c2ccccn2)cc(Br)cc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J08 compound treatment 3232.0 926.02 0.7987 3119.0 973.9 0.789 1.1226 1.0 3552977 Ald2.1-H_000186 O=C(N/N=C/Cc1ccccc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J09 compound treatment 88.0 -2218.0 -1.9129 55.0 -2090.1 -1.6932 -2.5499 -0.9981 3552578 Ald2.1-H_000187 CCN(CC)c1ccc(/C=N/NC(=O)c2ccccn2)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J10 compound treatment 2739.0 433.02 0.3735 2727.0 581.9 0.4714 0.5974 0.9933 3552981 Ald2.1-H_000188 COC(=O)c1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J11 compound treatment 3636.0 1330.0 1.1471 3167.0 1021.9 0.8279 1.3965 0.9872 3552582 Ald2.1-H_000189 O=C(N/N=C/c1ccc2OCCc2c1)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J12 compound treatment 3452.0 1146.0 0.9884 2378.0 232.9 0.1887 0.8323 0.8272 3552859 Ald2.1-H_000190 COc1cc(Br)c(/C=N/NC(=O)c2ccccn2)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J13 compound treatment 1627.0 -678.98 -0.5856 975.0 -1170.1 -0.9479 -1.0844 -0.9732 3552586 Ald2.1-H_000191 Oc1cccc(/C=N/NC(=O)c2ccccn2)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J14 compound treatment 1842.0 -463.98 -0.4002 2175.0 29.905 0.0242 -0.2658 -0.6631 3552985 Ald2.1-H_000192 O=C(N/N=C/c1cc2ccccc2n1S(=O)(=O)c3ccccc3)c4ccccn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J15 compound treatment 2023.0 -282.98 -0.2441 1937.0 -208.1 -0.1686 -0.2918 -0.9837 3552590 Ald2.1-H_000193 Oc1ccc(/C=N/NC(=O)c2ccccn2)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J16 compound treatment 2671.0 365.02 0.3148 2982.0 836.9 0.678 0.702 0.9391 3552862 Ald2.1-H_000194 O=C(N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3)c4ccccn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J17 compound treatment 209.0 -2097.0 -1.8086 240.0 -1905.1 -1.5433 -2.3702 -0.9969 3552594 Ald2.1-H_000195 Oc1ccc(O)c(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J18 compound treatment 2136.0 -169.98 -0.1466 3009.0 863.9 0.6999 0.3912 0.5471 3552866 Ald2.1-H_000196 O=C(N/N=C/C[P+](c1ccccc1)(c2ccccc2)c3ccccc3)c4ccccn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J19 compound treatment 908.0 -1398.0 -1.2057 1260.0 -885.1 -0.717 -1.3596 -0.9692 1936679 Ald2.1-H_000197 Oc1ccc(/C=N/NC(=O)c2ccccn2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J20 compound treatment 2376.0 70.016 0.0604 3131.0 985.9 0.7987 0.6075 0.7584 3552989 Ald2.1-H_000198 OB(O)c1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J21 mock treatment 4987.0 2681.0 2.3123 2972.0 826.9 0.6699 2.1087 0.8759 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J22 mock treatment 2170.0 -135.98 -0.1173 1732.0 -413.1 -0.3347 -0.3196 -0.9012 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J23 compound treatment 2420.0 114.02 0.0983 3073.0 927.9 0.7517 0.6011 0.7929 3552599 Ald2.1-H_000199 COc1ccc(/C=N/NC(=O)c2ccccn2)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 J24 compound treatment 1724.0 -581.98 -0.5019 2607.0 461.9 0.3742 -0.0903 -0.1443 3552993 Ald2.1-H_000200 O=C(N/N=C/c1ccc(OCC#C)cc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K01 compound treatment 2173.0 -132.98 -0.1147 2477.0 331.9 0.2689 0.109 0.373 3552103 Ald2.1-H_000201 COc1cccc(OC)c1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K02 compound treatment 2637.0 331.02 0.2855 2273.0 127.9 0.1036 0.2751 0.9059 3552353 Ald2.1-H_000202 OC[C@@H](O)[C@@H](O)[C@H](O)/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K03 compound treatment 2648.0 342.02 0.295 3183.0 1037.9 0.8408 0.8031 0.9013 1913656 Ald2.1-H_000203 COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K04 compound treatment 2438.0 132.02 0.1139 2123.0 -22.095 -0.0179 0.0679 0.5887 3552357 Ald2.1-H_000204 C[C@@H](O)[C@@H](O)[C@@H](O)C/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K05 compound treatment 2493.0 187.02 0.1613 1733.0 -412.1 -0.3338 -0.122 -0.3291 3552108 Ald2.1-H_000205 COc1cc(O)cc(OC)c1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K06 compound treatment 2351.0 45.016 0.0388 1812.0 -333.1 -0.2698 -0.1634 -0.5992 3552361 Ald2.1-H_000206 OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K07 mock treatment 3474.0 1168.0 1.0074 1440.0 -705.1 -0.5712 0.3084 0.2663 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K08 mock treatment 2711.0 405.02 0.3493 2086.0 -59.095 -0.0479 0.2131 0.6045 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K09 compound treatment 2389.0 83.016 0.0716 1598.0 -547.1 -0.4432 -0.2628 -0.5853 3552111 Ald2.1-H_000207 CC1(C)COC(CCC/C=N/NC(=O)c2ccccc2O)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K10 compound treatment 2095.0 -210.98 -0.182 1818.0 -327.1 -0.265 -0.316 -0.9832 3552365 Ald2.1-H_000208 OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K11 compound treatment 2196.0 -109.98 -0.0949 1589.0 -556.1 -0.4505 -0.3856 -0.8376 3552115 Ald2.1-H_000209 Cc1nnc(Sc2ccc(/C=N/NC(=O)c3ccccc3O)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K12 compound treatment 806.0 -1500.0 -1.2937 1198.0 -947.1 -0.7673 -1.4573 -0.9689 3552366 Ald2.1-H_000210 OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K13 compound treatment 2034.0 -271.98 -0.2346 1146.0 -999.1 -0.8094 -0.7382 -0.876 3552118 Ald2.1-H_000211 Oc1ccccc1C(=O)N/N=C/c2cc(Br)cs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K14 compound treatment 2539.0 233.02 0.201 2151.0 5.9048 0.0048 0.1455 0.7237 3552369 Ald2.1-H_000212 C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K15 mock treatment 3172.0 866.02 0.7469 2188.0 42.905 0.0348 0.5527 0.7392 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K16 mock treatment 2799.0 493.02 0.4252 2233.0 87.905 0.0712 0.351 0.8142 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K17 compound treatment 2644.0 338.02 0.2915 1713.0 -432.1 -0.35 -0.0414 -0.0908 3552121 Ald2.1-H_000213 CC(C)(C)OC(=O)NC/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K18 compound treatment 2164.0 -141.98 -0.1225 2001.0 -144.1 -0.1167 -0.1691 -0.9997 3552373 Ald2.1-H_000214 Oc1ccccc1C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K19 compound treatment 2199.0 -106.98 -0.0923 1685.0 -460.1 -0.3727 -0.3288 -0.8563 3552125 Ald2.1-H_000215 Oc1ccccc1C(=O)N/N=C/c2ccc-3c(Cc4ccccc43)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K20 compound treatment 1790.0 -515.98 -0.445 1321.0 -824.1 -0.6676 -0.7867 -0.9806 3552377 Ald2.1-H_000216 Oc1ccccc1C(=O)N/N=C/c2cc[n+]([O-])cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K21 compound treatment 2348.0 42.016 0.0362 1794.0 -351.1 -0.2844 -0.1755 -0.6121 1922658 Ald2.1-H_000217 Oc1ccccc1C(=O)N/N=C/c2ccc(F)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K22 compound treatment 1647.0 -658.98 -0.5683 1771.0 -374.1 -0.3031 -0.6162 -0.9567 3552381 Ald2.1-H_000218 Oc1ccccc1C(=O)N/N=C/c2ccc3ccccc3n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K23 mock treatment 1356.0 -949.98 -0.8193 2180.0 34.905 0.0283 -0.5594 -0.6823 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 K24 mock treatment 1263.0 -1043.0 -0.8995 1041.0 -1104.1 -0.8944 -1.2685 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L01 compound treatment 2729.0 423.02 0.3648 2929.0 783.9 0.6351 0.707 0.9654 3552603 Ald2.1-H_000219 COc1cccc(OC)c1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L02 compound treatment 1957.0 -348.98 -0.301 2103.0 -42.095 -0.0341 -0.2369 -0.7822 3552870 Ald2.1-H_000220 OC[C@@H](O)[C@@H](O)[C@H](O)/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L03 compound treatment 2061.0 -244.98 -0.2113 3299.0 1153.9 0.9348 0.5116 0.5338 3552607 Ald2.1-H_000221 COc1ccc(/C=N/NC(=O)c2ccccn2)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L04 compound treatment 2008.0 -297.98 -0.257 2394.0 248.9 0.2016 -0.0391 -0.1198 3552874 Ald2.1-H_000222 C[C@@H](O)[C@@H](O)[C@@H](O)C/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L05 compound treatment 2119.0 -186.98 -0.1613 2749.0 603.9 0.4892 0.2319 0.4502 3552611 Ald2.1-H_000223 COc1cc(O)cc(OC)c1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L06 compound treatment 2186.0 -119.98 -0.1035 2232.0 86.905 0.0704 -0.0234 -0.1869 3552878 Ald2.1-H_000224 OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L07 mock treatment 2627.0 321.02 0.2769 2632.0 486.9 0.3944 0.4747 0.985 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L08 mock treatment 2152.0 -153.98 -0.1328 2275.0 129.9 0.1052 -0.0195 -0.115 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L09 compound treatment 3131.0 825.02 0.7115 2536.0 390.9 0.3167 0.7271 0.9335 3552614 Ald2.1-H_000225 CC1(C)COC(CCC/C=N/NC(=O)c2ccccn2)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L10 compound treatment 2416.0 110.02 0.0949 2238.0 92.905 0.0753 0.1203 0.9934 3552881 Ald2.1-H_000226 OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L11 compound treatment 3004.0 698.02 0.602 2353.0 207.9 0.1684 0.5448 0.8715 3552618 Ald2.1-H_000227 Cc1nnc(Sc2ccc(/C=N/NC(=O)c3ccccn3)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L12 compound treatment 2593.0 287.02 0.2475 2763.0 617.9 0.5006 0.529 0.9473 3552884 Ald2.1-H_000228 OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L13 compound treatment 3129.0 823.02 0.7098 2320.0 174.9 0.1417 0.6021 0.8318 3552622 Ald2.1-H_000229 Brc1csc(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L14 compound treatment 2176.0 -129.98 -0.1121 2412.0 266.9 0.2162 0.0736 0.3023 3552885 Ald2.1-H_000230 C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L15 mock treatment 2899.0 593.02 0.5115 2269.0 123.9 0.1004 0.4326 0.83 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L16 mock treatment 2003.0 -302.98 -0.2613 1890.0 -255.1 -0.2067 -0.3309 -0.9932 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L17 compound treatment 2494.0 188.02 0.1622 2058.0 -87.095 -0.0706 0.0648 0.3663 3552626 Ald2.1-H_000231 CC(C)(C)OC(=O)NC/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L18 compound treatment 2913.0 607.02 0.5235 1939.0 -206.1 -0.167 0.2521 0.4588 3552890 Ald2.1-H_000232 O=C(N/N=C/c1ccc(Oc2ccccc2)cc1)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L19 compound treatment 2515.0 209.02 0.1803 2415.0 269.9 0.2187 0.2821 0.9954 3552630 Ald2.1-H_000233 O=C(N/N=C/c1ccc-2c(Cc3ccccc32)c1)c4ccccn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L20 compound treatment 1712.0 -593.98 -0.5123 2086.0 -59.095 -0.0479 -0.3961 -0.7698 3552894 Ald2.1-H_000234 [O-][n+]1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L21 compound treatment 2734.0 428.02 0.3691 2271.0 125.9 0.102 0.3331 0.8699 3552634 Ald2.1-H_000235 Fc1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L22 compound treatment 1752.0 -553.98 -0.4778 2112.0 -33.095 -0.0268 -0.3568 -0.7456 3552898 Ald2.1-H_000236 O=C(N/N=C/c1ccc2ccccc2n1)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L23 mock treatment 2395.0 89.016 0.0768 1320.0 -825.1 -0.6684 -0.4184 -0.6218 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 L24 mock treatment 1808.0 -497.98 -0.4295 937.0 -1208.1 -0.9787 -0.9957 -0.9317 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M01 compound treatment 1645.0 -660.98 -0.5701 1968.0 -177.1 -0.1435 -0.5045 -0.8583 3552129 Ald2.1-H_000237 Oc1ccc(/C=N/NC(=O)c2ccccc2O)cc1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M02 compound treatment 1758.0 -547.98 -0.4726 2551.0 405.9 0.3288 -0.1017 -0.1766 3552383 Ald2.1-H_000238 Cc1ccccc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M03 compound treatment 1817.0 -488.98 -0.4217 2998.0 852.9 0.6909 0.1904 0.2352 3552133 Ald2.1-H_000239 Oc1ccccc1C(=O)N/N=C/c2ccc(F)c(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M04 compound treatment 2112.0 -193.98 -0.1673 3374.0 1228.9 0.9956 0.5857 0.5801 3552385 Ald2.1-H_000240 COc1cc(/C=N/NC(=O)c2ccccc2O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M05 compound treatment 173.0 -2133.0 -1.8396 146.0 -1999.1 -1.6195 -2.446 -0.998 3552138 Ald2.1-H_000241 Oc1ccc(F)cc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M06 compound treatment 1330.0 -975.98 -0.8417 606.0 -1539.1 -1.2468 -1.4769 -0.9817 3552386 Ald2.1-H_000242 O[C@@H](/C=N/NC(=O)c1ccccc1O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M07 compound treatment 27.0 -2279.0 -1.9655 69.0 -2076.1 -1.6819 -2.5791 -0.997 3552142 Ald2.1-H_000243 Oc1ccccc1C(=O)N/N=C/c2coc3ccccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M08 compound treatment 2381.0 75.016 0.0647 1468.0 -677.1 -0.5485 -0.3421 -0.6194 3552388 Ald2.1-H_000244 OC[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M09 mock treatment 2879.0 573.02 0.4942 2133.0 -12.095 -0.0098 0.3425 0.693 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M10 mock treatment 2522.0 216.02 0.1863 1879.0 -266.1 -0.2156 -0.0207 -0.0726 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M11 compound treatment 2285.0 -20.984 -0.0181 1541.0 -604.1 -0.4894 -0.3588 -0.7328 3552146 Ald2.1-H_000245 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M12 compound treatment 2011.0 -294.98 -0.2544 1691.0 -454.1 -0.3679 -0.44 -0.9838 1919426 Ald2.1-H_000246 COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M13 mock treatment 2889.0 583.02 0.5028 2662.0 516.9 0.4188 0.6517 0.9959 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M14 mock treatment 2606.0 300.02 0.2588 2178.0 32.905 0.0267 0.2018 0.7758 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M15 compound treatment 2741.0 435.02 0.3752 2450.0 304.9 0.247 0.44 0.9794 3552150 Ald2.1-H_000247 OB(O)c1cccc(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M16 compound treatment 2053.0 -252.98 -0.2182 2352.0 206.9 0.1676 -0.0358 -0.13 3552389 Ald2.1-H_000248 CCOc1cccc(/C=N/NC(=O)c2ccccc2O)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M17 compound treatment 2124.0 -181.98 -0.157 1839.0 -306.1 -0.248 -0.2863 -0.9757 1913661 Ald2.1-H_000249 Oc1ccccc1C(=O)N/N=C/c2ccco2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M18 compound treatment 66.0 -2240.0 -1.9319 158.0 -1987.1 -1.6098 -2.5043 -0.9959 3552391 Ald2.1-H_000250 Oc1ccccc1C(=O)N/N=C/c2cc(I)cc(I)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M19 compound treatment 1581.0 -724.98 -0.6253 1935.0 -210.1 -0.1702 -0.5625 -0.868 3552154 Ald2.1-H_000251 Oc1ccccc1C(=O)N/N=C/c2ccoc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M20 compound treatment 1816.0 -489.98 -0.4226 1810.0 -335.1 -0.2715 -0.4908 -0.9771 1912672 Ald2.1-H_000252 CN(C)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M21 compound treatment 1771.0 -534.98 -0.4614 1518.0 -627.1 -0.508 -0.6855 -0.9988 3552158 Ald2.1-H_000253 Oc1cccc(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M22 compound treatment 1737.0 -568.98 -0.4907 1915.0 -230.1 -0.1864 -0.4788 -0.9121 1919995 Ald2.1-H_000254 CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccccc4O)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M23 compound treatment 1904.0 -401.98 -0.3467 1370.0 -775.1 -0.6279 -0.6892 -0.9608 1922299 Ald2.1-H_000255 Oc1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 M24 compound treatment 1624.0 -681.98 -0.5882 652.0 -1493.1 -1.2096 -1.2712 -0.9451 3552393 Ald2.1-H_000256 Oc1ccccc1C(=O)N/N=C/c2ccc(c(F)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N01 compound treatment 1680.0 -625.98 -0.5399 2616.0 470.9 0.3815 -0.112 -0.1694 3552638 Ald2.1-H_000257 Oc1ccc(/C=N/NC(=O)c2ccccn2)cc1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N02 compound treatment 1533.0 -772.98 -0.6667 2669.0 523.9 0.4244 -0.1713 -0.2167 3552902 Ald2.1-H_000258 Cc1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N03 compound treatment 987.0 -1319.0 -1.1376 2070.0 -75.095 -0.0608 -0.8474 -0.7439 3552642 Ald2.1-H_000259 Fc1ccc(/C=N/NC(=O)c2ccccn2)cc1Oc3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N04 compound treatment 1778.0 -527.98 -0.4554 2254.0 108.9 0.0882 -0.2596 -0.5597 3552906 Ald2.1-H_000260 COc1cc(/C=N/NC(=O)c2ccccn2)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N05 compound treatment 1591.0 -714.98 -0.6166 2097.0 -48.095 -0.039 -0.4636 -0.7503 3552646 Ald2.1-H_000261 Oc1ccc(F)cc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N06 compound treatment 1679.0 -626.98 -0.5407 1973.0 -172.1 -0.1394 -0.4809 -0.8613 3552910 Ald2.1-H_000262 O[C@@H](/C=N/NC(=O)c1ccccn1)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N07 compound treatment 2051.0 -254.98 -0.2199 2221.0 75.905 0.0615 -0.112 -0.4906 3552650 Ald2.1-H_000263 O=C(N/N=C/c1coc2ccccc2c1=O)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N08 compound treatment 1892.0 -413.98 -0.357 2563.0 417.9 0.3386 -0.0131 -0.0266 3552913 Ald2.1-H_000264 OC[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N09 mock treatment 2398.0 92.016 0.0794 2320.0 174.9 0.1417 0.1563 0.9625 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N10 mock treatment 1934.0 -371.98 -0.3208 2083.0 -62.095 -0.0503 -0.2624 -0.8081 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N11 compound treatment 2260.0 -45.984 -0.0397 1974.0 -171.1 -0.1386 -0.1261 -0.8743 3552654 Ald2.1-H_000265 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N12 compound treatment 1849.0 -456.98 -0.3941 2222.0 76.905 0.0623 -0.2346 -0.588 3552915 Ald2.1-H_000266 COc1ccc(/C=N/NC(=O)c2ccccn2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N13 mock treatment 2294.0 -11.984 -0.0103 2685.0 539.9 0.4374 0.302 0.6902 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N14 mock treatment 2669.0 363.02 0.3131 2213.0 67.905 0.055 0.2603 0.8188 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N15 compound treatment 2386.0 80.016 0.069 2229.0 83.905 0.068 0.0969 1.0 3552658 Ald2.1-H_000267 OB(O)c1cccc(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N16 compound treatment 2056.0 -249.98 -0.2156 2276.0 130.9 0.106 -0.0775 -0.3224 3552919 Ald2.1-H_000268 CCOc1cccc(/C=N/NC(=O)c2ccccn2)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N17 compound treatment 1987.0 -318.98 -0.2751 2099.0 -46.095 -0.0373 -0.2209 -0.7958 1937927 Ald2.1-H_000269 O=C(N/N=C/c1ccco1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N18 compound treatment 1981.0 -324.98 -0.2803 3046.0 900.9 0.7298 0.3179 0.4066 3552923 Ald2.1-H_000270 Oc1c(I)cc(I)cc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N19 compound treatment 2063.0 -242.98 -0.2096 1966.0 -179.1 -0.1451 -0.2508 -0.9839 3552663 Ald2.1-H_000271 O=C(N/N=C/c1ccoc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N20 compound treatment 2225.0 -80.984 -0.0698 2057.0 -88.095 -0.0714 -0.0999 -0.9999 3552927 Ald2.1-H_000272 CN(C)c1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N21 compound treatment 2156.0 -149.98 -0.1294 2050.0 -95.095 -0.077 -0.1459 -0.9693 3552665 Ald2.1-H_000273 Oc1cccc(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N22 compound treatment 1109.0 -1197.0 -1.0323 1649.0 -496.1 -0.4019 -1.0142 -0.9155 3552931 Ald2.1-H_000274 CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccccn4)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N23 compound treatment 1708.0 -597.98 -0.5157 2099.0 -46.095 -0.0373 -0.3911 -0.7563 3552669 Ald2.1-H_000275 Oc1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 N24 compound treatment 1219.0 -1087.0 -0.9375 1440.0 -705.1 -0.5712 -1.0668 -0.9718 3552936 Ald2.1-H_000276 Fc1cc(/C=N/NC(=O)c2ccccn2)ccc1c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O01 compound treatment 1165.0 -1141.0 -0.9841 1959.0 -186.1 -0.1508 -0.8024 -0.806 3552163 Ald2.1-H_000277 OCCOc1ccccc1/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O02 compound treatment 1548.0 -757.98 -0.6537 2029.0 -116.1 -0.0941 -0.5288 -0.8006 3552395 Ald2.1-H_000278 Oc1ccccc1C(=O)N/N=C/c2ccc(o2)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O03 compound treatment 2340.0 34.016 0.0293 2667.0 521.9 0.4228 0.3197 0.7544 3552167 Ald2.1-H_000279 OCCOc1cccc(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O04 compound treatment 1796.0 -509.98 -0.4398 1991.0 -154.1 -0.1248 -0.3993 -0.8733 3552397 Ald2.1-H_000280 Cn1cc(/C=N/NC(=O)c2ccccc2O)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O05 compound treatment 2197.0 -108.98 -0.094 2185.0 39.905 0.0323 -0.0436 -0.4387 3552171 Ald2.1-H_000281 OCCOc1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O06 compound treatment 827.0 -1479.0 -1.2756 149.0 -1996.1 -1.6171 -2.0454 -0.9931 3552399 Ald2.1-H_000282 Oc1ccccc1C(=O)N/N=C/c2cn(Cc3ccccc3)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O07 compound treatment 101.0 -2205.0 -1.9017 34.0 -2111.1 -1.7102 -2.554 -0.9986 3552175 Ald2.1-H_000283 COc1ccc(/C=N/NC(=O)c2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O08 compound treatment 1587.0 -718.98 -0.6201 1629.0 -516.1 -0.4181 -0.7341 -0.9816 3552401 Ald2.1-H_000284 Oc1ccccc1C(=O)N/N=C/C2=CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O09 compound treatment 1777.0 -528.98 -0.4562 799.0 -1346.1 -1.0905 -1.0937 -0.9252 3552179 Ald2.1-H_000285 COc1ccc(O)c(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O10 compound treatment 2540.0 234.02 0.2018 1694.0 -451.1 -0.3654 -0.1157 -0.2771 3552403 Ald2.1-H_000286 OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O11 mock treatment 2390.0 84.016 0.0725 2025.0 -120.1 -0.0973 -0.0176 -0.1447 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O12 mock treatment 3078.0 772.02 0.6658 1928.0 -217.1 -0.1759 0.3465 0.5031 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O13 compound treatment 2404.0 98.016 0.0845 1115.0 -1030.1 -0.8345 -0.5303 -0.6322 3552184 Ald2.1-H_000287 COc1cc(/C=C/C=N/NC(=O)c2ccccc2O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O14 compound treatment 2396.0 90.016 0.0776 1522.0 -623.1 -0.5048 -0.302 -0.5914 3552404 Ald2.1-H_000288 OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)/C=N/NC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O15 compound treatment 595.0 -1711.0 -1.4757 225.0 -1920.1 -1.5555 -2.1433 -0.9997 3552188 Ald2.1-H_000289 Cc1ccc(O)c(/C=N/NC(=O)c2ccccc2O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O16 compound treatment 2060.0 -245.98 -0.2122 1223.0 -922.1 -0.747 -0.6782 -0.8734 3552406 Ald2.1-H_000290 OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c2ccccc2O)[C@H](O)[C@@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O17 compound treatment 2085.0 -220.98 -0.1906 1808.0 -337.1 -0.2731 -0.3279 -0.9845 3552191 Ald2.1-H_000291 OCc1ccc(/C=N/NC(=O)c2ccccc2O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O18 compound treatment 1437.0 -868.98 -0.7495 1505.0 -640.1 -0.5185 -0.8966 -0.9838 3554239 Ald2.1-H_000292 C/C(=N\NC(=O)c1ccccc1O)/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O19 compound treatment 27.0 -2279.0 -1.9655 43.0 -2102.1 -1.7029 -2.594 -0.9974 3552195 Ald2.1-H_000293 Oc1ccccc1C(=O)N/N=C/c2ccc3ccccc3c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O20 compound treatment 1457.0 -848.98 -0.7322 945.0 -1200.1 -0.9722 -1.2052 -0.9902 3552408 Ald2.1-H_000294 CN(C)CCCOc1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O21 compound treatment 1745.0 -560.98 -0.4838 1440.0 -705.1 -0.5712 -0.746 -0.9966 3552199 Ald2.1-H_000295 Oc1ccccc1C(=O)N/N=C/c2ccc(o2)c3cccc(Cl)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O22 compound treatment 1147.0 -1159.0 -0.9996 1633.0 -512.1 -0.4149 -1.0002 -0.9241 3552410 Ald2.1-H_000296 CCOc1cc(/C=N/NC(=O)c2ccccc2O)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O23 compound treatment 1167.0 -1139.0 -0.9823 1416.0 -729.1 -0.5907 -1.1123 -0.9704 3552203 Ald2.1-H_000297 Oc1ccccc1C(=O)N/N=C/c2cc(Br)c(O)c(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 O24 compound treatment 1297.0 -1009.0 -0.8702 1097.0 -1048.1 -0.8491 -1.2157 -0.9999 3552412 Ald2.1-H_000298 CN(CCO)c1ccc(/C=N/NC(=O)c2ccccc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P01 compound treatment 47.0 -2259.0 -1.9483 2953.0 807.9 0.6545 -0.9148 -0.4451 3552673 Ald2.1-H_000299 OCCOc1ccccc1/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P02 compound treatment 1650.0 -655.98 -0.5658 2207.0 61.905 0.0501 -0.3646 -0.6419 3552940 Ald2.1-H_000300 OS(=O)(=O)c1ccc(/C=N/NC(=O)c2ccccn2)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P03 compound treatment 1500.0 -805.98 -0.6951 2942.0 796.9 0.6456 -0.035 -0.0369 3552677 Ald2.1-H_000301 OCCOc1cccc(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P04 compound treatment 1626.0 -679.98 -0.5865 1832.0 -313.1 -0.2536 -0.594 -0.9297 3552944 Ald2.1-H_000302 Cn1cc(/C=N/NC(=O)c2ccccn2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P05 compound treatment 2827.0 521.02 0.4494 2309.0 163.9 0.1328 0.4116 0.8785 3552680 Ald2.1-H_000303 OCCOc1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P06 compound treatment 1166.0 -1140.0 -0.9832 91.0 -2054.1 -1.6641 -1.8719 -0.9685 3552948 Ald2.1-H_000304 O=C(N/N=C/c1cn(Cc2ccccc2)c3ccccc13)c4ccccn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P07 compound treatment 1360.0 -945.98 -0.8159 845.0 -1300.1 -1.0532 -1.3217 -0.992 3552684 Ald2.1-H_000305 COc1ccc(/C=N/NC(=O)c2ccccn2)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P08 compound treatment 1309.0 -996.98 -0.8599 1561.0 -584.1 -0.4732 -0.9426 -0.9604 3552951 Ald2.1-H_000306 O=C(N/N=C/C1=CCCCC1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P09 compound treatment 1239.0 -1067.0 -0.9202 56.0 -2089.1 -1.6924 -1.8474 -0.959 3552688 Ald2.1-H_000307 COc1ccc(O)c(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P10 compound treatment 1954.0 -351.98 -0.3036 1407.0 -738.1 -0.5979 -0.6375 -0.9506 3552955 Ald2.1-H_000308 OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P11 mock treatment 2319.0 13.016 0.0112 1816.0 -329.1 -0.2666 -0.1806 -0.6767 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P12 mock treatment 2124.0 -181.98 -0.157 1462.0 -683.1 -0.5534 -0.5023 -0.8732 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P13 compound treatment 2198.0 -107.98 -0.0931 1552.0 -593.1 -0.4805 -0.4056 -0.8287 3552692 Ald2.1-H_000309 COc1cc(/C=C/C=N/NC(=O)c2ccccn2)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P14 compound treatment 1828.0 -477.98 -0.4122 1487.0 -658.1 -0.5331 -0.6685 -0.9919 3552957 Ald2.1-H_000310 OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)/C=N/NC(=O)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P15 compound treatment 1045.0 -1261.0 -1.0875 980.0 -1165.1 -0.9439 -1.4364 -0.9975 3552696 Ald2.1-H_000311 Cc1ccc(O)c(/C=N/NC(=O)c2ccccn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P16 compound treatment 1842.0 -463.98 -0.4002 1683.0 -462.1 -0.3743 -0.5477 -0.9994 3552961 Ald2.1-H_000312 OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c2ccccn2)[C@H](O)[C@@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P17 compound treatment 1795.0 -510.98 -0.4407 1649.0 -496.1 -0.4019 -0.5958 -0.9989 3552700 Ald2.1-H_000313 OCc1ccc(/C=N/NC(=O)c2ccccn2)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P18 compound treatment 1385.0 -920.98 -0.7943 1093.0 -1052.1 -0.8523 -1.1643 -0.9994 3554243 Ald2.1-H_000314 C/C(=N\NC(=O)c1ccccn1)/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P19 compound treatment 1828.0 -477.98 -0.4122 1504.0 -641.1 -0.5194 -0.6587 -0.9935 3552703 Ald2.1-H_000315 Oc1c(/C=N/NC(=O)c2ccccn2)ccc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P20 compound treatment 1537.0 -768.98 -0.6632 1243.0 -902.1 -0.7308 -0.9857 -0.9988 3552965 Ald2.1-H_000316 CN(C)CCCOc1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P21 compound treatment 1542.0 -763.98 -0.6589 1040.0 -1105.1 -0.8953 -1.099 -0.9886 3552707 Ald2.1-H_000317 Clc1cccc(c1)c2ccc(/C=N/NC(=O)c3ccccn3)o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P22 compound treatment 1209.0 -1097.0 -0.9461 736.0 -1409.1 -1.1415 -1.4762 -0.9956 3552969 Ald2.1-H_000318 CCOc1cc(/C=N/NC(=O)c2ccccn2)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P23 compound treatment 2027.0 -278.98 -0.2406 857.0 -1288.1 -1.0435 -0.908 -0.8479 3552710 Ald2.1-H_000319 Oc1c(Br)cc(/C=N/NC(=O)c2ccccn2)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2409 P24 compound treatment 1193.0 -1113.0 -0.9599 1577.0 -568.1 -0.4602 -1.0042 -0.9433 3552973 Ald2.1-H_000320 CN(CCO)c1ccc(/C=N/NC(=O)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A01 compound treatment 7.0 -2279.0 -1.9655 2874.0 820.08 0.6644 -0.9201 -0.4435 3622456 Ald3.1-H_000001 ONC(=O)CCCCC(=O)N/N=C/c1ccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A02 compound treatment 3.0 -2283.0 -1.969 1224.0 -829.92 -0.6723 -1.8677 -0.8977 3622458 Ald3.1-H_000002 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A03 compound treatment 78.0 -2208.0 -1.9043 1841.0 -212.92 -0.1725 -1.4685 -0.768 3622460 Ald3.1-H_000003 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A04 compound treatment 5.0 -2281.0 -1.9673 48.0 -2005.9 -1.625 -2.5401 -0.9955 3622462 Ald3.1-H_000004 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A05 compound treatment 37.0 -2249.0 -1.9397 13.0 -2040.9 -1.6534 -2.5407 -0.9968 3622464 Ald3.1-H_000005 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A06 compound treatment 6.0 -2280.0 -1.9664 628.0 -1425.9 -1.1552 -2.2073 -0.9678 3622466 Ald3.1-H_000006 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A07 compound treatment 2673.0 387.0 0.3338 2451.0 397.08 0.3217 0.4635 0.9998 3622468 Ald3.1-H_000007 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A08 compound treatment 1.0 -2285.0 -1.9707 1916.0 -137.92 -0.1117 -1.4725 -0.746 3622470 Ald3.1-H_000008 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A09 compound treatment 1292.0 -994.0 -0.8573 0.0 -2053.9 -1.6639 -1.7828 -0.9524 3622472 Ald3.1-H_000009 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A10 compound treatment 1.0 -2285.0 -1.9707 1230.0 -823.92 -0.6675 -1.8655 -0.8966 3622474 Ald3.1-H_000010 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A11 compound treatment 1621.0 -665.0 -0.5735 1455.0 -598.92 -0.4852 -0.7486 -0.9965 3622476 Ald3.1-H_000011 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A12 compound treatment 9.0 -2277.0 -1.9638 1251.0 -802.92 -0.6505 -1.8486 -0.8936 3622478 Ald3.1-H_000012 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A13 mock treatment 2119.0 -167.0 -0.144 10.0 -2043.9 -1.6558 -1.2727 -0.7657 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A14 mock treatment 1519.0 -767.0 -0.6615 1685.0 -368.92 -0.2989 -0.6791 -0.9355 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A15 compound treatment 303.0 -1983.0 -1.7103 97.0 -1956.9 -1.5853 -2.3303 -0.9993 3622480 Ald3.1-H_000013 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A16 compound treatment 5.0 -2281.0 -1.9673 1726.0 -327.92 -0.2657 -1.5789 -0.7954 3622482 Ald3.1-H_000014 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A17 compound treatment 503.0 -1783.0 -1.5378 67.0 -1986.9 -1.6096 -2.2255 -0.9997 3622484 Ald3.1-H_000015 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A18 compound treatment 8.0 -2278.0 -1.9647 1078.0 -975.92 -0.7906 -1.9483 -0.92 3622486 Ald3.1-H_000016 CC(=O)N/N=C/c1ccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A19 compound treatment 266.0 -2020.0 -1.7422 288.0 -1765.9 -1.4306 -2.2435 -0.9952 3622488 Ald3.1-H_000017 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A20 compound treatment 5.0 -2281.0 -1.9673 959.0 -1094.9 -0.887 -2.0183 -0.9353 3622490 Ald3.1-H_000018 O=Cc1ccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A21 compound treatment 2016.0 -270.0 -0.2329 1221.0 -832.92 -0.6748 -0.6418 -0.8991 3622492 Ald3.1-H_000019 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A22 compound treatment 1.0 -2285.0 -1.9707 871.0 -1182.9 -0.9583 -2.0711 -0.9451 3622494 Ald3.1-H_000020 OC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A23 compound treatment 46.0 -2240.0 -1.9319 38.0 -2015.9 -1.6331 -2.5209 -0.9965 3622496 Ald3.1-H_000021 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 A24 compound treatment 4.0 -2282.0 -1.9681 223.0 -1830.9 -1.4833 -2.4405 -0.9903 3622498 Ald3.1-H_000022 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B01 compound treatment 1625.0 -661.0 -0.5701 2389.0 335.08 0.2715 -0.2112 -0.3344 3622500 Ald3.1-H_000023 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)CCCCC(=O)NO)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B02 compound treatment 18.0 -2268.0 -1.9561 41.0 -2012.9 -1.6307 -2.5362 -0.9959 3622502 Ald3.1-H_000024 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3ccc(OCCCCCCC(=O)NO)cc3)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B03 compound treatment 747.0 -1539.0 -1.3273 1400.0 -653.92 -0.5297 -1.3131 -0.9188 3622504 Ald3.1-H_000025 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)CCCCCC(=O)NO)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B04 compound treatment 14.0 -2272.0 -1.9595 31.0 -2022.9 -1.6388 -2.5444 -0.9961 3622506 Ald3.1-H_000026 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3ccc(OCCCCCCC(=O)NO)c(OC)c3)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B05 compound treatment 25.0 -2261.0 -1.95 50.0 -2003.9 -1.6234 -2.5268 -0.9958 3622508 Ald3.1-H_000027 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)CCCCCCC(=O)NO)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B06 compound treatment 0.0 -2286.0 -1.9716 1.0 -2052.9 -1.6631 -2.5701 -0.9964 3622510 Ald3.1-H_000028 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3ccc(OCCCCCCC(=O)NO)c4ccccc34)c2)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B07 compound treatment 1969.0 -317.0 -0.2734 2061.0 7.0806 0.0057 -0.1893 -0.6921 3622512 Ald3.1-H_000029 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3cccc(c3)C(=O)NO)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B08 compound treatment 1468.0 -818.0 -0.7055 1550.0 -503.92 -0.4082 -0.7875 -0.9662 3622514 Ald3.1-H_000030 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)CCCCC(=O)Nc3ccccc3O)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B09 compound treatment 1605.0 -681.0 -0.5873 1569.0 -484.92 -0.3928 -0.6931 -0.9809 3622516 Ald3.1-H_000031 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3ccc(cc3)C(=O)NO)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B10 compound treatment 1145.0 -1141.0 -0.9841 637.0 -1416.9 -1.1479 -1.5075 -0.9971 3622518 Ald3.1-H_000032 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)CCCCCC(=O)Nc3ccccc3O)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B11 compound treatment 1146.0 -1140.0 -0.9832 978.0 -1075.9 -0.8716 -1.3116 -0.9982 3622520 Ald3.1-H_000033 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3cccc(OCC(=O)NO)c3)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B12 compound treatment 908.0 -1378.0 -1.1885 293.0 -1760.9 -1.4265 -1.8491 -0.9959 3622522 Ald3.1-H_000034 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)CCCCCCC(=O)Nc3ccccc3O)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B13 mock treatment 2270.0 -16.0 -0.0138 1613.0 -440.92 -0.3572 -0.2623 -0.7339 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B14 mock treatment 2063.0 -223.0 -0.1923 1557.0 -496.92 -0.4026 -0.4207 -0.9429 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B15 compound treatment 400.0 -1886.0 -1.6266 97.0 -1956.9 -1.5853 -2.2712 -0.9999 3622524 Ald3.1-H_000035 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3cccc(OCCCCCC(=O)NO)c3)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B16 compound treatment 1638.0 -648.0 -0.5589 1119.0 -934.92 -0.7574 -0.9307 -0.9888 3622526 Ald3.1-H_000036 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)CCCCCCC(=O)O)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B17 compound treatment 786.0 -1500.0 -1.2937 723.0 -1330.9 -1.0782 -1.6772 -0.9959 3622528 Ald3.1-H_000037 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3ccc(OCCCCCC(=O)NO)cc3)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B18 compound treatment 1765.0 -521.0 -0.4493 958.0 -1095.9 -0.8878 -0.9455 -0.9502 3622530 Ald3.1-H_000038 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)C)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B19 compound treatment 5.0 -2281.0 -1.9673 0.0 -2053.9 -1.6639 -2.5676 -0.9965 3622532 Ald3.1-H_000039 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3cccc(OCCCCCCC(=O)NO)c3)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B20 compound treatment 1228.0 -1058.0 -0.9125 365.0 -1688.9 -1.3682 -1.6127 -0.9806 3622534 Ald3.1-H_000040 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(C=O)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B21 compound treatment 391.0 -1895.0 -1.6344 64.0 -1989.9 -1.6121 -2.2956 -1.0 3622536 Ald3.1-H_000041 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)c3ccc(OCC(=O)NO)cc3)c2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B22 compound treatment 2182.0 -104.0 -0.0897 873.0 -1180.9 -0.9567 -0.7399 -0.77 3622538 Ald3.1-H_000042 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2cccc(\C=N\NC(=O)CCCCCC(=O)O)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B23 compound treatment 1347.0 -939.0 -0.8098 604.0 -1449.9 -1.1746 -1.4032 -0.9835 3622540 Ald3.1-H_000043 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 B24 compound treatment 639.0 -1647.0 -1.4205 137.0 -1916.9 -1.5529 -2.1025 -0.999 3622542 Ald3.1-H_000044 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C01 compound treatment 2242.0 -44.0 -0.0379 3815.0 1761.1 1.4267 0.982 0.6881 3622544 Ald3.1-H_000045 ONC(=O)CCCCC(=O)N/N=C/c1ccc(CN2[C@H](COC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C02 compound treatment 13.0 -2273.0 -1.9604 16.0 -2037.9 -1.6509 -2.5536 -0.9963 3622546 Ald3.1-H_000046 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C03 compound treatment 1898.0 -388.0 -0.3346 2546.0 492.08 0.3986 0.0453 0.087 3622548 Ald3.1-H_000047 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2[C@H](COC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C04 compound treatment 280.0 -2006.0 -1.7301 173.0 -1880.9 -1.5238 -2.3008 -0.998 3622550 Ald3.1-H_000048 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C05 compound treatment 1116.0 -1170.0 -1.0091 2346.0 292.08 0.2366 -0.5462 -0.527 3622552 Ald3.1-H_000049 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2[C@H](COC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C06 compound treatment 0.0 -2286.0 -1.9716 2.0 -2051.9 -1.6623 -2.5695 -0.9964 3622554 Ald3.1-H_000050 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C07 compound treatment 2628.0 342.0 0.295 2535.0 481.08 0.3897 0.4841 0.9906 3622556 Ald3.1-H_000051 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C08 compound treatment 1925.0 -361.0 -0.3113 2183.0 129.08 0.1046 -0.1462 -0.4452 3622558 Ald3.1-H_000052 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C09 compound treatment 2572.0 286.0 0.2467 1712.0 -341.92 -0.277 -0.0214 -0.0578 3622560 Ald3.1-H_000053 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C10 compound treatment 1875.0 -411.0 -0.3545 1307.0 -746.92 -0.6051 -0.6785 -0.9675 3622562 Ald3.1-H_000054 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C11 mock treatment 2161.0 -125.0 -0.1078 742.0 -1311.9 -1.0628 -0.8277 -0.7749 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C12 mock treatment 2113.0 -173.0 -0.1492 2239.0 185.08 0.1499 5.0E-4 0.0024 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C13 compound treatment 2213.0 -73.0 -0.063 1954.0 -99.919 -0.0809 -0.1018 -0.9923 3622564 Ald3.1-H_000055 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C14 compound treatment 1531.0 -755.0 -0.6512 984.0 -1069.9 -0.8668 -1.0733 -0.9901 3622566 Ald3.1-H_000056 OC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2[C@H](COC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C15 mock treatment 2128.0 -158.0 -0.1363 1947.0 -106.92 -0.0866 -0.1576 -0.9761 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C16 mock treatment 2079.0 -207.0 -0.1785 1576.0 -477.92 -0.3872 -0.4 -0.9382 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C17 compound treatment 658.0 -1628.0 -1.4041 586.0 -1467.9 -1.1892 -1.8337 -0.9966 3622568 Ald3.1-H_000057 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C18 compound treatment 551.0 -1735.0 -1.4964 1113.0 -940.92 -0.7623 -1.5971 -0.951 3622570 Ald3.1-H_000058 CC(=O)N/N=C/c1ccc(CN2[C@H](COC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C19 compound treatment 23.0 -2263.0 -1.9517 9.0 -2044.9 -1.6566 -2.5515 -0.9967 3622572 Ald3.1-H_000059 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C20 compound treatment 1622.0 -664.0 -0.5727 539.0 -1514.9 -1.2273 -1.2727 -0.9398 3622574 Ald3.1-H_000060 O=Cc1ccc(CN2[C@H](COC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C21 compound treatment 325.0 -1961.0 -1.6913 249.0 -1804.9 -1.4622 -2.2298 -0.9974 3622576 Ald3.1-H_000061 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@H](COC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C22 compound treatment 1232.0 -1054.0 -0.909 445.0 -1608.9 -1.3034 -1.5644 -0.9845 3622578 Ald3.1-H_000062 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2[C@H](COC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C23 compound treatment 1796.0 -490.0 -0.4226 386.0 -1667.9 -1.3512 -1.2543 -0.8859 3622580 Ald3.1-H_000063 ONC(=O)CCCCC(=O)N/N=C/c1ccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 C24 compound treatment 26.0 -2260.0 -1.9492 7.0 -2046.9 -1.6582 -2.5508 -0.9968 3622581 Ald3.1-H_000064 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D01 compound treatment 3302.0 1016.0 0.8763 3214.0 1160.1 0.9398 1.2841 0.9994 3622582 Ald3.1-H_000065 ONC(=O)CCCCC(=O)N/N=C/c1cccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D02 compound treatment 175.0 -2111.0 -1.8207 471.0 -1582.9 -1.2823 -2.1941 -0.9853 3622584 Ald3.1-H_000066 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D03 compound treatment 845.0 -1441.0 -1.2428 1015.0 -1038.9 -0.8416 -1.4739 -0.982 3622586 Ald3.1-H_000067 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D04 compound treatment 425.0 -1861.0 -1.605 236.0 -1817.9 -1.4727 -2.1763 -0.9991 3622588 Ald3.1-H_000068 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D05 compound treatment 172.0 -2114.0 -1.8232 150.0 -1903.9 -1.5424 -2.3799 -0.9965 3622590 Ald3.1-H_000069 ONC(=O)CCCCCCC(=O)N/N=C/c1cccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D06 compound treatment 424.0 -1862.0 -1.6059 67.0 -1986.9 -1.6096 -2.2737 -1.0 3622592 Ald3.1-H_000070 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D07 compound treatment 2537.0 251.0 0.2165 2997.0 943.08 0.764 0.6933 0.8731 3622594 Ald3.1-H_000071 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D08 compound treatment 2662.0 376.0 0.3243 3121.0 1067.1 0.8645 0.8406 0.9104 3622596 Ald3.1-H_000072 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D09 compound treatment 2278.0 -8.0 -0.0069 2859.0 805.08 0.6522 0.4563 0.6996 3622598 Ald3.1-H_000073 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D10 compound treatment 1033.0 -1253.0 -1.0807 1358.0 -695.92 -0.5638 -1.1628 -0.954 3622600 Ald3.1-H_000074 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D11 mock treatment 2334.0 48.0 0.0414 2641.0 587.08 0.4756 0.3656 0.7658 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D12 mock treatment 2531.0 245.0 0.2113 2410.0 356.08 0.2885 0.3534 0.9883 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D13 compound treatment 3027.0 741.0 0.6391 1490.0 -563.92 -0.4568 0.1289 0.164 3622602 Ald3.1-H_000075 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D14 compound treatment 2518.0 232.0 0.2001 2696.0 642.08 0.5202 0.5093 0.9138 3622604 Ald3.1-H_000076 OC(=O)CCCCCC(=O)N/N=C/c1cccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D15 mock treatment 2831.0 545.0 0.47 2153.0 99.081 0.0803 0.3891 0.816 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D16 mock treatment 2363.0 77.0 0.0664 1792.0 -261.92 -0.2122 -0.1031 -0.4636 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D17 compound treatment 1785.0 -501.0 -0.4321 1272.0 -781.92 -0.6334 -0.7534 -0.9826 3622606 Ald3.1-H_000077 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D18 compound treatment 2053.0 -233.0 -0.201 2084.0 30.081 0.0244 -0.1249 -0.6168 3622608 Ald3.1-H_000078 CC(=O)N/N=C/c1cccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D19 compound treatment 61.0 -2225.0 -1.919 20.0 -2033.9 -1.6477 -2.522 -0.9971 3622610 Ald3.1-H_000079 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D20 compound treatment 1241.0 -1045.0 -0.9013 750.0 -1303.9 -1.0563 -1.3842 -0.9969 3622612 Ald3.1-H_000080 O=Cc1cccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D21 compound treatment 320.0 -1966.0 -1.6956 424.0 -1629.9 -1.3204 -2.1326 -0.9924 3622614 Ald3.1-H_000081 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2cccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D22 compound treatment 1445.0 -841.0 -0.7253 932.0 -1121.9 -0.9089 -1.1556 -0.9938 3622616 Ald3.1-H_000082 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D23 compound treatment 927.0 -1359.0 -1.1721 368.0 -1685.9 -1.3658 -1.7945 -0.9971 3622618 Ald3.1-H_000083 ONC(=O)CCCCC(=O)N/N=C/c1cccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 D24 compound treatment 36.0 -2250.0 -1.9405 19.0 -2034.9 -1.6485 -2.5378 -0.9967 3622620 Ald3.1-H_000084 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E01 mock treatment 3217.0 931.0 0.8029 3470.0 1416.1 1.1472 1.379 0.9848 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E02 mock treatment 2560.0 274.0 0.2363 3590.0 1536.1 1.2444 1.047 0.8266 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E03 compound treatment 4.0 -2282.0 -1.9681 3122.0 1068.1 0.8653 -0.7798 -0.3627 3622622 Ald3.1-H_000085 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E04 compound treatment 69.0 -2217.0 -1.9121 217.0 -1836.9 -1.4881 -2.4043 -0.9923 3622623 Ald3.1-H_000086 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E05 compound treatment 1621.0 -665.0 -0.5735 1385.0 -668.92 -0.5419 -0.7887 -0.9996 3622624 Ald3.1-H_000087 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E06 compound treatment 54.0 -2232.0 -1.925 6.0 -2047.9 -1.659 -2.5343 -0.9973 3622625 Ald3.1-H_000088 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E07 compound treatment 3100.0 814.0 0.702 3357.0 1303.1 1.0556 1.2429 0.9804 3622626 Ald3.1-H_000089 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E08 compound treatment 2521.0 235.0 0.2027 2673.0 619.08 0.5015 0.4979 0.9205 3622627 Ald3.1-H_000090 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E09 mock treatment 2509.0 223.0 0.1923 2923.0 869.08 0.7041 0.6338 0.8684 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E10 mock treatment 2726.0 440.0 0.3795 3340.0 1286.1 1.0419 1.005 0.9064 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E11 compound treatment 2284.0 -2.0 -0.0017 2956.0 902.08 0.7308 0.5155 0.7054 3622628 Ald3.1-H_000091 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E12 compound treatment 1555.0 -731.0 -0.6305 1587.0 -466.92 -0.3783 -0.7133 -0.9701 3622629 Ald3.1-H_000092 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E13 compound treatment 2786.0 500.0 0.4312 933.0 -1120.9 -0.9081 -0.3372 -0.3354 3622630 Ald3.1-H_000093 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E14 compound treatment 1988.0 -298.0 -0.257 2103.0 49.081 0.0398 -0.1536 -0.5907 3622631 Ald3.1-H_000094 OC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E15 compound treatment 753.0 -1533.0 -1.3221 317.0 -1736.9 -1.4071 -1.9299 -0.9995 3622632 Ald3.1-H_000095 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E16 compound treatment 859.0 -1427.0 -1.2307 1851.0 -202.92 -0.1644 -0.9865 -0.7945 3622633 Ald3.1-H_000096 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E17 mock treatment 2438.0 152.0 0.1311 1861.0 -192.92 -0.1563 -0.0178 -0.0873 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E18 mock treatment 1046.0 -1240.0 -1.0694 1577.0 -476.92 -0.3864 -1.0294 -0.9053 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E19 compound treatment 5.0 -2281.0 -1.9673 0.0 -2053.9 -1.6639 -2.5676 -0.9965 3622634 Ald3.1-H_000097 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E20 compound treatment 1071.0 -1215.0 -1.0479 420.0 -1633.9 -1.3237 -1.6769 -0.9933 3622635 Ald3.1-H_000098 O=Cc1ccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E21 compound treatment 1789.0 -497.0 -0.4286 818.0 -1235.9 -1.0012 -1.0111 -0.9283 3622636 Ald3.1-H_000099 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E22 compound treatment 675.0 -1611.0 -1.3894 529.0 -1524.9 -1.2354 -1.856 -0.9983 3622637 Ald3.1-H_000100 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E23 compound treatment 20.0 -2266.0 -1.9543 118.0 -1935.9 -1.5683 -2.4909 -0.994 3622638 Ald3.1-H_000101 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 E24 compound treatment 841.0 -1445.0 -1.2463 75.0 -1978.9 -1.6031 -2.0148 -0.9922 3622639 Ald3.1-H_000102 CC(=O)N/N=C/c1ccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F01 mock treatment 3952.0 1666.0 1.4369 3856.0 1802.1 1.4599 2.0483 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F02 mock treatment 8.0 -2278.0 -1.9647 4238.0 2184.1 1.7694 -0.1381 -0.0522 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F03 compound treatment 2546.0 260.0 0.2242 1341.0 -712.92 -0.5775 -0.2498 -0.4032 3622640 Ald3.1-H_000103 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F04 compound treatment 13.0 -2273.0 -1.9604 13.0 -2040.9 -1.6534 -2.5553 -0.9964 3622642 Ald3.1-H_000104 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F05 compound treatment 2.0 -2284.0 -1.9699 120.0 -1933.9 -1.5667 -2.5007 -0.9936 3622644 Ald3.1-H_000105 ONC(=O)CCCCCCC(=O)N/N=C/c1cccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F06 compound treatment 9.0 -2277.0 -1.9638 30.0 -2023.9 -1.6396 -2.548 -0.996 3622646 Ald3.1-H_000106 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F07 compound treatment 3102.0 816.0 0.7038 2540.0 486.08 0.3938 0.7761 0.9624 3622648 Ald3.1-H_000107 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F08 compound treatment 34.0 -2252.0 -1.9423 1909.0 -144.92 -0.1174 -1.4564 -0.7485 3622650 Ald3.1-H_000108 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F09 mock treatment 2030.0 -256.0 -0.2208 2180.0 126.08 0.1021 -0.0839 -0.3449 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F10 mock treatment 2.0 -2284.0 -1.9699 1732.0 -321.92 -0.2608 -1.5773 -0.7938 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F11 compound treatment 2529.0 243.0 0.2096 2174.0 120.08 0.0973 0.217 0.9391 3622652 Ald3.1-H_000109 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F12 compound treatment 23.0 -2263.0 -1.9517 1807.0 -246.92 -0.2 -1.5215 -0.7755 3622654 Ald3.1-H_000110 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F13 compound treatment 2744.0 458.0 0.395 1498.0 -555.92 -0.4504 -0.0391 -0.0653 3622656 Ald3.1-H_000111 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F14 compound treatment 81.0 -2205.0 -1.9017 5.0 -2048.9 -1.6599 -2.5184 -0.9977 3622658 Ald3.1-H_000112 OC(=O)CCCCCC(=O)N/N=C/c1cccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F15 compound treatment 663.0 -1623.0 -1.3998 1477.0 -576.92 -0.4674 -1.3203 -0.8947 3622660 Ald3.1-H_000113 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F16 compound treatment 28.0 -2258.0 -1.9474 1788.0 -265.92 -0.2154 -1.5294 -0.7806 3622662 Ald3.1-H_000114 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F17 mock treatment 2811.0 525.0 0.4528 1664.0 -389.92 -0.3159 0.0968 0.1754 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F18 mock treatment 4.0 -2282.0 -1.9681 2427.0 373.08 0.3022 -1.178 -0.5916 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F19 compound treatment 69.0 -2217.0 -1.9121 43.0 -2010.9 -1.6291 -2.504 -0.9968 3622664 Ald3.1-H_000115 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F20 compound treatment 887.0 -1399.0 -1.2066 1093.0 -960.92 -0.7785 -1.4036 -0.9775 3622666 Ald3.1-H_000116 O=Cc1cccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F21 compound treatment 908.0 -1378.0 -1.1885 640.0 -1413.9 -1.1454 -1.6503 -0.9998 3622668 Ald3.1-H_000117 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F22 compound treatment 7.0 -2279.0 -1.9655 17.0 -2036.9 -1.6501 -2.5567 -0.9962 3622670 Ald3.1-H_000118 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F23 compound treatment 175.0 -2111.0 -1.8207 85.0 -1968.9 -1.595 -2.4153 -0.9978 3622672 Ald3.1-H_000119 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 F24 compound treatment 72.0 -2214.0 -1.9095 1.0 -2052.9 -1.6631 -2.5262 -0.9976 3622674 Ald3.1-H_000120 CC(=O)N/N=C/c1cccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G01 compound treatment 1705.0 -581.0 -0.5011 1226.0 -827.92 -0.6707 -0.8286 -0.9897 3622676 Ald3.1-H_000121 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)CCCCC(=O)NO)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G02 compound treatment 0.0 -2286.0 -1.9716 1.0 -2052.9 -1.6631 -2.5701 -0.9964 3622678 Ald3.1-H_000122 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3ccc(OCCCCCCC(=O)NO)cc3)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G03 mock treatment 2221.0 -65.0 -0.0561 2373.0 319.08 0.2585 0.1431 0.5412 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G04 mock treatment 1651.0 -635.0 -0.5477 2886.0 832.08 0.6741 0.0894 0.1029 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G05 compound treatment 1096.0 -1190.0 -1.0263 173.0 -1880.9 -1.5238 -1.8032 -0.9815 3622680 Ald3.1-H_000123 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)CCCCCCC(=O)NO)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G06 compound treatment 0.0 -2286.0 -1.9716 0.0 -2053.9 -1.6639 -2.5707 -0.9964 3622682 Ald3.1-H_000124 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3ccc(OCCCCCCC(=O)NO)c4ccccc34)cc2)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G07 compound treatment 2535.0 249.0 0.2148 2662.0 608.08 0.4926 0.5002 0.9308 3622684 Ald3.1-H_000125 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3cccc(c3)C(=O)NO)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G08 compound treatment 286.0 -2000.0 -1.7249 499.0 -1554.9 -1.2597 -2.1104 -0.9881 3622686 Ald3.1-H_000126 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)CCCCC(=O)Nc3ccccc3O)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G09 compound treatment 2163.0 -123.0 -0.1061 2593.0 539.08 0.4367 0.2338 0.5202 3622688 Ald3.1-H_000127 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3ccc(cc3)C(=O)NO)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G10 compound treatment 601.0 -1685.0 -1.4532 285.0 -1768.9 -1.433 -2.0409 -1.0 3622690 Ald3.1-H_000128 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)CCCCCC(=O)Nc3ccccc3O)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G11 compound treatment 1979.0 -307.0 -0.2648 889.0 -1164.9 -0.9437 -0.8545 -0.8718 3622692 Ald3.1-H_000129 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3cccc(OCC(=O)NO)c3)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G12 compound treatment 890.0 -1396.0 -1.204 410.0 -1643.9 -1.3318 -1.793 -0.9987 3622694 Ald3.1-H_000130 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)CCCCCCC(=O)Nc3ccccc3O)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G13 compound treatment 2195.0 -91.0 -0.0785 1005.0 -1048.9 -0.8497 -0.6564 -0.7691 3622696 Ald3.1-H_000131 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3ccc(OCC(=O)NO)cc3)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G14 compound treatment 1854.0 -432.0 -0.3726 1383.0 -670.92 -0.5435 -0.6478 -0.983 3622698 Ald3.1-H_000132 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)CCCCCC(=O)O)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G15 compound treatment 66.0 -2220.0 -1.9147 137.0 -1916.9 -1.5529 -2.452 -0.9946 3622700 Ald3.1-H_000133 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3cccc(OCCCCCC(=O)NO)c3)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G16 compound treatment 1607.0 -679.0 -0.5856 1182.0 -871.92 -0.7064 -0.9136 -0.9957 3622702 Ald3.1-H_000134 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)CCCCCCC(=O)O)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G17 compound treatment 87.0 -2199.0 -1.8965 70.0 -1983.9 -1.6072 -2.4775 -0.9966 3622704 Ald3.1-H_000135 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3ccc(OCCCCCC(=O)NO)cc3)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G18 compound treatment 1317.0 -969.0 -0.8357 930.0 -1123.9 -0.9105 -1.2348 -0.9991 3622706 Ald3.1-H_000136 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)C)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G19 mock treatment 1084.0 -1202.0 -1.0367 760.0 -1293.9 -1.0482 -1.4742 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G20 mock treatment 1609.0 -677.0 -0.5839 757.0 -1296.9 -1.0507 -1.1558 -0.9616 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G21 compound treatment 315.0 -1971.0 -1.6999 116.0 -1937.9 -1.5699 -2.3121 -0.9992 3622708 Ald3.1-H_000137 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)CCCCCC(=O)NO)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G22 compound treatment 0.0 -2286.0 -1.9716 0.0 -2053.9 -1.6639 -2.5707 -0.9964 3622710 Ald3.1-H_000138 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3ccc(OCCCCCCC(=O)NO)c(OC)c3)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G23 compound treatment 0.0 -2286.0 -1.9716 0.0 -2053.9 -1.6639 -2.5707 -0.9964 3622712 Ald3.1-H_000139 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(\C=N\NC(=O)c3cccc(OCCCCCCC(=O)NO)c3)cc2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 G24 compound treatment 615.0 -1671.0 -1.4412 402.0 -1651.9 -1.3382 -1.9653 -0.9993 3622714 Ald3.1-H_000140 COC[C@H]1[C@@H](OC(=O)CC/C=C/CCC(=O)N1Cc2ccc(C=O)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H01 compound treatment 623.0 -1663.0 -1.4343 507.0 -1546.9 -1.2532 -1.9003 -0.9977 3214834 Ald3.1-H_000141 ONC(=O)CCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H02 compound treatment 126.0 -2160.0 -1.8629 63.0 -1990.9 -1.6129 -2.4577 -0.9974 3622716 Ald3.1-H_000142 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H03 mock treatment 2479.0 193.0 0.1665 2409.0 355.08 0.2877 0.3211 0.9662 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H04 mock treatment 1605.0 -681.0 -0.5873 2421.0 367.08 0.2974 -0.205 -0.3114 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H05 compound treatment 15.0 -2271.0 -1.9586 8.0 -2045.9 -1.6574 -2.5569 -0.9965 3213068 Ald3.1-H_000143 ONC(=O)CCCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H06 compound treatment 891.0 -1395.0 -1.2031 55.0 -1998.9 -1.6194 -1.9958 -0.9893 3622718 Ald3.1-H_000144 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccccc2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H07 compound treatment 2750.0 464.0 0.4002 1708.0 -345.92 -0.2802 0.0848 0.1736 3553005 Ald3.1-H_000145 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H08 compound treatment 1664.0 -622.0 -0.5364 1689.0 -364.92 -0.2956 -0.5884 -0.9606 3622720 Ald3.1-H_000146 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H09 compound treatment 2081.0 -205.0 -0.1768 1751.0 -302.92 -0.2454 -0.2985 -0.9871 3553670 Ald3.1-H_000147 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H10 compound treatment 1419.0 -867.0 -0.7478 878.0 -1175.9 -0.9526 -1.2024 -0.9928 3214226 Ald3.1-H_000148 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H11 compound treatment 1799.0 -487.0 -0.42 1324.0 -729.92 -0.5913 -0.7151 -0.986 3622722 Ald3.1-H_000149 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H12 compound treatment 1220.0 -1066.0 -0.9194 709.0 -1344.9 -1.0895 -1.4205 -0.9964 3213070 Ald3.1-H_000150 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H13 compound treatment 2028.0 -258.0 -0.2225 1954.0 -99.919 -0.0809 -0.2146 -0.9062 3622724 Ald3.1-H_000151 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H14 compound treatment 1885.0 -401.0 -0.3458 2132.0 78.081 0.0633 -0.1998 -0.5684 3213680 Ald3.1-H_000152 OC(=O)CCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H15 compound treatment 795.0 -1491.0 -1.2859 616.0 -1437.9 -1.1649 -1.733 -0.9988 3622726 Ald3.1-H_000153 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H16 compound treatment 1920.0 -366.0 -0.3157 1621.0 -432.92 -0.3507 -0.4712 -0.9986 3213678 Ald3.1-H_000154 OC(=O)CCCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H17 compound treatment 383.0 -1903.0 -1.6413 462.0 -1591.9 -1.2896 -2.0725 -0.9929 3622728 Ald3.1-H_000155 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H18 compound treatment 2004.0 -282.0 -0.2432 1590.0 -463.92 -0.3758 -0.4377 -0.9778 3622730 Ald3.1-H_000156 CC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H19 mock treatment 2447.0 161.0 0.1389 1110.0 -943.92 -0.7647 -0.4425 -0.5694 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H20 mock treatment 1606.0 -680.0 -0.5865 1325.0 -728.92 -0.5905 -0.8323 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H21 compound treatment 22.0 -2264.0 -1.9526 17.0 -2036.9 -1.6501 -2.5475 -0.9965 3214224 Ald3.1-H_000157 ONC(=O)CCCCCC(=O)N/N=C/c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H22 compound treatment 33.0 -2253.0 -1.9431 36.0 -2017.9 -1.6347 -2.5299 -0.9963 3622731 Ald3.1-H_000158 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H23 compound treatment 61.0 -2225.0 -1.919 49.0 -2004.9 -1.6242 -2.5054 -0.9966 3622733 Ald3.1-H_000159 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 H24 compound treatment 963.0 -1323.0 -1.141 1041.0 -1012.9 -0.8206 -1.3871 -0.9869 1009816 Ald3.1-H_000160 O=Cc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I01 compound treatment 3318.0 1032.0 0.8901 3611.0 1557.1 1.2614 1.5213 0.9854 3622735 Ald3.1-H_000161 ONC(=O)CCCCC(=O)N/N=C/c1ccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I02 compound treatment 161.0 -2125.0 -1.8327 6.0 -2047.9 -1.659 -2.4691 -0.9988 3622737 Ald3.1-H_000162 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I03 compound treatment 3628.0 1342.0 1.1574 2538.0 484.08 0.3922 1.0957 0.8966 3622739 Ald3.1-H_000163 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I04 compound treatment 166.0 -2120.0 -1.8284 4.0 -2049.9 -1.6607 -2.4672 -0.9988 3622741 Ald3.1-H_000164 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I05 mock treatment 4017.0 1731.0 1.4929 3683.0 1629.1 1.3197 1.9888 0.9981 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I06 mock treatment 2410.0 124.0 0.1069 2919.0 865.08 0.7008 0.5712 0.8057 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I07 compound treatment 2545.0 259.0 0.2234 2336.0 282.08 0.2285 0.3195 0.9999 3622743 Ald3.1-H_000165 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I08 compound treatment 2575.0 289.0 0.2493 2322.0 268.08 0.2172 0.3298 0.9976 3622745 Ald3.1-H_000166 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I09 compound treatment 3002.0 716.0 0.6175 2478.0 424.08 0.3436 0.6796 0.9617 3622747 Ald3.1-H_000167 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I10 compound treatment 2565.0 279.0 0.2406 1279.0 -774.92 -0.6278 -0.2738 -0.4072 3622749 Ald3.1-H_000168 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I11 compound treatment 3015.0 729.0 0.6287 2657.0 603.08 0.4886 0.79 0.9922 3622751 Ald3.1-H_000169 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I12 compound treatment 2521.0 235.0 0.2027 1426.0 -627.92 -0.5087 -0.2164 -0.3952 3622753 Ald3.1-H_000170 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I13 compound treatment 1984.0 -302.0 -0.2605 2253.0 199.08 0.1613 -0.0701 -0.2289 3622755 Ald3.1-H_000171 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I14 compound treatment 2470.0 184.0 0.1587 2213.0 159.08 0.1289 0.2033 0.9947 3622757 Ald3.1-H_000172 OC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I15 compound treatment 1214.0 -1072.0 -0.9246 1094.0 -959.92 -0.7776 -1.2036 -0.9963 3622759 Ald3.1-H_000173 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I16 compound treatment 2664.0 378.0 0.326 1932.0 -121.92 -0.0988 0.1607 0.4717 3622761 Ald3.1-H_000174 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I17 compound treatment 1651.0 -635.0 -0.5477 1128.0 -925.92 -0.7501 -0.9177 -0.9881 3622763 Ald3.1-H_000175 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I18 compound treatment 2574.0 288.0 0.2484 1594.0 -459.92 -0.3726 -0.0878 -0.1961 3622765 Ald3.1-H_000176 CC(=O)N/N=C/c1ccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I19 compound treatment 100.0 -2186.0 -1.8853 31.0 -2022.9 -1.6388 -2.4919 -0.9976 3622767 Ald3.1-H_000177 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I20 compound treatment 2279.0 -7.0 -0.006 985.0 -1068.9 -0.8659 -0.6166 -0.712 3622769 Ald3.1-H_000178 O=Cc1ccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I21 mock treatment 2661.0 375.0 0.3234 1754.0 -299.92 -0.243 0.0569 0.1406 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I22 mock treatment 1931.0 -355.0 -0.3062 914.0 -1139.9 -0.9235 -0.8695 -0.8937 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I23 compound treatment 378.0 -1908.0 -1.6456 330.0 -1723.9 -1.3966 -2.1511 -0.9967 3622771 Ald3.1-H_000179 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 I24 compound treatment 2.0 -2284.0 -1.9699 2.0 -2051.9 -1.6623 -2.5683 -0.9964 3622773 Ald3.1-H_000180 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccc(CN3[C@@H]4CCCC[C@H]4OC(=O)CC/C=C/CCC3=O)cc2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J01 compound treatment 1414.0 -872.0 -0.7521 2129.0 75.081 0.0608 -0.4888 -0.6478 3215196 Ald3.1-H_000181 ONC(=O)CCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J02 compound treatment 472.0 -1814.0 -1.5645 7.0 -2046.9 -1.6582 -2.2788 -0.9996 3622775 Ald3.1-H_000182 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J03 compound treatment 871.0 -1415.0 -1.2204 196.0 -1857.9 -1.5051 -1.9272 -0.9946 3214586 Ald3.1-H_000183 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J04 compound treatment 1423.0 -863.0 -0.7443 98.0 -1955.9 -1.5845 -1.6467 -0.9407 3622777 Ald3.1-H_000184 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J05 mock treatment 1956.0 -330.0 -0.2846 2504.0 450.08 0.3646 0.0566 0.1223 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J06 mock treatment 2077.0 -209.0 -0.1803 2302.0 248.08 0.201 0.0147 0.0543 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J07 compound treatment 2520.0 234.0 0.2018 1168.0 -885.92 -0.7177 -0.3648 -0.4893 3553510 Ald3.1-H_000185 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J08 compound treatment 1941.0 -345.0 -0.2975 1698.0 -355.92 -0.2883 -0.4143 -0.9999 3622779 Ald3.1-H_000186 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J09 compound treatment 1121.0 -1165.0 -1.0048 1425.0 -628.92 -0.5095 -1.0707 -0.9505 3554094 Ald3.1-H_000187 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J10 compound treatment 894.0 -1392.0 -1.2005 912.0 -1141.9 -0.9251 -1.503 -0.9917 3214584 Ald3.1-H_000188 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J11 compound treatment 1510.0 -776.0 -0.6693 815.0 -1238.9 -1.0037 -1.1829 -0.9806 3622781 Ald3.1-H_000189 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J12 compound treatment 1710.0 -576.0 -0.4968 1341.0 -712.92 -0.5775 -0.7597 -0.9972 3213428 Ald3.1-H_000190 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J13 compound treatment 1570.0 -716.0 -0.6175 967.0 -1086.9 -0.8805 -1.0593 -0.9849 3622783 Ald3.1-H_000191 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J14 compound treatment 2223.0 -63.0 -0.0543 2021.0 -32.919 -0.0267 -0.0573 -0.9463 3214038 Ald3.1-H_000192 OC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J15 compound treatment 2157.0 -129.0 -0.1113 1761.0 -292.92 -0.2373 -0.2465 -0.9404 3622785 Ald3.1-H_000193 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J16 compound treatment 2228.0 -58.0 -0.05 2172.0 118.08 0.0957 0.0323 0.2989 3214040 Ald3.1-H_000194 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J17 compound treatment 746.0 -1540.0 -1.3282 813.0 -1240.9 -1.0053 -1.65 -0.9906 3622787 Ald3.1-H_000195 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J18 compound treatment 2196.0 -90.0 -0.0776 1713.0 -340.92 -0.2762 -0.2502 -0.8721 3622789 Ald3.1-H_000196 CC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J19 compound treatment 1309.0 -977.0 -0.8426 977.0 -1076.9 -0.8724 -1.2127 -0.9998 3622791 Ald3.1-H_000197 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J20 compound treatment 1210.0 -1076.0 -0.928 1180.0 -873.92 -0.708 -1.1568 -0.9911 1073512 Ald3.1-H_000198 O=Cc1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J21 mock treatment 1787.0 -499.0 -0.4304 1619.0 -434.92 -0.3523 -0.5535 -0.9951 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J22 mock treatment 1547.0 -739.0 -0.6374 1463.0 -590.92 -0.4787 -0.7892 -0.99 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J23 compound treatment 113.0 -2173.0 -1.8741 102.0 -1951.9 -1.5813 -2.4433 -0.9964 3213430 Ald3.1-H_000199 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)N(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 J24 compound treatment 322.0 -1964.0 -1.6939 381.0 -1672.9 -1.3553 -2.1561 -0.9939 3622793 Ald3.1-H_000200 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K01 compound treatment 3254.0 968.0 0.8349 3370.0 1316.1 1.0662 1.3442 0.9927 3622795 Ald3.1-H_000201 ONC(=O)CCCCC(=O)N/N=C/c1ccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K02 compound treatment 241.0 -2045.0 -1.7637 1.0 -2052.9 -1.6631 -2.4231 -0.9996 3622797 Ald3.1-H_000202 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K03 compound treatment 3558.0 1272.0 1.097 3687.0 1633.1 1.323 1.7112 0.9957 3622799 Ald3.1-H_000203 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K04 compound treatment 190.0 -2096.0 -1.8077 2.0 -2051.9 -1.6623 -2.4537 -0.9991 3622801 Ald3.1-H_000204 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K05 compound treatment 1858.0 -428.0 -0.3691 1015.0 -1038.9 -0.8416 -0.8561 -0.9316 3622803 Ald3.1-H_000205 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K06 compound treatment 116.0 -2170.0 -1.8715 0.0 -2053.9 -1.6639 -2.4999 -0.9983 3622805 Ald3.1-H_000206 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K07 mock treatment 2910.0 624.0 0.5382 3012.0 958.08 0.7762 0.9294 0.984 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K08 mock treatment 2921.0 635.0 0.5477 3444.0 1390.1 1.1261 1.1835 0.9451 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K09 compound treatment 3044.0 758.0 0.6537 2815.0 761.08 0.6166 0.8982 0.9996 3622807 Ald3.1-H_000207 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K10 compound treatment 2482.0 196.0 0.169 1234.0 -819.92 -0.6642 -0.3501 -0.5109 3622809 Ald3.1-H_000208 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K11 compound treatment 3085.0 799.0 0.6891 2859.0 805.08 0.6522 0.9485 0.9996 3622811 Ald3.1-H_000209 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K12 compound treatment 2272.0 -14.0 -0.0121 1821.0 -232.92 -0.1887 -0.142 -0.7508 3622813 Ald3.1-H_000210 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K13 compound treatment 4482.0 2196.0 1.894 2017.0 -36.919 -0.0299 1.3181 0.6959 3622815 Ald3.1-H_000211 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K14 compound treatment 2731.0 445.0 0.3838 2844.0 790.08 0.6401 0.724 0.9701 3622817 Ald3.1-H_000212 OC(=O)CCCCCC(=O)N/N=C/c1ccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K15 mock treatment 3404.0 1118.0 0.9642 3312.0 1258.1 1.0192 1.4025 0.9996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K16 mock treatment 2966.0 680.0 0.5865 2619.0 565.08 0.4578 0.7384 0.9925 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K17 compound treatment 2798.0 512.0 0.4416 2374.0 320.08 0.2593 0.4956 0.9678 3622819 Ald3.1-H_000213 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K18 compound treatment 3456.0 1170.0 1.0091 1992.0 -61.919 -0.0502 0.6781 0.6711 3622821 Ald3.1-H_000214 CC(=O)N/N=C/c1ccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K19 compound treatment 337.0 -1949.0 -1.6809 47.0 -2006.9 -1.6258 -2.3382 -0.9999 3622823 Ald3.1-H_000215 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K20 compound treatment 2573.0 287.0 0.2475 1404.0 -649.92 -0.5265 -0.1973 -0.3391 3622825 Ald3.1-H_000216 O=Cc1ccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K21 compound treatment 1514.0 -772.0 -0.6658 1852.0 -201.92 -0.1636 -0.5865 -0.8554 3622827 Ald3.1-H_000217 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K22 compound treatment 2528.0 242.0 0.2087 1682.0 -371.92 -0.3013 -0.0655 -0.1786 3622829 Ald3.1-H_000218 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K23 mock treatment 2518.0 232.0 0.2001 1463.0 -590.92 -0.4787 -0.197 -0.3797 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 K24 mock treatment 1670.0 -616.0 -0.5313 659.0 -1394.9 -1.13 -1.1747 -0.9408 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L01 compound treatment 1966.0 -320.0 -0.276 1128.0 -925.92 -0.7501 -0.7256 -0.9078 3622831 Ald3.1-H_000219 ONC(=O)CCCCC(=O)N/N=C/c1ccc(OCC#C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L02 compound treatment 134.0 -2152.0 -1.856 87.0 -1966.9 -1.5934 -2.4391 -0.9971 3622833 Ald3.1-H_000220 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L03 compound treatment 233.0 -2053.0 -1.7706 97.0 -1956.9 -1.5853 -2.373 -0.9985 3622835 Ald3.1-H_000221 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(OCC#C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L04 compound treatment 295.0 -1991.0 -1.7172 22.0 -2031.9 -1.6461 -2.3782 -0.9998 3622837 Ald3.1-H_000222 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L05 compound treatment 46.0 -2240.0 -1.9319 2.0 -2051.9 -1.6623 -2.5415 -0.9972 3622839 Ald3.1-H_000223 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(OCC#C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L06 compound treatment 2866.0 580.0 0.5002 31.0 -2022.9 -1.6388 -0.8051 -0.4699 3622841 Ald3.1-H_000224 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccc(OCC#C)cc2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L07 mock treatment 2823.0 537.0 0.4631 3387.0 1333.1 1.0799 1.0911 0.9286 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L08 mock treatment 2613.0 327.0 0.282 2498.0 444.08 0.3598 0.4538 0.9927 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L09 compound treatment 3760.0 1474.0 1.2713 1766.0 -287.92 -0.2332 0.734 0.5679 3554221 Ald3.1-H_000225 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L10 compound treatment 1882.0 -404.0 -0.3484 818.0 -1235.9 -1.0012 -0.9544 -0.9002 3622843 Ald3.1-H_000226 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L11 compound treatment 2286.0 0.0 0.0 1092.0 -961.92 -0.7793 -0.551 -0.7071 3622845 Ald3.1-H_000227 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L12 compound treatment 1822.0 -464.0 -0.4002 1135.0 -918.92 -0.7444 -0.8094 -0.9576 3622847 Ald3.1-H_000228 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L13 compound treatment 2443.0 157.0 0.1354 1566.0 -487.92 -0.3953 -0.1838 -0.4398 3622849 Ald3.1-H_000229 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L14 compound treatment 2947.0 661.0 0.5701 1273.0 -780.92 -0.6326 -0.0442 -0.0519 3622851 Ald3.1-H_000230 OC(=O)CCCCCC(=O)N/N=C/c1ccc(OCC#C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L15 mock treatment 2792.0 506.0 0.4364 1490.0 -563.92 -0.4568 -0.0144 -0.0229 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L16 mock treatment 2824.0 538.0 0.464 1671.0 -382.92 -0.3102 0.1087 0.1948 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L17 compound treatment 2117.0 -169.0 -0.1458 1207.0 -846.92 -0.6861 -0.5882 -0.8386 3622853 Ald3.1-H_000231 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L18 compound treatment 2444.0 158.0 0.1363 1511.0 -542.92 -0.4398 -0.2146 -0.4662 3622855 Ald3.1-H_000232 CC(=O)N/N=C/c1ccc(OCC#C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L19 compound treatment 46.0 -2240.0 -1.9319 18.0 -2035.9 -1.6493 -2.5323 -0.9969 3622857 Ald3.1-H_000233 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L20 compound treatment 2671.0 385.0 0.332 1306.0 -747.92 -0.6059 -0.1936 -0.2803 3622859 Ald3.1-H_000234 O=Cc1ccc(OCC#C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L21 compound treatment 1907.0 -379.0 -0.3269 1064.0 -989.92 -0.8019 -0.7982 -0.9217 3553658 Ald3.1-H_000235 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L22 compound treatment 1337.0 -949.0 -0.8185 577.0 -1476.9 -1.1965 -1.4248 -0.9829 3622860 Ald3.1-H_000236 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L23 mock treatment 1926.0 -360.0 -0.3105 986.0 -1067.9 -0.8651 -0.8313 -0.9044 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 L24 mock treatment 1582.0 -704.0 -0.6072 705.0 -1348.9 -1.0928 -1.202 -0.9615 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M01 compound treatment 1752.0 -534.0 -0.4606 1081.0 -972.92 -0.7882 -0.883 -0.9673 3622862 Ald3.1-H_000237 ONC(=O)CCCCC(=O)N/N=C/c1cccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M02 compound treatment 97.0 -2189.0 -1.8879 22.0 -2031.9 -1.6461 -2.4989 -0.9977 3622864 Ald3.1-H_000238 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M03 compound treatment 2652.0 366.0 0.3157 925.0 -1128.9 -0.9146 -0.4235 -0.4377 3622866 Ald3.1-H_000239 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M04 compound treatment 2212.0 -74.0 -0.0638 16.0 -2037.9 -1.6509 -1.2125 -0.7339 3622868 Ald3.1-H_000240 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M05 compound treatment 634.0 -1652.0 -1.4248 10.0 -2043.9 -1.6558 -2.1783 -0.9972 3622870 Ald3.1-H_000241 ONC(=O)CCCCCCC(=O)N/N=C/c1cccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M06 compound treatment 42.0 -2244.0 -1.9354 0.0 -2053.9 -1.6639 -2.5451 -0.9972 3622872 Ald3.1-H_000242 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M07 compound treatment 2028.0 -258.0 -0.2225 1898.0 -155.92 -0.1263 -0.2467 -0.964 3622874 Ald3.1-H_000243 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M08 compound treatment 1706.0 -580.0 -0.5002 1648.0 -405.92 -0.3288 -0.5862 -0.9793 3622876 Ald3.1-H_000244 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M09 mock treatment 3486.0 1200.0 1.035 2851.0 797.08 0.6457 1.1884 0.9742 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M10 mock treatment 2190.0 -96.0 -0.0828 2281.0 227.08 0.184 0.0715 0.3546 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M11 compound treatment 1678.0 -608.0 -0.5244 1693.0 -360.92 -0.2924 -0.5775 -0.9619 3622878 Ald3.1-H_000245 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M12 compound treatment 1783.0 -503.0 -0.4338 1536.0 -517.92 -0.4196 -0.6034 -0.9999 3622880 Ald3.1-H_000246 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M13 mock treatment 2592.0 306.0 0.2639 2388.0 334.08 0.2706 0.378 0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M14 mock treatment 2013.0 -273.0 -0.2355 2153.0 99.081 0.0803 -0.1097 -0.4411 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M15 compound treatment 1651.0 -635.0 -0.5477 1289.0 -764.92 -0.6197 -0.8254 -0.9981 3622882 Ald3.1-H_000247 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M16 compound treatment 2515.0 229.0 0.1975 2063.0 9.0806 0.0074 0.1449 0.7329 3622884 Ald3.1-H_000248 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M17 compound treatment 2025.0 -261.0 -0.2251 1265.0 -788.92 -0.6391 -0.6111 -0.9019 3622886 Ald3.1-H_000249 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M18 compound treatment 2173.0 -113.0 -0.0975 1566.0 -487.92 -0.3953 -0.3484 -0.8558 3622888 Ald3.1-H_000250 CC(=O)N/N=C/c1cccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M19 compound treatment 2235.0 -51.0 -0.044 1412.0 -641.92 -0.52 -0.3988 -0.7642 3622890 Ald3.1-H_000251 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M20 compound treatment 1572.0 -714.0 -0.6158 793.0 -1260.9 -1.0215 -1.1577 -0.9706 3622892 Ald3.1-H_000252 O=Cc1cccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M21 compound treatment 366.0 -1920.0 -1.6559 147.0 -1906.9 -1.5448 -2.2633 -0.9994 3622894 Ald3.1-H_000253 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(CN3[C@H]4CCC[C@@H]4OC(=O)CC/C=C/CCC3=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M22 compound treatment 1844.0 -442.0 -0.3812 978.0 -1075.9 -0.8716 -0.8859 -0.9312 3622896 Ald3.1-H_000254 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(CN2[C@H]3CCC[C@@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M23 compound treatment 1173.0 -1113.0 -0.9599 339.0 -1714.9 -1.3893 -1.6611 -0.9837 3622898 Ald3.1-H_000255 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 M24 compound treatment 1231.0 -1055.0 -0.9099 1030.0 -1023.9 -0.8295 -1.2299 -0.9989 3622900 Ald3.1-H_000256 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N01 compound treatment 2679.0 393.0 0.3389 3772.0 1718.1 1.3918 1.2239 0.8543 3622902 Ald3.1-H_000257 ONC(=O)CCCCC(=O)N/N=C/c1ccc(cc1)c2ccc(\C=N\NC(=O)CCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N02 compound treatment 2368.0 82.0 0.0707 568.0 -1485.9 -1.2038 -0.8012 -0.6644 3622904 Ald3.1-H_000258 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4ccc(OCCCCCCC(=O)NO)cc4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N03 compound treatment 226.0 -2060.0 -1.7767 301.0 -1752.9 -1.4201 -2.2604 -0.9938 3622906 Ald3.1-H_000259 ONC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)c2ccc(\C=N\NC(=O)CCCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N04 compound treatment 2594.0 308.0 0.2656 348.0 -1705.9 -1.382 -0.7894 -0.5609 3622908 Ald3.1-H_000260 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4ccc(OCCCCCCC(=O)NO)c(OC)c4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N05 compound treatment 1677.0 -609.0 -0.5252 548.0 -1505.9 -1.22 -1.234 -0.9291 3622910 Ald3.1-H_000261 ONC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)c2ccc(\C=N\NC(=O)CCCCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N06 compound treatment 2762.0 476.0 0.4105 1285.0 -768.92 -0.6229 -0.1502 -0.2013 3622912 Ald3.1-H_000262 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4ccc(OCCCCCCC(=O)NO)c5ccccc45)cc3)c6ccccc16 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N07 compound treatment 3317.0 1031.0 0.8892 2486.0 432.08 0.35 0.8763 0.917 3622914 Ald3.1-H_000263 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4cccc(c4)C(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N08 compound treatment 2355.0 69.0 0.0595 2954.0 900.08 0.7292 0.5577 0.7623 3622916 Ald3.1-H_000264 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)CCCCC(=O)Nc4ccccc4O)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N09 mock treatment 3228.0 942.0 0.8124 2600.0 546.08 0.4424 0.8873 0.9592 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N10 mock treatment 2259.0 -27.0 -0.0233 1834.0 -219.92 -0.1782 -0.1424 -0.7928 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N11 compound treatment 3022.0 736.0 0.6348 2419.0 365.08 0.2958 0.658 0.9396 3622918 Ald3.1-H_000265 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4cccc(OCC(=O)NO)c4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N12 compound treatment 2482.0 196.0 0.169 2764.0 710.08 0.5752 0.5263 0.8778 3622920 Ald3.1-H_000266 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)CCCCCCC(=O)Nc4ccccc4O)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N13 mock treatment 2184.0 -102.0 -0.088 2346.0 292.08 0.2366 0.1051 0.4164 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N14 mock treatment 2516.0 230.0 0.1984 2423.0 369.08 0.299 0.3517 0.9801 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N15 compound treatment 280.0 -2006.0 -1.7301 293.0 -1760.9 -1.4265 -2.2321 -0.9954 3622922 Ald3.1-H_000267 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4cccc(OCCCCCC(=O)NO)c4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N16 compound treatment 2687.0 401.0 0.3458 2092.0 38.081 0.0308 0.2664 0.7671 3622924 Ald3.1-H_000268 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(cc1)c2ccc(\C=N\NC(=O)CCCCCCC(=O)O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N17 compound treatment 2848.0 562.0 0.4847 1851.0 -202.92 -0.1644 0.2265 0.4425 3622926 Ald3.1-H_000269 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4ccc(OCCCCCC(=O)NO)cc4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N18 compound treatment 2588.0 302.0 0.2605 1766.0 -287.92 -0.2332 0.0192 0.055 3622928 Ald3.1-H_000270 CC(=O)N/N=C/c1ccc(cc1)c2ccc(\C=N\NC(=O)C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N19 compound treatment 2439.0 153.0 0.132 1113.0 -940.92 -0.7623 -0.4457 -0.5761 3622930 Ald3.1-H_000271 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4cccc(OCCCCCCC(=O)NO)c4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N20 compound treatment 2109.0 -177.0 -0.1527 1127.0 -926.92 -0.7509 -0.6389 -0.8338 3622932 Ald3.1-H_000272 O=Cc1ccc(cc1)c2ccc(C=O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N21 compound treatment 164.0 -2122.0 -1.8301 169.0 -1884.9 -1.527 -2.3739 -0.9959 3622933 Ald3.1-H_000273 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N22 compound treatment 954.0 -1332.0 -1.1488 1034.0 -1019.9 -0.8263 -1.3966 -0.9869 3622935 Ald3.1-H_000274 OC(=O)CCCCCCC(=O)N/N=C/c1ccc(OCC#C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N23 compound treatment 2732.0 446.0 0.3847 985.0 -1068.9 -0.8659 -0.3403 -0.3592 3622937 Ald3.1-H_000275 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4ccc(cc4)C(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 N24 compound treatment 1372.0 -914.0 -0.7883 543.0 -1510.9 -1.224 -1.4229 -0.9774 3622939 Ald3.1-H_000276 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)CCCCCC(=O)Nc4ccccc4O)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O01 compound treatment 2270.0 -16.0 -0.0138 1408.0 -645.92 -0.5233 -0.3798 -0.7255 3622941 Ald3.1-H_000277 ONC(=O)CCCCC(=O)N/N=C/c1cccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O02 compound treatment 1817.0 -469.0 -0.4045 27.0 -2026.9 -1.642 -1.4471 -0.8557 3622942 Ald3.1-H_000278 ONC(=O)CCCCCCOc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O03 compound treatment 2668.0 382.0 0.3295 1003.0 -1050.9 -0.8514 -0.369 -0.4043 3622943 Ald3.1-H_000279 ONC(=O)CCCCCC(=O)N/N=C/c1cccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O04 compound treatment 547.0 -1739.0 -1.4998 22.0 -2031.9 -1.6461 -2.2245 -0.9989 3622944 Ald3.1-H_000280 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O05 compound treatment 1892.0 -394.0 -0.3398 76.0 -1977.9 -1.6023 -1.3733 -0.8384 3622945 Ald3.1-H_000281 ONC(=O)CCCCCCC(=O)N/N=C/c1cccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O06 compound treatment 278.0 -2008.0 -1.7318 1.0 -2052.9 -1.6631 -2.4006 -0.9998 3622946 Ald3.1-H_000282 ONC(=O)CCCCCCOc1ccc(C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O07 compound treatment 3107.0 821.0 0.7081 2642.0 588.08 0.4764 0.8376 0.9814 3622947 Ald3.1-H_000283 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O08 compound treatment 2083.0 -203.0 -0.1751 1630.0 -423.92 -0.3434 -0.3666 -0.9511 3622948 Ald3.1-H_000284 Oc1ccccc1NC(=O)CCCCC(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O09 compound treatment 1634.0 -652.0 -0.5623 1048.0 -1005.9 -0.8149 -0.9739 -0.9836 3622949 Ald3.1-H_000285 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O10 compound treatment 1922.0 -364.0 -0.3139 1140.0 -913.92 -0.7404 -0.7455 -0.927 3622950 Ald3.1-H_000286 Oc1ccccc1NC(=O)CCCCCC(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O11 mock treatment 2741.0 455.0 0.3924 1710.0 -343.92 -0.2786 0.0805 0.1672 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O12 mock treatment 2196.0 -90.0 -0.0776 1682.0 -371.92 -0.3013 -0.2679 -0.8612 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O13 compound treatment 1888.0 -398.0 -0.3433 690.0 -1363.9 -1.1049 -1.024 -0.8851 3622951 Ald3.1-H_000287 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O14 compound treatment 1733.0 -553.0 -0.4769 1112.0 -941.92 -0.7631 -0.8768 -0.9744 3622953 Ald3.1-H_000288 OC(=O)CCCCCC(=O)N/N=C/c1cccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O15 compound treatment 1305.0 -981.0 -0.8461 616.0 -1437.9 -1.1649 -1.422 -0.9877 3622955 Ald3.1-H_000289 ONC(=O)CCCCCOc1cccc(c1)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O16 compound treatment 1772.0 -514.0 -0.4433 1429.0 -624.92 -0.5063 -0.6714 -0.9978 3622956 Ald3.1-H_000290 OC(=O)CCCCCCC(=O)N/N=C/c1cccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O17 compound treatment 312.0 -1974.0 -1.7025 145.0 -1908.9 -1.5464 -2.2973 -0.9988 3622957 Ald3.1-H_000291 ONC(=O)CCCCCOc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O18 compound treatment 1784.0 -502.0 -0.433 1548.0 -505.92 -0.4099 -0.596 -0.9996 3622958 Ald3.1-H_000292 CC(=O)N/N=C/c1cccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O19 compound treatment 237.0 -2049.0 -1.7672 181.0 -1872.9 -1.5173 -2.3225 -0.9971 3622959 Ald3.1-H_000293 ONC(=O)CCCCCCOc1cccc(c1)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O20 compound treatment 1536.0 -750.0 -0.6468 882.0 -1171.9 -0.9494 -1.1287 -0.9825 3622960 Ald3.1-H_000294 O=Cc1cccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O21 compound treatment 1364.0 -922.0 -0.7952 692.0 -1361.9 -1.1033 -1.3424 -0.9871 3622961 Ald3.1-H_000295 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2cccc(CN3C[C@@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O22 compound treatment 1414.0 -872.0 -0.7521 892.0 -1161.9 -0.9413 -1.1974 -0.9938 3622962 Ald3.1-H_000296 OC(=O)CCCCCC(=O)N/N=C/c1cccc(CN2C[C@@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O23 compound treatment 1145.0 -1141.0 -0.9841 397.0 -1656.9 -1.3423 -1.645 -0.9884 3622963 Ald3.1-H_000297 ONC(=O)COc1cccc(c1)C(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 O24 compound treatment 927.0 -1359.0 -1.1721 337.0 -1716.9 -1.3909 -1.8123 -0.9964 3622964 Ald3.1-H_000298 Oc1ccccc1NC(=O)CCCCCCC(=O)N/N=C/c2cccc(CN3C[C@H](OC(=O)CC/C=C/CCC3=O)c4ccccc4)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P01 compound treatment 2379.0 93.0 0.0802 2973.0 919.08 0.7446 0.5832 0.7788 3214824 Ald3.1-H_000299 NNC(=O)CCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P02 compound treatment 216.0 -2070.0 -1.7853 91.0 -1962.9 -1.5902 -2.3868 -0.9983 3622965 Ald3.1-H_000300 NNC(=O)c1ccc(OCCCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P03 compound treatment 2543.0 257.0 0.2217 2683.0 629.08 0.5096 0.5171 0.9305 3214214 Ald3.1-H_000301 NNC(=O)CCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P04 compound treatment 815.0 -1471.0 -1.2687 140.0 -1913.9 -1.5505 -1.9935 -0.995 3622966 Ald3.1-H_000302 COc1cc(ccc1OCCCCCCC(=O)NO)C(=O)NN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P05 compound treatment 2045.0 -241.0 -0.2079 1323.0 -730.92 -0.5921 -0.5657 -0.9014 3213058 Ald3.1-H_000303 NNC(=O)CCCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P06 compound treatment 1340.0 -946.0 -0.8159 46.0 -2007.9 -1.6266 -1.7271 -0.9491 3622967 Ald3.1-H_000304 NNC(=O)c1ccc(OCCCCCCC(=O)NO)c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P07 compound treatment 2961.0 675.0 0.5822 2631.0 577.08 0.4675 0.7422 0.9941 3551921 Ald3.1-H_000305 NNC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P08 compound treatment 1573.0 -713.0 -0.6149 2003.0 -50.919 -0.0413 -0.464 -0.7528 3622968 Ald3.1-H_000306 NNC(=O)CCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P09 compound treatment 2687.0 401.0 0.3458 2014.0 -39.919 -0.0323 0.2217 0.6382 3551923 Ald3.1-H_000307 NNC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P10 compound treatment 1713.0 -573.0 -0.4942 2238.0 184.08 0.1491 -0.244 -0.4727 3214215 Ald3.1-H_000308 NNC(=O)CCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P11 mock treatment 2725.0 439.0 0.3786 1782.0 -271.92 -0.2203 0.112 0.2556 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P12 mock treatment 2125.0 -161.0 -0.1389 1121.0 -932.92 -0.7558 -0.6326 -0.8232 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P13 compound treatment 2232.0 -54.0 -0.0466 1400.0 -653.92 -0.5297 -0.4075 -0.7663 3622969 Ald3.1-H_000309 NNC(=O)c1ccc(OCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P14 compound treatment 1721.0 -565.0 -0.4873 1901.0 -152.92 -0.1239 -0.4322 -0.8595 3213669 Ald3.1-H_000310 NNC(=O)CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P15 compound treatment 2052.0 -234.0 -0.2018 1122.0 -931.92 -0.755 -0.6765 -0.8657 3622970 Ald3.1-H_000311 NNC(=O)c1cccc(OCCCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P16 compound treatment 2079.0 -207.0 -0.1785 1200.0 -853.92 -0.6918 -0.6154 -0.8614 3213668 Ald3.1-H_000312 NNC(=O)CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P17 compound treatment 1700.0 -586.0 -0.5054 402.0 -1651.9 -1.3382 -1.3037 -0.9113 3622971 Ald3.1-H_000313 NNC(=O)c1ccc(OCCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P18 compound treatment 2372.0 86.0 0.0742 1603.0 -450.92 -0.3653 -0.2059 -0.5523 1003260 Ald3.1-H_000314 CC(=O)NN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P19 compound treatment 417.0 -1869.0 -1.6119 134.0 -1919.9 -1.5554 -2.2396 -0.9998 3622972 Ald3.1-H_000315 NNC(=O)c1cccc(OCCCCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P20 mock treatment 1037.0 -1249.0 -1.0772 608.0 -1445.9 -1.1714 -1.59 -0.9991 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P21 compound treatment 2233.0 -53.0 -0.0457 1108.0 -945.92 -0.7663 -0.5742 -0.748 3622973 Ald3.1-H_000316 ONC(=O)COc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)c3ccc(\C=N\NC(=O)c4ccc(OCC(=O)NO)cc4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P22 compound treatment 2016.0 -270.0 -0.2329 854.0 -1199.9 -0.9721 -0.852 -0.8524 3622975 Ald3.1-H_000317 OC(=O)CCCCCC(=O)N/N=C/c1ccc(cc1)c2ccc(\C=N\NC(=O)CCCCCC(=O)O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P23 compound treatment 1294.0 -992.0 -0.8556 319.0 -1734.9 -1.4055 -1.5988 -0.9717 3622977 Ald3.1-H_000318 NNC(=O)c1cccc(OCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2410 P24 compound treatment 1036.0 -1250.0 -1.0781 461.0 -1592.9 -1.2904 -1.6748 -0.996 3213059 Ald3.1-H_000319 NNC(=O)CCCCCCC(=O)Nc1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A01 compound treatment 1246.0 -1217.2 -1.0498 1973.0 -379.58 -0.3075 -0.9597 -0.8774 3551921 Ald2.1-H_000321 NNC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A02 compound treatment 408.0 -2055.2 -1.7725 489.0 -1863.6 -1.5097 -2.3209 -0.9968 3553354 Ald2.1-H_000322 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2c(O)ccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A03 compound treatment 1079.0 -1384.2 -1.1938 2306.0 -46.581 -0.0377 -0.8708 -0.7291 3552997 Ald2.1-H_000323 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A04 compound treatment 1862.0 -601.17 -0.5185 31.0 -2321.6 -1.8807 -1.6965 -0.8696 3553358 Ald2.1-H_000324 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(O)c3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A05 compound treatment 2698.0 234.83 0.2025 2257.0 -95.581 -0.0774 0.0885 0.408 3553001 Ald2.1-H_000325 COc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A06 compound treatment 1926.0 -537.17 -0.4633 12.0 -2340.6 -1.8961 -1.6684 -0.8547 3553362 Ald2.1-H_000326 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc([N+](=O)[O-])c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A07 compound treatment 2329.0 -134.17 -0.1157 1886.0 -466.58 -0.378 -0.3491 -0.8831 3553005 Ald2.1-H_000327 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A08 compound treatment 1970.0 -493.17 -0.4253 7.0 -2345.6 -1.9002 -1.6444 -0.8445 3553366 Ald2.1-H_000328 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(O)ccc2[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A09 compound treatment 0.0 -2463.2 -2.1244 2336.0 -16.581 -0.0134 -1.5117 -0.7116 3553009 Ald2.1-H_000329 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc3OCCOc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A10 compound treatment 1946.0 -517.17 -0.446 1267.0 -1085.6 -0.8794 -0.9373 -0.9505 3553369 Ald2.1-H_000330 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)n3ccnc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A11 compound treatment 1921.0 -542.17 -0.4676 1638.0 -714.58 -0.5789 -0.74 -0.9944 3553013 Ald2.1-H_000331 ONC(=O)c1cccc(c1)C(=O)N/N=C/COCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A12 compound treatment 1838.0 -625.17 -0.5392 981.0 -1371.6 -1.1111 -1.167 -0.9449 3553372 Ald2.1-H_000332 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2c[nH]c3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A13 mock treatment 2140.0 -323.17 -0.2787 2121.0 -231.58 -0.1876 -0.3297 -0.9814 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A14 mock treatment 866.0 -1597.2 -1.3775 1344.0 -1008.6 -0.8171 -1.5518 -0.9689 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A15 compound treatment 932.0 -1531.2 -1.3206 933.0 -1419.6 -1.15 -1.747 -0.9976 3553017 Ald2.1-H_000333 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A16 compound treatment 1807.0 -656.17 -0.5659 807.0 -1545.6 -1.2521 -1.2855 -0.9356 3553376 Ald2.1-H_000334 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(I)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A17 compound treatment 2499.0 35.828 0.0309 1704.0 -648.58 -0.5254 -0.3497 -0.6644 3553021 Ald2.1-H_000335 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A18 compound treatment 1674.0 -789.17 -0.6806 0.0 -2352.6 -1.9059 -1.8289 -0.9037 3553380 Ald2.1-H_000336 C/C=C(/C)\C=N\NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A19 compound treatment 1727.0 -736.17 -0.6349 2158.0 -194.58 -0.1576 -0.5604 -0.8567 3553025 Ald2.1-H_000337 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A20 compound treatment 533.0 -1930.2 -1.6647 3.0 -2349.6 -1.9034 -2.523 -0.9978 3553384 Ald2.1-H_000338 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(s2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A21 compound treatment 2006.0 -457.17 -0.3943 742.0 -1610.6 -1.3048 -1.2014 -0.8814 3553029 Ald2.1-H_000339 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(Br)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A22 compound treatment 2626.0 162.83 0.1404 4.0 -2348.6 -1.9026 -1.2461 -0.6531 3553388 Ald2.1-H_000340 Cc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A23 compound treatment 528.0 -1935.2 -1.669 356.0 -1996.6 -1.6175 -2.3239 -0.9999 3553033 Ald2.1-H_000341 ONC(=O)c1cccc(c1)C(=O)N/N=C/C(=C/c2ccccc2)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 A24 compound treatment 655.0 -1808.2 -1.5595 493.0 -1859.6 -1.5065 -2.168 -0.9999 3553391 Ald2.1-H_000342 Cc1[nH]cnc1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B01 compound treatment 2225.0 -238.17 -0.2054 1782.0 -570.58 -0.4622 -0.4721 -0.9333 3551923 Ald2.1-H_000343 NNC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B02 compound treatment 526.0 -1937.2 -1.6707 506.0 -1846.6 -1.4959 -2.2392 -0.9985 3553956 Ald2.1-H_000344 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2c(O)ccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B03 compound treatment 1804.0 -659.17 -0.5685 1667.0 -685.58 -0.5554 -0.7947 -0.9999 3553662 Ald2.1-H_000345 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B04 compound treatment 1527.0 -936.17 -0.8074 1443.0 -909.58 -0.7369 -1.092 -0.999 3553960 Ald2.1-H_000346 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(O)c3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B05 compound treatment 1608.0 -855.17 -0.7376 1639.0 -713.58 -0.5781 -0.9303 -0.9927 3553666 Ald2.1-H_000347 COc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B06 compound treatment 1934.0 -529.17 -0.4564 1517.0 -835.58 -0.6769 -0.8014 -0.9816 3553964 Ald2.1-H_000348 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc([N+](=O)[O-])c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B07 compound treatment 2514.0 50.828 0.0438 2164.0 -188.58 -0.1528 -0.077 -0.4846 3553670 Ald2.1-H_000349 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B08 compound treatment 1790.0 -673.17 -0.5806 1046.0 -1306.6 -1.0585 -1.159 -0.96 3553968 Ald2.1-H_000350 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(O)ccc2[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B09 compound treatment 1601.0 -862.17 -0.7436 1999.0 -353.58 -0.2864 -0.7283 -0.914 3553675 Ald2.1-H_000351 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc3OCCOc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B10 compound treatment 2306.0 -157.17 -0.1356 1814.0 -538.58 -0.4363 -0.4044 -0.8851 3553971 Ald2.1-H_000352 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)n3ccnc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B11 compound treatment 1459.0 -1004.2 -0.8661 1816.0 -536.58 -0.4347 -0.9198 -0.9492 3553679 Ald2.1-H_000353 ONC(=O)c1ccc(cc1)C(=O)N/N=C/COCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B12 compound treatment 2265.0 -198.17 -0.1709 1306.0 -1046.6 -0.8478 -0.7204 -0.8329 3553975 Ald2.1-H_000354 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2c[nH]c3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B13 mock treatment 2247.0 -216.17 -0.1864 1995.0 -357.58 -0.2897 -0.3367 -0.9773 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B14 mock treatment 1731.0 -732.17 -0.6315 1856.0 -496.58 -0.4023 -0.731 -0.9763 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B15 compound treatment 390.0 -2073.2 -1.788 315.0 -2037.6 -1.6507 -2.4315 -0.9992 3553682 Ald2.1-H_000355 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B16 compound treatment 1755.0 -708.17 -0.6108 1543.0 -809.58 -0.6559 -0.8956 -0.9994 3553978 Ald2.1-H_000356 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(I)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B17 compound treatment 1531.0 -932.17 -0.804 1768.0 -584.58 -0.4736 -0.9034 -0.9681 3553686 Ald2.1-H_000357 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B18 compound treatment 1592.0 -871.17 -0.7513 1356.0 -996.58 -0.8073 -1.1022 -0.9994 3553981 Ald2.1-H_000358 C/C=C(/C)\C=N\NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B19 compound treatment 1361.0 -1102.2 -0.9506 1355.0 -997.58 -0.8082 -1.2436 -0.9967 3553690 Ald2.1-H_000359 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B20 compound treatment 505.0 -1958.2 -1.6888 624.0 -1728.6 -1.4003 -2.1844 -0.9957 3553985 Ald2.1-H_000360 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(s2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B21 compound treatment 2393.0 -70.172 -0.0605 1387.0 -965.58 -0.7822 -0.5959 -0.7595 3553695 Ald2.1-H_000361 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(Br)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B22 compound treatment 2007.0 -456.17 -0.3934 1170.0 -1182.6 -0.958 -0.9556 -0.9227 3553989 Ald2.1-H_000362 Cc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B23 compound treatment 98.0 -2365.2 -2.0399 17.0 -2335.6 -1.8921 -2.7803 -0.9993 3553699 Ald2.1-H_000363 ONC(=O)c1ccc(cc1)C(=O)N/N=C/C(=C/c2ccccc2)/Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 B24 compound treatment 1316.0 -1147.2 -0.9894 1028.0 -1324.6 -1.0731 -1.4584 -0.9992 3553992 Ald2.1-H_000364 Cc1[nH]cnc1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C01 compound treatment 2087.0 -376.17 -0.3244 1094.0 -1258.6 -1.0196 -0.9504 -0.8882 3553037 Ald2.1-H_000365 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(Br)o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C02 compound treatment 1934.0 -529.17 -0.4564 2134.0 -218.58 -0.1771 -0.4479 -0.915 3553395 Ald2.1-H_000366 Cc1ccsc1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C03 compound treatment 1818.0 -645.17 -0.5564 2248.0 -104.58 -0.0847 -0.4534 -0.8055 3553041 Ald2.1-H_000367 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(O)cc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C04 compound treatment 2373.0 -90.172 -0.0778 3037.0 684.42 0.5545 0.3371 0.602 3553399 Ald2.1-H_000368 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)c3cccc(c3)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C05 compound treatment 2571.0 107.83 0.093 1425.0 -927.58 -0.7514 -0.4656 -0.6149 3553045 Ald2.1-H_000369 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(O)ccc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C06 compound treatment 2061.0 -402.17 -0.3469 1991.0 -361.58 -0.2929 -0.4524 -0.9965 3553403 Ald2.1-H_000370 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C07 compound treatment 2369.0 -94.172 -0.0812 2170.0 -182.58 -0.1479 -0.162 -0.9602 3553049 Ald2.1-H_000371 COc1cc(Br)cc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C08 compound treatment 2292.0 -171.17 -0.1476 2059.0 -293.58 -0.2378 -0.2726 -0.9737 3553407 Ald2.1-H_000372 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc3ccccc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C09 compound treatment 2603.0 139.83 0.1206 2426.0 73.419 0.0595 0.1273 0.9469 3553053 Ald2.1-H_000373 COc1ccc(Br)c(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C10 compound treatment 2945.0 481.83 0.4156 2101.0 -251.58 -0.2038 0.1497 0.3235 3553411 Ald2.1-H_000374 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C11 mock treatment 2513.0 49.828 0.043 2176.0 -176.58 -0.1431 -0.0708 -0.4738 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C12 mock treatment 2381.0 -82.172 -0.0709 2330.0 -22.581 -0.0183 -0.063 -0.8614 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C13 compound treatment 1991.0 -472.17 -0.4072 2326.0 -26.581 -0.0215 -0.3032 -0.7435 3553057 Ald2.1-H_000375 COc1ccc(Br)cc1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C14 compound treatment 2284.0 -179.17 -0.1545 1952.0 -400.58 -0.3245 -0.3387 -0.9424 3553415 Ald2.1-H_000376 COc1cc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C15 mock treatment 2328.0 -135.17 -0.1166 2367.0 14.419 0.0117 -0.0742 -0.6331 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C16 mock treatment 2109.0 -354.17 -0.3055 2161.0 -191.58 -0.1552 -0.3257 -0.9507 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C17 compound treatment 2491.0 27.828 0.024 1768.0 -584.58 -0.4736 -0.3179 -0.6704 3553061 Ald2.1-H_000377 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc3OCOc3cc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C18 compound treatment 1908.0 -555.17 -0.4788 1670.0 -682.58 -0.553 -0.7296 -0.9974 3553419 Ald2.1-H_000378 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2c(F)c(F)c(F)c(F)c2F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C19 compound treatment 2341.0 -122.17 -0.1054 2304.0 -48.581 -0.0394 -0.1023 -0.9098 3553065 Ald2.1-H_000379 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccnc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C20 compound treatment 1927.0 -536.17 -0.4624 1725.0 -627.58 -0.5084 -0.6865 -0.9989 3553423 Ald2.1-H_000380 ONC(=O)c1cccc(c1)C(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C21 compound treatment 1834.0 -629.17 -0.5426 1829.0 -523.58 -0.4242 -0.6836 -0.9926 3553069 Ald2.1-H_000381 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccncc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C22 compound treatment 1835.0 -628.17 -0.5418 1665.0 -687.58 -0.557 -0.777 -0.9999 3553427 Ald2.1-H_000382 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C23 compound treatment 537.0 -1926.2 -1.6612 722.0 -1630.6 -1.321 -2.1087 -0.9936 3553073 Ald2.1-H_000383 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(Br)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 C24 compound treatment 1239.0 -1224.2 -1.0558 1319.0 -1033.6 -0.8373 -1.3386 -0.9934 3553430 Ald2.1-H_000384 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D01 compound treatment 2619.0 155.83 0.1344 2054.0 -298.58 -0.2419 -0.076 -0.2747 3553703 Ald2.1-H_000385 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(Br)o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D02 compound treatment 1509.0 -954.17 -0.8229 1287.0 -1065.6 -0.8632 -1.1923 -0.9997 3553995 Ald2.1-H_000386 Cc1ccsc1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D03 compound treatment 2669.0 205.83 0.1775 2274.0 -78.581 -0.0637 0.0805 0.4269 3553706 Ald2.1-H_000387 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(O)cc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D04 compound treatment 1422.0 -1041.2 -0.898 1398.0 -954.58 -0.7733 -1.1818 -0.9972 3553998 Ald2.1-H_000388 CC1(C)[C@@H]2C[C@H]1C(=CC2)/C=N/NC(=O)c3ccc(cc3)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D05 compound treatment 2666.0 202.83 0.1749 1833.0 -519.58 -0.4209 -0.1739 -0.3816 3553710 Ald2.1-H_000389 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(O)ccc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D06 compound treatment 1941.0 -522.17 -0.4504 1801.0 -551.58 -0.4468 -0.6344 -1.0 3554002 Ald2.1-H_000390 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D07 compound treatment 2926.0 462.83 0.3992 2959.0 606.42 0.4913 0.6296 0.9947 3553714 Ald2.1-H_000391 COc1cc(Br)cc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D08 compound treatment 1919.0 -544.17 -0.4693 2296.0 -56.581 -0.0458 -0.3643 -0.7725 3554006 Ald2.1-H_000392 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc3ccccc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D09 compound treatment 2449.0 -14.172 -0.0122 2045.0 -307.58 -0.2492 -0.1848 -0.7409 3553718 Ald2.1-H_000393 COc1ccc(Br)c(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D10 compound treatment 2154.0 -309.17 -0.2666 1889.0 -463.58 -0.3756 -0.4541 -0.9859 3554009 Ald2.1-H_000394 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D11 mock treatment 2978.0 514.83 0.444 2524.0 171.42 0.1389 0.4122 0.8859 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D12 mock treatment 2971.0 507.83 0.438 2075.0 -277.58 -0.2249 0.1507 0.3061 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D13 compound treatment 2240.0 -223.17 -0.1925 1975.0 -377.58 -0.3059 -0.3524 -0.9751 3553722 Ald2.1-H_000395 COc1ccc(Br)cc1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D14 compound treatment 2184.0 -279.17 -0.2408 2298.0 -54.581 -0.0442 -0.2015 -0.8232 3554013 Ald2.1-H_000396 COc1cc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c(cc1OC)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D15 mock treatment 2175.0 -288.17 -0.2485 2295.0 -57.581 -0.0466 -0.2087 -0.8254 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D16 mock treatment 2233.0 -230.17 -0.1985 1912.0 -440.58 -0.3569 -0.3928 -0.9617 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D17 compound treatment 1745.0 -718.17 -0.6194 1685.0 -667.58 -0.5408 -0.8204 -0.9977 3553726 Ald2.1-H_000397 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc3OCOc3cc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D18 compound treatment 1684.0 -779.17 -0.672 1070.0 -1282.6 -1.039 -1.2099 -0.9778 3554017 Ald2.1-H_000398 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2c(F)c(F)c(F)c(F)c2F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D19 compound treatment 1750.0 -713.17 -0.6151 1502.0 -850.58 -0.6891 -0.9222 -0.9984 3553730 Ald2.1-H_000399 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccnc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D20 compound treatment 1204.0 -1259.2 -1.086 1683.0 -669.58 -0.5424 -1.1515 -0.9486 3554021 Ald2.1-H_000400 ONC(=O)c1ccc(cc1)C(=O)N/N=C/CCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D21 compound treatment 1051.0 -1412.2 -1.2179 1420.0 -932.58 -0.7555 -1.3954 -0.9736 3553734 Ald2.1-H_000401 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccncc2Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D22 compound treatment 1441.0 -1022.2 -0.8816 1120.0 -1232.6 -0.9985 -1.3294 -0.9981 3554025 Ald2.1-H_000402 CC(=C)[C@H]1CCC(=CC1)/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D23 compound treatment 1095.0 -1368.2 -1.18 1023.0 -1329.6 -1.0771 -1.596 -0.999 3553737 Ald2.1-H_000403 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(Br)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 D24 compound treatment 1659.0 -804.17 -0.6936 1280.0 -1072.6 -0.8689 -1.1048 -0.9938 3554029 Ald2.1-H_000404 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E01 mock treatment 2299.0 -164.17 -0.1416 2740.0 387.42 0.3139 0.1218 0.3538 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E02 mock treatment 2195.0 -268.17 -0.2313 2931.0 578.42 0.4686 0.1678 0.3211 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E03 compound treatment 2676.0 212.83 0.1836 3101.0 748.42 0.6063 0.5585 0.8817 3553077 Ald2.1-H_000405 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(Br)s2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E04 compound treatment 2852.0 388.83 0.3353 2105.0 -247.58 -0.2006 0.0953 0.2439 3553434 Ald2.1-H_000406 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cn(c3ccccc23)S(=O)(=O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E05 compound treatment 3210.0 746.83 0.6441 2844.0 491.42 0.3981 0.737 0.9733 3553081 Ald2.1-H_000407 COc1cc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E06 compound treatment 2498.0 34.828 0.03 2822.0 469.42 0.3803 0.2901 0.7606 3553438 Ald2.1-H_000408 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E07 compound treatment 446.0 -2017.2 -1.7397 395.0 -1957.6 -1.5859 -2.3515 -0.9989 3553084 Ald2.1-H_000409 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E08 compound treatment 2373.0 -90.172 -0.0778 2619.0 266.42 0.2158 0.0976 0.4255 3553442 Ald2.1-H_000410 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E09 mock treatment 2316.0 -147.17 -0.1269 2900.0 547.42 0.4435 0.2238 0.4852 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E10 mock treatment 3469.0 1005.8 0.8675 2559.0 206.42 0.1672 0.7316 0.8282 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E11 compound treatment 3142.0 678.83 0.5855 2903.0 550.42 0.4459 0.7293 0.991 3553088 Ald2.1-H_000411 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E12 compound treatment 2740.0 276.83 0.2388 2482.0 129.42 0.1048 0.243 0.9317 3553446 Ald2.1-H_000412 Cc1ncc(CO)c(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E13 compound treatment 2479.0 15.828 0.0137 2632.0 279.42 0.2264 0.1697 0.7484 3553092 Ald2.1-H_000413 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E14 compound treatment 2299.0 -164.17 -0.1416 2110.0 -242.58 -0.1965 -0.2391 -0.9871 3553450 Ald2.1-H_000414 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc[nH]2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E15 compound treatment 2669.0 205.83 0.1775 2406.0 53.419 0.0433 0.1561 0.8545 3553096 Ald2.1-H_000415 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E16 compound treatment 1655.0 -808.17 -0.697 1797.0 -555.58 -0.4501 -0.8111 -0.9776 3553454 Ald2.1-H_000416 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)N3CCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E17 mock treatment 2900.0 436.83 0.3767 2394.0 41.419 0.0336 0.2901 0.767 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E18 mock treatment 2034.0 -429.17 -0.3701 1371.0 -981.58 -0.7952 -0.824 -0.9395 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E19 compound treatment 1956.0 -507.17 -0.4374 1416.0 -936.58 -0.7587 -0.8458 -0.9658 3553100 Ald2.1-H_000417 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(c2)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E20 compound treatment 1278.0 -1185.2 -1.0222 1447.0 -905.58 -0.7336 -1.2415 -0.9868 3553458 Ald2.1-H_000418 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E21 compound treatment 1604.0 -859.17 -0.741 1655.0 -697.58 -0.5651 -0.9236 -0.9911 3553104 Ald2.1-H_000419 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E22 compound treatment 1711.0 -752.17 -0.6487 1333.0 -1019.6 -0.826 -1.0428 -0.9929 3553462 Ald2.1-H_000420 CCCCCCC/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E23 compound treatment 1404.0 -1059.2 -0.9135 617.0 -1735.6 -1.406 -1.6401 -0.9782 3553108 Ald2.1-H_000421 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 E24 compound treatment 1493.0 -970.17 -0.8367 870.0 -1482.6 -1.2011 -1.4409 -0.9844 3553466 Ald2.1-H_000422 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2nccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F01 mock treatment 1987.0 -476.17 -0.4107 2617.0 264.42 0.2142 -0.1389 -0.2999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F02 mock treatment 2314.0 -149.17 -0.1287 2215.0 -137.58 -0.1115 -0.1698 -0.9974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F03 compound treatment 1400.0 -1063.2 -0.9169 2507.0 154.42 0.1251 -0.5599 -0.605 3553741 Ald2.1-H_000423 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(Br)s2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F04 compound treatment 2047.0 -416.17 -0.3589 1744.0 -608.58 -0.493 -0.6024 -0.9878 3554032 Ald2.1-H_000424 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cn(c3ccccc23)S(=O)(=O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F05 compound treatment 2284.0 -179.17 -0.1545 2547.0 194.42 0.1575 0.0021 0.0095 3553745 Ald2.1-H_000425 COc1cc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c(Br)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F06 compound treatment 2371.0 -92.172 -0.0795 2512.0 159.42 0.1291 0.0351 0.2315 3554034 Ald2.1-H_000426 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F07 compound treatment 105.0 -2358.2 -2.0338 304.0 -2048.6 -1.6596 -2.6116 -0.9949 3553748 Ald2.1-H_000427 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F08 compound treatment 2321.0 -142.17 -0.1226 2587.0 234.42 0.1899 0.0476 0.2105 3554036 Ald2.1-H_000428 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F09 mock treatment 2606.0 142.83 0.1232 4617.0 2264.4 1.8344 1.3842 0.7529 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F10 mock treatment 1836.0 -627.17 -0.5409 2738.0 385.42 0.3122 -0.1617 -0.2589 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F11 compound treatment 2564.0 100.83 0.087 2037.0 -315.58 -0.2557 -0.1193 -0.4417 3553752 Ald2.1-H_000429 CC(C)(C)OC(=O)NC1(CCCC1)/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F12 compound treatment 2338.0 -125.17 -0.108 2638.0 285.42 0.2312 0.0872 0.3416 3554038 Ald2.1-H_000430 Cc1ncc(CO)c(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F13 compound treatment 2628.0 164.83 0.1422 2470.0 117.42 0.0951 0.1678 0.9809 3553756 Ald2.1-H_000431 CC(C)(C)OC(=O)N1CCC[C@H]1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F14 compound treatment 1.0 -2462.2 -2.1235 2597.0 244.42 0.198 -1.3615 -0.6384 3554040 Ald2.1-H_000432 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc[nH]2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F15 compound treatment 1342.0 -1121.2 -0.967 2464.0 111.42 0.0903 -0.6199 -0.6383 3553759 Ald2.1-H_000433 CC(C)(C)OC(=O)Nc1cccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F16 compound treatment 1627.0 -836.17 -0.7212 990.0 -1362.6 -1.1038 -1.2905 -0.9787 3554042 Ald2.1-H_000434 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)N3CCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F17 mock treatment 1676.0 -787.17 -0.6789 2618.0 265.42 0.215 -0.328 -0.4606 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F18 mock treatment 1938.0 -525.17 -0.4529 2513.0 160.42 0.13 -0.2284 -0.4847 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F19 compound treatment 1110.0 -1353.2 -1.1671 1775.0 -577.58 -0.4679 -1.1561 -0.9195 3553763 Ald2.1-H_000435 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(c2)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F20 compound treatment 1337.0 -1126.2 -0.9713 1125.0 -1227.6 -0.9945 -1.39 -0.9999 3554044 Ald2.1-H_000436 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F21 compound treatment 1821.0 -642.17 -0.5538 1643.0 -709.58 -0.5748 -0.7981 -0.9998 3553767 Ald2.1-H_000437 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F22 compound treatment 1267.0 -1196.2 -1.0316 913.0 -1439.6 -1.1662 -1.5541 -0.9981 3554046 Ald2.1-H_000438 CCCCCCC/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F23 compound treatment 1238.0 -1225.2 -1.0567 1399.0 -953.58 -0.7725 -1.2934 -0.9881 3553771 Ald2.1-H_000439 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 F24 compound treatment 987.0 -1476.2 -1.2731 822.0 -1530.6 -1.2399 -1.777 -0.9999 3554048 Ald2.1-H_000440 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2nccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G01 compound treatment 1040.0 -1423.2 -1.2274 2829.0 476.42 0.386 -0.595 -0.4624 3553111 Ald2.1-H_000441 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccccc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G02 compound treatment 1095.0 -1368.2 -1.18 1458.0 -894.58 -0.7247 -1.3468 -0.9726 3553471 Ald2.1-H_000442 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G03 mock treatment 1682.0 -781.17 -0.6737 3703.0 1350.4 1.094 0.2972 0.2313 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G04 mock treatment 1938.0 -525.17 -0.4529 1432.0 -920.58 -0.7458 -0.8476 -0.9714 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G05 compound treatment 2543.0 79.828 0.0688 2340.0 -12.581 -0.0102 0.0415 0.5959 3553115 Ald2.1-H_000443 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccnc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G06 compound treatment 1573.0 -890.17 -0.7677 1607.0 -745.58 -0.604 -0.97 -0.993 3553474 Ald2.1-H_000444 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G07 compound treatment 1949.0 -514.17 -0.4435 2116.0 -236.58 -0.1917 -0.4491 -0.9296 3553118 Ald2.1-H_000445 ONC(=O)c1cccc(c1)C(=O)N/N=C/C=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G08 compound treatment 109.0 -2354.2 -2.0304 0.0 -2352.6 -1.9059 -2.7833 -0.9995 3553478 Ald2.1-H_000446 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(O)c(O)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G09 compound treatment 2092.0 -371.17 -0.3201 2135.0 -217.58 -0.1763 -0.351 -0.9605 3553123 Ald2.1-H_000447 C[C@H](CCC=C(C)C)C/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G10 compound treatment 2104.0 -359.17 -0.3098 1898.0 -454.58 -0.3683 -0.4794 -0.9963 3553482 Ald2.1-H_000448 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2c(O)cc(O)cc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G11 compound treatment 2614.0 150.83 0.1301 2423.0 70.419 0.057 0.1323 0.9316 3553127 Ald2.1-H_000449 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G12 compound treatment 1222.0 -1241.2 -1.0705 2001.0 -351.58 -0.2848 -0.9583 -0.8651 3553485 Ald2.1-H_000450 COc1cc(OC)c(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G13 compound treatment 1935.0 -528.17 -0.4555 2448.0 95.419 0.0773 -0.2674 -0.5788 3553128 Ald2.1-H_000451 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(C#N)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G14 compound treatment 1401.0 -1062.2 -0.9161 1954.0 -398.58 -0.3229 -0.8761 -0.902 3553487 Ald2.1-H_000452 COc1cc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G15 compound treatment 1637.0 -826.17 -0.7125 2150.0 -202.58 -0.1641 -0.6199 -0.8478 3553133 Ald2.1-H_000453 ONC(=O)c1cccc(c1)C(=O)N/N=C/C2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G16 compound treatment 1207.0 -1256.2 -1.0834 1546.0 -806.58 -0.6534 -1.2281 -0.9707 3553491 Ald2.1-H_000454 CC(C)(C)/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G17 compound treatment 1530.0 -933.17 -0.8048 1736.0 -616.58 -0.4995 -0.9223 -0.9737 3553137 Ald2.1-H_000455 COc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G18 compound treatment 884.0 -1579.2 -1.362 1412.0 -940.58 -0.762 -1.5019 -0.9623 3553494 Ald2.1-H_000456 CC1=C(C/C=N/NC(=O)c2cccc(c2)C(=O)NO)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G19 mock treatment 1325.0 -1138.2 -0.9816 1434.0 -918.58 -0.7442 -1.2203 -0.9907 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G20 mock treatment 1396.0 -1067.2 -0.9204 812.0 -1540.6 -1.248 -1.5333 -0.9888 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G21 compound treatment 286.0 -2177.2 -1.8777 395.0 -1957.6 -1.5859 -2.4491 -0.9965 3553141 Ald2.1-H_000457 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(Br)cc(Br)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G22 compound treatment 1508.0 -955.17 -0.8238 778.0 -1574.6 -1.2756 -1.4845 -0.9776 3553498 Ald2.1-H_000458 NC(=O)COc1ccccc1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G23 compound treatment 3.0 -2460.2 -2.1218 19.0 -2333.6 -1.8905 -2.8371 -0.9983 3553145 Ald2.1-H_000459 CCCCN(CCCC)c1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 G24 compound treatment 870.0 -1593.2 -1.374 583.0 -1769.6 -1.4336 -1.9853 -0.9998 3553502 Ald2.1-H_000460 NC(=O)COc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H01 compound treatment 1200.0 -1263.2 -1.0894 1076.0 -1276.6 -1.0342 -1.5016 -0.9997 3553774 Ald2.1-H_000461 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccccc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H02 compound treatment 1090.0 -1373.2 -1.1843 1137.0 -1215.6 -0.9848 -1.5338 -0.9958 3554050 Ald2.1-H_000462 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H03 mock treatment 2153.0 -310.17 -0.2675 1765.0 -587.58 -0.476 -0.5257 -0.9629 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H04 mock treatment 1904.0 -559.17 -0.4823 1676.0 -676.58 -0.5481 -0.7286 -0.998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H05 compound treatment 2431.0 -32.172 -0.0277 936.0 -1416.6 -1.1476 -0.8311 -0.724 3553778 Ald2.1-H_000463 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccnc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H06 compound treatment 1804.0 -659.17 -0.5685 1518.0 -834.58 -0.6761 -0.8801 -0.9963 3554054 Ald2.1-H_000464 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H07 compound treatment 1798.0 -665.17 -0.5737 1101.0 -1251.6 -1.0139 -1.1226 -0.9636 3553782 Ald2.1-H_000465 ONC(=O)c1ccc(cc1)C(=O)N/N=C/C=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H08 compound treatment 723.0 -1740.2 -1.5008 526.0 -1826.6 -1.4797 -2.1076 -1.0 3554058 Ald2.1-H_000466 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(O)c(O)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H09 compound treatment 2101.0 -362.17 -0.3124 1588.0 -764.58 -0.6194 -0.6589 -0.9498 3553785 Ald2.1-H_000467 C[C@H](CCC=C(C)C)C/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H10 compound treatment 1801.0 -662.17 -0.5711 1515.0 -837.58 -0.6785 -0.8836 -0.9963 3554062 Ald2.1-H_000468 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2c(O)cc(O)cc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H11 compound treatment 2308.0 -155.17 -0.1338 1045.0 -1307.6 -1.0593 -0.8437 -0.7902 3553788 Ald2.1-H_000469 C[C@@H](CCC=C(C)C)C/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H12 compound treatment 2129.0 -334.17 -0.2882 1662.0 -690.58 -0.5594 -0.5994 -0.9524 3554066 Ald2.1-H_000470 COc1cc(OC)c(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H13 compound treatment 2322.0 -141.17 -0.1218 1880.0 -472.58 -0.3828 -0.3568 -0.8882 3553791 Ald2.1-H_000471 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(C#N)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H14 compound treatment 2274.0 -189.17 -0.1632 1470.0 -882.58 -0.715 -0.6209 -0.8467 3554070 Ald2.1-H_000472 COc1cc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H15 compound treatment 1905.0 -558.17 -0.4814 1630.0 -722.58 -0.5854 -0.7543 -0.9953 3553793 Ald2.1-H_000473 ONC(=O)c1ccc(cc1)C(=O)N/N=C/C2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H16 compound treatment 1990.0 -473.17 -0.4081 1417.0 -935.58 -0.7579 -0.8245 -0.9578 3554074 Ald2.1-H_000474 CC(C)(C)/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H17 compound treatment 1595.0 -868.17 -0.7488 927.0 -1425.6 -1.1549 -1.3461 -0.978 3553797 Ald2.1-H_000475 COc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H18 compound treatment 1765.0 -698.17 -0.6021 1221.0 -1131.6 -0.9167 -1.074 -0.9792 3554078 Ald2.1-H_000476 CC1=C(C/C=N/NC(=O)c2ccc(cc2)C(=O)NO)C(C)(C)CCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H19 mock treatment 1862.0 -601.17 -0.5185 517.0 -1835.6 -1.487 -1.4181 -0.9005 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H20 mock treatment 1887.0 -576.17 -0.4969 957.0 -1395.6 -1.1306 -1.1508 -0.9319 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H21 compound treatment 1066.0 -1397.2 -1.205 798.0 -1554.6 -1.2594 -1.7426 -0.9998 3553801 Ald2.1-H_000477 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(Br)cc(Br)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H22 compound treatment 1574.0 -889.17 -0.7669 808.0 -1544.6 -1.2513 -1.4271 -0.9724 3554082 Ald2.1-H_000478 NC(=O)COc1ccccc1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H23 compound treatment 146.0 -2317.2 -1.9985 158.0 -2194.6 -1.7779 -2.6703 -0.9983 3553805 Ald2.1-H_000479 CCCCN(CCCC)c1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 H24 compound treatment 1300.0 -1163.2 -1.0032 801.0 -1551.6 -1.257 -1.5982 -0.9938 3554086 Ald2.1-H_000480 NC(=O)COc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I01 compound treatment 2807.0 343.83 0.2965 2880.0 527.42 0.4273 0.5118 0.9841 3553148 Ald2.1-H_000481 COc1cc(Cl)c(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I02 compound treatment 2488.0 24.828 0.0214 2522.0 169.42 0.1372 0.1122 0.8077 3554234 Ald2.1-H_000482 ONC(=O)c1cccc(c1)C(=O)NN=C2CCCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I03 compound treatment 1257.0 -1206.2 -1.0403 1560.0 -792.58 -0.6421 -1.1896 -0.9731 3553152 Ald2.1-H_000483 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(Cl)cc(Cl)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I04 compound treatment 2578.0 114.83 0.099 2221.0 -131.58 -0.1066 -0.0053 -0.0367 3554232 Ald2.1-H_000484 ONC(=O)c1cccc(c1)C(=O)NN=C2CCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I05 mock treatment 3476.0 1012.8 0.8735 3429.0 1076.4 0.872 1.2343 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I06 mock treatment 3222.0 758.83 0.6545 2748.0 395.42 0.3203 0.6893 0.946 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I07 compound treatment 2495.0 31.828 0.0275 3905.0 1552.4 1.2576 0.9087 0.7224 3553156 Ald2.1-H_000485 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I08 compound treatment 2674.0 210.83 0.1818 2766.0 413.42 0.3349 0.3654 0.9588 3553643 Ald2.1-H_000486 ONC(=O)c1cccc(c1)C(=O)N/N=C/Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I09 compound treatment 397.0 -2066.2 -1.782 346.0 -2006.6 -1.6256 -2.4095 -0.9989 3553212 Ald2.1-H_000487 CCN(CC)c1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I10 compound treatment 2772.0 308.83 0.2664 3728.0 1375.4 1.1142 0.9762 0.8521 3553647 Ald2.1-H_000488 COC(=O)c1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I11 compound treatment 2998.0 534.83 0.4613 2793.0 440.42 0.3568 0.5785 0.9919 3553216 Ald2.1-H_000489 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc3OCCc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I12 compound treatment 2519.0 55.828 0.0481 2854.0 501.42 0.4062 0.3213 0.7854 3553506 Ald2.1-H_000490 COc1cc(Br)c(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I13 compound treatment 2253.0 -210.17 -0.1813 1370.0 -982.58 -0.796 -0.691 -0.8465 3553220 Ald2.1-H_000491 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(O)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I14 compound treatment 2529.0 65.828 0.0568 2715.0 362.42 0.2936 0.2478 0.8285 3553651 Ald2.1-H_000492 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc3ccccc3n2S(=O)(=O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I15 compound treatment 2648.0 184.83 0.1594 2912.0 559.42 0.4532 0.4332 0.9017 3553224 Ald2.1-H_000493 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(O)cc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I16 compound treatment 1512.0 -951.17 -0.8203 1584.0 -768.58 -0.6226 -1.0203 -0.9907 3553510 Ald2.1-H_000494 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I17 compound treatment 1243.0 -1220.2 -1.0523 1866.0 -486.58 -0.3942 -1.0229 -0.9102 3553228 Ald2.1-H_000495 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(O)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I18 compound treatment 1967.0 -496.17 -0.4279 2040.0 -312.58 -0.2532 -0.4816 -0.9686 3553514 Ald2.1-H_000496 ONC(=O)c1cccc(c1)C(=O)N/N=C/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I19 compound treatment 1489.0 -974.17 -0.8402 1007.0 -1345.6 -1.0901 -1.3649 -0.9917 3553231 Ald2.1-H_000497 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(O)c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I20 compound treatment 2308.0 -155.17 -0.1338 1440.0 -912.58 -0.7393 -0.6174 -0.8218 3553655 Ald2.1-H_000498 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(cc2)B(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I21 mock treatment 1931.0 -532.17 -0.459 1917.0 -435.58 -0.3529 -0.5741 -0.9916 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I22 mock treatment 2251.0 -212.17 -0.183 1541.0 -811.58 -0.6575 -0.5943 -0.8708 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I23 compound treatment 2344.0 -119.17 -0.1028 1799.0 -553.58 -0.4485 -0.3898 -0.8472 3553235 Ald2.1-H_000499 COc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 I24 compound treatment 1647.0 -816.17 -0.7039 806.0 -1546.6 -1.2529 -1.3837 -0.9628 3553658 Ald2.1-H_000500 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J01 compound treatment 1684.0 -779.17 -0.672 1050.0 -1302.6 -1.0552 -1.2213 -0.9763 3553809 Ald2.1-H_000501 COc1cc(Cl)c(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c(Cl)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J02 compound treatment 1644.0 -819.17 -0.7065 2011.0 -341.58 -0.2767 -0.6952 -0.9163 3554238 Ald2.1-H_000502 ONC(=O)c1ccc(cc1)C(=O)NN=C2CCCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J03 compound treatment 1930.0 -533.17 -0.4598 1910.0 -442.58 -0.3585 -0.5787 -0.9924 3553812 Ald2.1-H_000503 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(Cl)cc(Cl)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J04 compound treatment 2132.0 -331.17 -0.2856 1664.0 -688.58 -0.5578 -0.5964 -0.9517 3554236 Ald2.1-H_000504 ONC(=O)c1ccc(cc1)C(=O)NN=C2CCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J05 mock treatment 2121.0 -342.17 -0.2951 2339.0 -13.581 -0.011 -0.2165 -0.733 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J06 mock treatment 1965.0 -498.17 -0.4297 1543.0 -809.58 -0.6559 -0.7676 -0.979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J07 compound treatment 2452.0 -11.172 -0.0096 1821.0 -531.58 -0.4306 -0.3113 -0.7227 3553816 Ald2.1-H_000505 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J08 compound treatment 2396.0 -67.172 -0.0579 2407.0 54.419 0.0441 -0.0098 -0.1345 3554206 Ald2.1-H_000506 ONC(=O)c1ccc(cc1)C(=O)N/N=C/Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J09 compound treatment 419.0 -2044.2 -1.763 366.0 -1986.6 -1.6094 -2.3846 -0.999 3553820 Ald2.1-H_000507 CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J10 compound treatment 2437.0 -26.172 -0.0226 2213.0 -139.58 -0.1131 -0.0959 -0.8318 3554209 Ald2.1-H_000508 COC(=O)c1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J11 compound treatment 2249.0 -214.17 -0.1847 2080.0 -272.58 -0.2208 -0.2868 -0.9961 3553823 Ald2.1-H_000509 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc3OCCc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J12 compound treatment 2508.0 44.828 0.0387 2475.0 122.42 0.0992 0.0975 0.9156 3554090 Ald2.1-H_000510 COc1cc(Br)c(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J13 compound treatment 2020.0 -443.17 -0.3822 1864.0 -488.58 -0.3958 -0.5501 -0.9998 3553827 Ald2.1-H_000511 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(O)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J14 compound treatment 1970.0 -493.17 -0.4253 2305.0 -47.581 -0.0385 -0.328 -0.768 3554213 Ald2.1-H_000512 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc3ccccc3n2S(=O)(=O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J15 compound treatment 2277.0 -186.17 -0.1606 1875.0 -477.58 -0.3869 -0.3871 -0.9241 3553831 Ald2.1-H_000513 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(O)cc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J16 compound treatment 1806.0 -657.17 -0.5668 1205.0 -1147.6 -0.9297 -1.0582 -0.9718 3554094 Ald2.1-H_000514 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)N(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J17 compound treatment 1603.0 -860.17 -0.7419 1285.0 -1067.6 -0.8649 -1.1361 -0.9971 3553835 Ald2.1-H_000515 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(O)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J18 compound treatment 2049.0 -414.17 -0.3572 1744.0 -608.58 -0.493 -0.6012 -0.9875 3554098 Ald2.1-H_000516 ONC(=O)c1ccc(cc1)C(=O)N/N=C/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J19 compound treatment 1281.0 -1182.2 -1.0196 1001.0 -1351.6 -1.0949 -1.4952 -0.9994 3553839 Ald2.1-H_000517 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(O)c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J20 compound treatment 2137.0 -326.17 -0.2813 1440.0 -912.58 -0.7393 -0.7217 -0.9124 3554217 Ald2.1-H_000518 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(cc2)B(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J21 mock treatment 2009.0 -454.17 -0.3917 1783.0 -569.58 -0.4614 -0.6033 -0.9967 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J22 mock treatment 2220.0 -243.17 -0.2097 1625.0 -727.58 -0.5894 -0.5651 -0.9032 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J23 compound treatment 1774.0 -689.17 -0.5944 1217.0 -1135.6 -0.9199 -1.0708 -0.9777 3553843 Ald2.1-H_000519 COc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 J24 compound treatment 2330.0 -133.17 -0.1149 1050.0 -1302.6 -1.0552 -0.8274 -0.7795 3554221 Ald2.1-H_000520 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(OCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K01 compound treatment 2232.0 -231.17 -0.1994 2749.0 396.42 0.3211 0.0861 0.2278 3553239 Ald2.1-H_000521 COc1cccc(OC)c1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K02 compound treatment 2499.0 35.828 0.0309 2636.0 283.42 0.2296 0.1842 0.7951 3553517 Ald2.1-H_000522 OC[C@@H](O)[C@@H](O)[C@H](O)/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K03 compound treatment 2890.0 426.83 0.3681 2848.0 495.42 0.4013 0.5441 0.9991 3553243 Ald2.1-H_000523 COc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K04 compound treatment 2281.0 -182.17 -0.1571 2781.0 428.42 0.3471 0.1343 0.3526 3553522 Ald2.1-H_000524 C[C@@H](O)[C@@H](O)[C@@H](O)C/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K05 compound treatment 2849.0 385.83 0.3328 3386.0 1033.4 0.8372 0.8273 0.9183 3553247 Ald2.1-H_000525 COc1cc(O)cc(OC)c1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K06 compound treatment 2962.0 498.83 0.4302 2736.0 383.42 0.3106 0.5238 0.9872 3553525 Ald2.1-H_000526 OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K07 mock treatment 3629.0 1165.8 1.0055 2991.0 638.42 0.5172 1.0767 0.9522 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K08 mock treatment 3366.0 902.83 0.7787 2960.0 607.42 0.4921 0.8985 0.9755 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K09 compound treatment 3094.0 630.83 0.5441 3153.0 800.42 0.6484 0.8432 0.9962 3553250 Ald2.1-H_000527 CC1(C)COC(CCC/C=N/NC(=O)c2cccc(c2)C(=O)NO)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K10 compound treatment 2956.0 492.83 0.425 2849.0 496.42 0.4022 0.5849 0.9996 3553530 Ald2.1-H_000528 OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K11 compound treatment 3320.0 856.83 0.739 2960.0 607.42 0.4921 0.8705 0.9805 3553254 Ald2.1-H_000529 Cc1nnc(Sc2ccc(/C=N/NC(=O)c3cccc(c3)C(=O)NO)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K12 compound treatment 3423.0 959.83 0.8278 2801.0 448.42 0.3633 0.8422 0.9316 3553531 Ald2.1-H_000530 OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K13 compound treatment 3451.0 987.83 0.852 3236.0 883.42 0.7157 1.1085 0.9962 3553258 Ald2.1-H_000531 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(Br)cs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K14 compound treatment 3260.0 796.83 0.6872 3019.0 666.42 0.5399 0.8677 0.9929 3553533 Ald2.1-H_000532 C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K15 mock treatment 3885.0 1421.8 1.2263 2983.0 630.42 0.5107 1.2282 0.9246 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K16 mock treatment 3800.0 1336.8 1.153 2688.0 335.42 0.2717 1.0074 0.8505 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K17 compound treatment 3799.0 1335.8 1.1521 3379.0 1026.4 0.8315 1.4026 0.9872 3553262 Ald2.1-H_000533 CC(C)(C)OC(=O)NC/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K18 compound treatment 2943.0 479.83 0.4138 2308.0 -44.581 -0.0361 0.2671 0.643 3553537 Ald2.1-H_000534 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K19 compound treatment 1546.0 -917.17 -0.791 1590.0 -762.58 -0.6178 -0.9962 -0.9925 3553266 Ald2.1-H_000535 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc-3c(Cc4ccccc43)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K20 compound treatment 3120.0 656.83 0.5665 2348.0 -4.5806 -0.0037 0.3979 0.7025 3553541 Ald2.1-H_000536 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc[n+]([O-])cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K21 compound treatment 2667.0 203.83 0.1758 2284.0 -68.581 -0.0556 0.085 0.4611 3553269 Ald2.1-H_000537 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(F)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K22 compound treatment 2624.0 160.83 0.1387 1983.0 -369.58 -0.2994 -0.1136 -0.3444 3553544 Ald2.1-H_000538 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc3ccccc3n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K23 mock treatment 2199.0 -264.17 -0.2278 2206.0 -146.58 -0.1187 -0.2451 -0.9539 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 K24 mock treatment 2387.0 -76.172 -0.0657 1525.0 -827.58 -0.6704 -0.5205 -0.7727 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L01 compound treatment 2403.0 -60.172 -0.0519 2031.0 -321.58 -0.2605 -0.2209 -0.8316 3553847 Ald2.1-H_000539 COc1cccc(OC)c1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L02 compound treatment 2364.0 -99.172 -0.0855 2022.0 -330.58 -0.2678 -0.2498 -0.8887 3554102 Ald2.1-H_000540 OC[C@@H](O)[C@@H](O)[C@H](O)/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L03 compound treatment 2359.0 -104.17 -0.0898 2823.0 470.42 0.3811 0.2059 0.526 3553851 Ald2.1-H_000541 COc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L04 compound treatment 2478.0 14.828 0.0128 2505.0 152.42 0.1235 0.0964 0.7762 3554105 Ald2.1-H_000542 C[C@@H](O)[C@@H](O)[C@@H](O)C/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L05 compound treatment 2950.0 486.83 0.4199 2764.0 411.42 0.3333 0.5326 0.9935 3553855 Ald2.1-H_000543 COc1cc(O)cc(OC)c1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L06 compound treatment 2695.0 231.83 0.1999 2650.0 297.42 0.2409 0.3118 0.9957 3554109 Ald2.1-H_000544 OC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L07 mock treatment 2680.0 216.83 0.187 3520.0 1167.4 0.9457 0.801 0.8308 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L08 mock treatment 3005.0 541.83 0.4673 3125.0 772.42 0.6257 0.7729 0.9897 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L09 compound treatment 3102.0 638.83 0.551 3274.0 921.42 0.7465 0.9174 0.9888 3553858 Ald2.1-H_000545 CC1(C)COC(CCC/C=N/NC(=O)c2ccc(cc2)C(=O)NO)OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L10 compound treatment 2825.0 361.83 0.3121 2772.0 419.42 0.3398 0.4609 0.9991 3554113 Ald2.1-H_000546 OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L11 compound treatment 3093.0 629.83 0.5432 2974.0 621.42 0.5034 0.7401 0.9993 3553862 Ald2.1-H_000547 Cc1nnc(Sc2ccc(/C=N/NC(=O)c3ccc(cc3)C(=O)NO)o2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L12 compound treatment 3137.0 673.83 0.5811 2569.0 216.42 0.1753 0.5349 0.8812 3554115 Ald2.1-H_000548 OC[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L13 compound treatment 2677.0 213.83 0.1844 1209.0 -1143.6 -0.9264 -0.5247 -0.5554 3553866 Ald2.1-H_000549 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(Br)cs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L14 compound treatment 3141.0 677.83 0.5846 2672.0 319.42 0.2588 0.5963 0.9328 3554117 Ald2.1-H_000550 C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L15 mock treatment 2802.0 338.83 0.2922 3495.0 1142.4 0.9255 0.8611 0.8872 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L16 mock treatment 2819.0 355.83 0.3069 3009.0 656.42 0.5318 0.593 0.9659 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L17 compound treatment 2507.0 43.828 0.0378 2697.0 344.42 0.279 0.224 0.7956 3553870 Ald2.1-H_000551 CC(C)(C)OC(=O)NC/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L18 compound treatment 2447.0 -16.172 -0.0139 2254.0 -98.581 -0.0799 -0.0663 -0.8182 3554121 Ald2.1-H_000552 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(Oc3ccccc3)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L19 compound treatment 294.0 -2169.2 -1.8708 227.0 -2125.6 -1.722 -2.5405 -0.9991 3553873 Ald2.1-H_000553 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc-3c(Cc4ccccc43)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L20 compound treatment 2627.0 163.83 0.1413 2191.0 -161.58 -0.1309 0.0074 0.0382 3554125 Ald2.1-H_000554 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc[n+]([O-])cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L21 compound treatment 1802.0 -661.17 -0.5702 1431.0 -921.58 -0.7466 -0.9311 -0.9912 3553877 Ald2.1-H_000555 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(F)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L22 compound treatment 1764.0 -699.17 -0.603 1380.0 -972.58 -0.7879 -0.9835 -0.9913 3554129 Ald2.1-H_000556 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc3ccccc3n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L23 mock treatment 2032.0 -431.17 -0.3719 1746.0 -606.58 -0.4914 -0.6104 -0.9905 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 L24 mock treatment 1845.0 -618.17 -0.5331 1407.0 -945.58 -0.766 -0.9187 -0.9843 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M01 compound treatment 2004.0 -459.17 -0.396 1974.0 -378.58 -0.3067 -0.4969 -0.992 3553273 Ald2.1-H_000557 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(O)c(F)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M02 compound treatment 1987.0 -476.17 -0.4107 2825.0 472.42 0.3827 -0.0198 -0.0352 3553549 Ald2.1-H_000558 Cc1ccccc1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M03 compound treatment 2443.0 -20.172 -0.0174 2297.0 -55.581 -0.045 -0.0441 -0.9144 3553277 Ald2.1-H_000559 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(F)c(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M04 compound treatment 1697.0 -766.17 -0.6608 1840.0 -512.58 -0.4152 -0.7609 -0.9749 3553553 Ald2.1-H_000560 COc1cc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M05 compound treatment 1335.0 -1128.2 -0.973 2156.0 -196.58 -0.1593 -0.8006 -0.812 3553281 Ald2.1-H_000561 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(F)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M06 compound treatment 2544.0 80.828 0.0697 2494.0 141.42 0.1146 0.1303 0.9716 3553579 Ald2.1-H_000562 ONC(=O)c1cccc(c1)C(=O)N/N=C/[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M07 compound treatment 2492.0 28.828 0.0249 3046.0 693.42 0.5617 0.4148 0.7377 3553285 Ald2.1-H_000563 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2coc3ccccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M08 compound treatment 2683.0 219.83 0.1896 2545.0 192.42 0.1559 0.2443 0.9953 3553584 Ald2.1-H_000564 OC[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M09 mock treatment 2407.0 -56.172 -0.0484 2908.0 555.42 0.45 0.2839 0.6273 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M10 mock treatment 2789.0 325.83 0.281 2944.0 591.42 0.4791 0.5375 0.9677 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M11 compound treatment 2761.0 297.83 0.2569 3064.0 711.42 0.5763 0.5892 0.9337 3553289 Ald2.1-H_000565 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M12 compound treatment 3062.0 598.83 0.5165 2689.0 336.42 0.2725 0.5579 0.9554 3553585 Ald2.1-H_000566 COc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M13 mock treatment 3791.0 1327.8 1.1452 2802.0 449.42 0.3641 1.0672 0.8881 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M14 mock treatment 3020.0 556.83 0.4802 2577.0 224.42 0.1818 0.4681 0.9117 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M15 compound treatment 3067.0 603.83 0.5208 2584.0 231.42 0.1875 0.5008 0.9048 3553293 Ald2.1-H_000567 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(c2)B(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M16 compound treatment 2677.0 213.83 0.1844 2462.0 109.42 0.0886 0.1931 0.9436 3553589 Ald2.1-H_000568 CCOc1cccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M17 compound treatment 2538.0 74.828 0.0645 2048.0 -304.58 -0.2467 -0.1288 -0.5052 3553297 Ald2.1-H_000569 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccco2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M18 compound treatment 2169.0 -294.17 -0.2537 2629.0 276.42 0.2239 -0.0211 -0.0622 3553593 Ald2.1-H_000570 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(I)cc(I)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M19 compound treatment 2603.0 139.83 0.1206 2255.0 -97.581 -0.0791 0.0294 0.2037 3553301 Ald2.1-H_000571 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccoc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M20 compound treatment 2018.0 -445.17 -0.3839 1541.0 -811.58 -0.6575 -0.7364 -0.9672 3553597 Ald2.1-H_000572 CN(C)c1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M21 compound treatment 1869.0 -594.17 -0.5124 1491.0 -861.58 -0.698 -0.8559 -0.9885 3553305 Ald2.1-H_000573 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cccc(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M22 compound treatment 2025.0 -438.17 -0.3779 1162.0 -1190.6 -0.9645 -0.9492 -0.9163 3553601 Ald2.1-H_000574 CCn1c2ccccc2c3cc(/C=N/NC(=O)c4cccc(c4)C(=O)NO)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M23 compound treatment 1920.0 -543.17 -0.4685 2002.0 -350.58 -0.284 -0.5321 -0.9712 3553309 Ald2.1-H_000575 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 M24 compound treatment 2060.0 -403.17 -0.3477 947.0 -1405.6 -1.1387 -1.051 -0.8828 3553605 Ald2.1-H_000576 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(c(F)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N01 compound treatment 2007.0 -456.17 -0.3934 2694.0 341.42 0.2766 -0.0826 -0.1718 3553880 Ald2.1-H_000577 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(O)c(F)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N02 compound treatment 2433.0 -30.172 -0.026 2092.0 -260.58 -0.2111 -0.1677 -0.7883 3554133 Ald2.1-H_000578 Cc1ccccc1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N03 compound treatment 1838.0 -625.17 -0.5392 2578.0 225.42 0.1826 -0.2521 -0.4429 3553882 Ald2.1-H_000579 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(F)c(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N04 compound treatment 2490.0 26.828 0.0231 2837.0 484.42 0.3924 0.2939 0.7475 3554137 Ald2.1-H_000580 COc1cc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N05 compound treatment 1907.0 -556.17 -0.4797 1991.0 -361.58 -0.2929 -0.5463 -0.972 3553886 Ald2.1-H_000581 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(F)ccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N06 compound treatment 2901.0 437.83 0.3776 2494.0 141.42 0.1146 0.348 0.8819 3554141 Ald2.1-H_000582 ONC(=O)c1ccc(cc1)C(=O)N/N=C/[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N07 compound treatment 3543.0 1079.8 0.9313 3140.0 787.42 0.6379 1.1096 0.983 3553889 Ald2.1-H_000583 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2coc3ccccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N08 compound treatment 2783.0 319.83 0.2758 2599.0 246.42 0.1996 0.3362 0.9874 3554145 Ald2.1-H_000584 OC[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N09 mock treatment 2968.0 504.83 0.4354 2889.0 536.42 0.4346 0.6152 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N10 mock treatment 3164.0 700.83 0.6044 1229.0 -1123.6 -0.9102 -0.2162 -0.1979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N11 compound treatment 2638.0 174.83 0.1508 2231.0 -121.58 -0.0985 0.037 0.2053 3553894 Ald2.1-H_000585 CC(C)(C)OC(=O)Nc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N12 compound treatment 2695.0 231.83 0.1999 2679.0 326.42 0.2644 0.3284 0.9905 3554147 Ald2.1-H_000586 COc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N13 mock treatment 2981.0 517.83 0.4466 3811.0 1458.4 1.1815 1.1512 0.9115 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N14 mock treatment 2943.0 479.83 0.4138 3225.0 872.42 0.7068 0.7924 0.9675 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N15 compound treatment 2855.0 391.83 0.3379 2749.0 396.42 0.3211 0.466 0.9997 3553898 Ald2.1-H_000587 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(c2)B(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N16 compound treatment 2637.0 173.83 0.1499 2444.0 91.419 0.0741 0.1584 0.9472 3554152 Ald2.1-H_000588 CCOc1cccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N17 compound treatment 3407.0 943.83 0.814 2650.0 297.42 0.2409 0.746 0.8787 3553901 Ald2.1-H_000589 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccco2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N18 compound treatment 3238.0 774.83 0.6683 2047.0 -305.58 -0.2476 0.2975 0.4174 3554155 Ald2.1-H_000590 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(I)cc(I)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N19 compound treatment 2559.0 95.828 0.0826 2014.0 -338.58 -0.2743 -0.1355 -0.473 3553905 Ald2.1-H_000591 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccoc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N20 compound treatment 1805.0 -658.17 -0.5676 1262.0 -1090.6 -0.8835 -1.0261 -0.9771 3554159 Ald2.1-H_000592 CN(C)c1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N21 compound treatment 2689.0 225.83 0.1948 1947.0 -405.58 -0.3286 -0.0946 -0.2477 3553909 Ald2.1-H_000593 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cccc(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N22 compound treatment 1502.0 -961.17 -0.829 589.0 -1763.6 -1.4287 -1.5964 -0.9665 3554162 Ald2.1-H_000594 CCn1c2ccccc2c3cc(/C=N/NC(=O)c4ccc(cc4)C(=O)NO)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N23 compound treatment 1848.0 -615.17 -0.5306 1604.0 -748.58 -0.6064 -0.804 -0.9978 3553913 Ald2.1-H_000595 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 N24 compound treatment 2179.0 -284.17 -0.2451 1630.0 -722.58 -0.5854 -0.5872 -0.9253 3554166 Ald2.1-H_000596 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(c(F)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O01 compound treatment 1968.0 -495.17 -0.4271 3501.0 1148.4 0.9304 0.3559 0.3476 3553313 Ald2.1-H_000597 OCCOc1ccccc1/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O02 compound treatment 2567.0 103.83 0.0895 3233.0 880.42 0.7132 0.5677 0.7897 3553608 Ald2.1-H_000598 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(o2)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O03 compound treatment 1965.0 -498.17 -0.4297 3170.0 817.42 0.6622 0.1644 0.2083 3553317 Ald2.1-H_000599 OCCOc1cccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O04 compound treatment 2091.0 -372.17 -0.321 3084.0 731.42 0.5925 0.192 0.2849 3553612 Ald2.1-H_000600 Cn1cc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O05 compound treatment 3431.0 967.83 0.8347 3744.0 1391.4 1.1272 1.3873 0.9891 3553320 Ald2.1-H_000601 OCCOc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O06 compound treatment 1997.0 -466.17 -0.4021 2397.0 44.419 0.036 -0.2589 -0.6413 3553614 Ald2.1-H_000602 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cn(Cc3ccccc3)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O07 compound treatment 2041.0 -422.17 -0.3641 1547.0 -805.58 -0.6526 -0.7189 -0.962 3553323 Ald2.1-H_000603 COc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O08 compound treatment 2661.0 197.83 0.1706 2819.0 466.42 0.3779 0.3878 0.9355 3553618 Ald2.1-H_000604 ONC(=O)c1cccc(c1)C(=O)N/N=C/C2=CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O09 compound treatment 2574.0 110.83 0.0956 2188.0 -164.58 -0.1333 -0.0267 -0.1627 3553327 Ald2.1-H_000605 COc1ccc(O)c(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O10 compound treatment 3206.0 742.83 0.6407 2349.0 -3.5806 -0.0029 0.451 0.7039 3553622 Ald2.1-H_000606 OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)c1cccc(c1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O11 mock treatment 2462.0 -1.1719 -0.001 2495.0 142.42 0.1154 0.0809 0.7009 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O12 mock treatment 3415.0 951.83 0.8209 3086.0 733.42 0.5942 1.0006 0.9874 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O13 compound treatment 2425.0 -38.172 -0.0329 3010.0 657.42 0.5326 0.3533 0.6621 3553331 Ald2.1-H_000607 COc1cc(/C=C/C=N/NC(=O)c2cccc(c2)C(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O14 compound treatment 2815.0 351.83 0.3034 2342.0 -10.581 -0.0086 0.2085 0.6869 3553623 Ald2.1-H_000608 OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)/C=N/NC(=O)c2cccc(c2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O15 compound treatment 1516.0 -947.17 -0.8169 1195.0 -1157.6 -0.9378 -1.2407 -0.9976 3553334 Ald2.1-H_000609 Cc1ccc(O)c(/C=N/NC(=O)c2cccc(c2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O16 compound treatment 2489.0 25.828 0.0223 2051.0 -301.58 -0.2443 -0.157 -0.64 3553627 Ald2.1-H_000610 OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c2cccc(c2)C(=O)NO)[C@H](O)[C@@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O17 compound treatment 2598.0 134.83 0.1163 2166.0 -186.58 -0.1512 -0.0247 -0.1293 3553338 Ald2.1-H_000611 OCc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O18 compound treatment 2769.0 305.83 0.2638 1972.0 -380.58 -0.3083 -0.0315 -0.0776 3554247 Ald2.1-H_000612 C/C(=N\NC(=O)c1cccc(c1)C(=O)NO)/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O19 compound treatment 662.0 -1801.2 -1.5534 800.0 -1552.6 -1.2578 -1.9878 -0.9945 3553342 Ald2.1-H_000613 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc3ccccc3c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O20 compound treatment 1904.0 -559.17 -0.4823 1454.0 -898.58 -0.728 -0.8558 -0.98 3553631 Ald2.1-H_000614 CN(C)CCCOc1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O21 compound treatment 2210.0 -253.17 -0.2184 1663.0 -689.58 -0.5586 -0.5494 -0.916 3553346 Ald2.1-H_000615 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2ccc(o2)c3cccc(Cl)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O22 compound treatment 2091.0 -372.17 -0.321 1270.0 -1082.6 -0.877 -0.8471 -0.9071 3553635 Ald2.1-H_000616 CCOc1cc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O23 compound treatment 2151.0 -312.17 -0.2692 1545.0 -807.58 -0.6542 -0.653 -0.923 3553350 Ald2.1-H_000617 ONC(=O)c1cccc(c1)C(=O)N/N=C/c2cc(Br)c(O)c(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 O24 compound treatment 1999.0 -464.17 -0.4003 1024.0 -1328.6 -1.0763 -1.0441 -0.9093 3553639 Ald2.1-H_000618 CN(CCO)c1ccc(/C=N/NC(=O)c2cccc(c2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P01 compound treatment 1853.0 -610.17 -0.5262 2712.0 359.42 0.2912 -0.1662 -0.2764 3553917 Ald2.1-H_000619 OCCOc1ccccc1/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P02 compound treatment 2685.0 221.83 0.1913 2203.0 -149.58 -0.1212 0.0496 0.219 3554170 Ald2.1-H_000620 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(o2)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P03 compound treatment 1881.0 -582.17 -0.5021 2263.0 -89.581 -0.0726 -0.4064 -0.801 3553921 Ald2.1-H_000621 OCCOc1cccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P04 compound treatment 2028.0 -435.17 -0.3753 2683.0 330.42 0.2677 -0.0761 -0.1651 3554174 Ald2.1-H_000622 Cn1cc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P05 compound treatment 2614.0 150.83 0.1301 2846.0 493.42 0.3997 0.3746 0.8912 3553924 Ald2.1-H_000623 OCCOc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P06 compound treatment 1710.0 -753.17 -0.6496 873.0 -1479.6 -1.1986 -1.3069 -0.9586 3554177 Ald2.1-H_000624 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cn(Cc3ccccc3)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P07 compound treatment 2751.0 287.83 0.2482 2147.0 -205.58 -0.1665 0.0578 0.1932 3553927 Ald2.1-H_000625 COc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P08 compound treatment 2254.0 -209.17 -0.1804 1799.0 -553.58 -0.4485 -0.4447 -0.9199 3554181 Ald2.1-H_000626 ONC(=O)c1ccc(cc1)C(=O)N/N=C/C2=CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P09 compound treatment 2033.0 -430.17 -0.371 2143.0 -209.58 -0.1698 -0.3824 -0.9372 3553931 Ald2.1-H_000627 COc1ccc(O)c(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P10 compound treatment 2136.0 -327.17 -0.2822 1917.0 -435.58 -0.3529 -0.449 -0.9939 3554185 Ald2.1-H_000628 OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)/C=N/NC(=O)c1ccc(cc1)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P11 mock treatment 2698.0 234.83 0.2025 2175.0 -177.58 -0.1439 0.0415 0.167 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P12 mock treatment 2972.0 508.83 0.4388 2608.0 255.42 0.2069 0.4566 0.9411 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P13 compound treatment 2476.0 12.828 0.0111 2564.0 211.42 0.1713 0.1289 0.7512 3553935 Ald2.1-H_000629 COc1cc(/C=C/C=N/NC(=O)c2ccc(cc2)C(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P14 compound treatment 2444.0 -19.172 -0.0165 2229.0 -123.58 -0.1001 -0.0825 -0.8129 3554187 Ald2.1-H_000630 OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)/C=N/NC(=O)c2ccc(cc2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P15 compound treatment 2240.0 -223.17 -0.1925 1925.0 -427.58 -0.3464 -0.381 -0.9615 3553938 Ald2.1-H_000631 Cc1ccc(O)c(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P16 compound treatment 2357.0 -106.17 -0.0916 1940.0 -412.58 -0.3342 -0.3011 -0.8688 3554191 Ald2.1-H_000632 OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)/C=N/NC(=O)c2ccc(cc2)C(=O)NO)[C@H](O)[C@@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P17 compound treatment 2201.0 -262.17 -0.2261 2060.0 -292.58 -0.237 -0.3275 -0.9997 3553942 Ald2.1-H_000633 OCc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P18 compound treatment 2206.0 -257.17 -0.2218 1825.0 -527.58 -0.4274 -0.4591 -0.9533 3554251 Ald2.1-H_000634 C/C(=N\NC(=O)c1ccc(cc1)C(=O)NO)/C[P+](c2ccccc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P19 compound treatment 1198.0 -1265.2 -1.0912 501.0 -1851.6 -1.5 -1.8322 -0.9878 3553946 Ald2.1-H_000635 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc3ccccc3c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P20 compound treatment 2125.0 -338.17 -0.2917 1211.0 -1141.6 -0.9248 -0.8602 -0.887 3554194 Ald2.1-H_000636 CN(C)CCCOc1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P21 compound treatment 1495.0 -968.17 -0.835 1061.0 -1291.6 -1.0463 -1.3303 -0.9938 3553950 Ald2.1-H_000637 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2ccc(o2)c3cccc(Cl)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P22 compound treatment 2807.0 343.83 0.2965 1210.0 -1142.6 -0.9256 -0.4448 -0.4577 3554198 Ald2.1-H_000638 CCOc1cc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P23 compound treatment 1798.0 -665.17 -0.5737 1050.0 -1302.6 -1.0552 -1.1518 -0.959 3553954 Ald2.1-H_000639 ONC(=O)c1ccc(cc1)C(=O)N/N=C/c2cc(Br)c(O)c(Br)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2411 P24 compound treatment 1130.0 -1333.2 -1.1498 1182.0 -1170.6 -0.9483 -1.4836 -0.9954 3554202 Ald2.1-H_000640 CN(CCO)c1ccc(/C=N/NC(=O)c2ccc(cc2)C(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A01 compound treatment 66.0 -2021.6 -1.7435 61.0 -1874.3 -1.5184 -2.3066 -0.9976 3636025 DAlc3.1-H_000321 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccccc2c3ccccc3)[C@H](OC(=O)Nc4ccccc4)[C@@H]1OC(=O)Nc5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A02 compound treatment 602.0 -1485.6 -1.2812 638.0 -1297.3 -1.051 -1.6491 -0.9952 3636027 DAlc3.1-H_000322 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)c2ccc(Br)cc2)[C@H](OC(=O)c3cc4ccccc4[nH]3)[C@H]1OC(=O)c5cc6ccccc6[nH]5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A03 compound treatment 1683.0 -404.58 -0.3489 956.0 -979.34 -0.7934 -0.8077 -0.9319 3636029 DAlc3.1-H_000323 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)c2ccc(Br)cc2)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A04 compound treatment 54.0 -2033.6 -1.7539 941.0 -994.34 -0.8055 -1.8098 -0.9377 3636031 DAlc3.1-H_000324 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)c2c(OC)cccc2OC)[C@H](OC(=O)c3cc4ccccc4[nH]3)[C@H]1OC(=O)c5cc6ccccc6[nH]5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A05 compound treatment 1606.0 -481.58 -0.4153 924.0 -1011.3 -0.8193 -0.873 -0.9504 3636033 DAlc3.1-H_000325 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)c2c(OC)cccc2OC)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A06 compound treatment 112.0 -1975.6 -1.7039 18.0 -1917.3 -1.5533 -2.3031 -0.9989 3636035 DAlc3.1-H_000326 COC(=O)[C@]1(CC=C)N=C(O[C@@H]1c2ccccc2)c3ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A07 compound treatment 1554.0 -533.58 -0.4602 375.0 -1560.3 -1.2641 -1.2192 -0.9063 3636037 DAlc3.1-H_000327 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2cccc(F)c2)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A08 compound treatment 15.0 -2072.6 -1.7875 235.0 -1700.3 -1.3775 -2.238 -0.9917 3636039 DAlc3.1-H_000328 COC(=O)[C@@]1(CC=C)COC(=N1)c2ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A09 compound treatment 17.0 -2070.6 -1.7858 1.0 -1934.3 -1.567 -2.3708 -0.9979 3636041 DAlc3.1-H_000329 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A10 compound treatment 293.0 -1794.6 -1.5477 1.0 -1934.3 -1.567 -2.2025 -1.0 3636043 DAlc3.1-H_000330 COC(=O)[C@@]1(Cc2ccccc2)COC(=N1)c3ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A11 compound treatment 44.0 -2043.6 -1.7625 10.0 -1925.3 -1.5597 -2.3492 -0.9981 3636045 DAlc3.1-H_000331 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccc(C#N)cc2)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A12 compound treatment 915.0 -1172.6 -1.0113 185.0 -1750.3 -1.418 -1.7178 -0.9863 3636047 DAlc3.1-H_000332 COC(=O)[C@@]1(CCS(=O)(=O)c2ccccc2)COC(=N1)c3ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A13 mock treatment 2041.0 -46.578 -0.0402 1633.0 -302.34 -0.2449 -0.2016 -0.8122 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A14 mock treatment 2856.0 768.42 0.6627 852.0 -1083.3 -0.8776 -0.152 -0.1382 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A15 compound treatment 1529.0 -558.58 -0.4818 877.0 -1058.3 -0.8574 -0.9469 -0.9628 3636049 DAlc3.1-H_000333 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)c2c(OC)cccc2OC)[C@@H]3OC(=O)[C@H](Cc4ccccc4)C/C=C/C[C@@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A16 compound treatment 166.0 -1921.6 -1.6573 35.0 -1900.3 -1.5395 -2.2605 -0.9993 3556558 DAlc3.1-H_000334 COC(=O)[C@]1(CCS(=O)(=O)c2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A17 compound treatment 29.0 -2058.6 -1.7754 178.0 -1757.3 -1.4236 -2.2621 -0.994 3636050 DAlc3.1-H_000335 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@@H]3OC(=O)[C@H](Cc4ccccc4)C/C=C/C[C@@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A18 compound treatment 7.0 -2080.6 -1.7944 154.0 -1781.3 -1.4431 -2.2893 -0.9942 3636051 DAlc3.1-H_000336 NC(=O)[C@]1(CCS(=O)(=O)c2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A19 compound treatment 6.0 -2081.6 -1.7953 0.0 -1935.3 -1.5678 -2.3781 -0.9977 3636053 DAlc3.1-H_000337 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccc3OCOc3c2)[C@@H]4OC(=O)[C@H](Cc5ccccc5)C/C=C/C[C@@H](Cc6ccccc6)C(=O)O[C@@H]14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A20 compound treatment 10.0 -2077.6 -1.7918 20.0 -1915.3 -1.5516 -2.3642 -0.9974 3636055 DAlc3.1-H_000338 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@](CCS(=O)(=O)c3ccccc3)([C@@H](O2)c4ccccc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A21 compound treatment 443.0 -1644.6 -1.4184 807.0 -1128.3 -0.9141 -1.6493 -0.9774 3636057 DAlc3.1-H_000339 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)c2c(OC)cccc2OC)[C@@H]3OC(=O)[C@@H](Cc4ccc5ccccc5c4)C/C=C/C[C@H](Cc6ccc7ccccc7c6)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A22 compound treatment 0.0 -2087.6 -1.8004 3.0 -1932.3 -1.5654 -2.38 -0.9976 3636059 DAlc3.1-H_000340 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@](Cc3ccccc3)([C@@H](O2)c4ccccc4)C(=O)N5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A23 compound treatment 7.0 -2080.6 -1.7944 7.0 -1928.3 -1.5622 -2.3735 -0.9976 3636061 DAlc3.1-H_000341 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@@H]3OC(=O)[C@@H](Cc4ccc5ccccc5c4)C/C=C/C[C@H](Cc6ccc7ccccc7c6)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 A24 compound treatment 52.0 -2035.6 -1.7556 0.0 -1935.3 -1.5678 -2.35 -0.9984 3636063 DAlc3.1-H_000342 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@](Cc3ccccc3)([C@@H](O2)c4ccccc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B01 compound treatment 1327.0 -760.58 -0.656 1203.0 -732.34 -0.5933 -0.8834 -0.9987 3636065 DAlc3.1-H_000343 CC(C)CNC(=O)[C@]1(Cc2ccccc2I)[C@@H](N(Cc3ccccc3Cl)C(=O)c4ccccc41)c5ccc(COC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B02 compound treatment 82.0 -2005.6 -1.7297 67.0 -1868.3 -1.5136 -2.2934 -0.9978 3636067 DAlc3.1-H_000344 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(CC=C)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B03 compound treatment 1891.0 -196.58 -0.1695 1514.0 -421.34 -0.3413 -0.3612 -0.9478 3636069 DAlc3.1-H_000345 CCCNC(=O)[C@]1(CC(=O)N(C2Cc3ccccc3C2)[C@@H]1c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)Sc5ccc(C)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B04 compound treatment 177.0 -1910.6 -1.6478 105.0 -1830.3 -1.4828 -2.2137 -0.9986 3636071 DAlc3.1-H_000346 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccccc4)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B05 compound treatment 2172.0 84.422 0.0728 1996.0 60.656 0.0491 0.0862 0.9817 3636073 DAlc3.1-H_000347 CC(C)CN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(Cc4ccccc4Cl)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B06 compound treatment 37.0 -2050.6 -1.7685 129.0 -1806.3 -1.4633 -2.2853 -0.9956 3636075 DAlc3.1-H_000348 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(Cc5cccc(c5)N6CCC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B07 compound treatment 1701.0 -386.58 -0.3334 1507.0 -428.34 -0.347 -0.4811 -0.9998 3636077 DAlc3.1-H_000349 CC(C)CNC(=O)[C@]1(Cc2ccccc2I)[C@@H](N(Cc3ccccc3)C(=O)c4ccccc41)c5ccc(COC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B08 compound treatment 76.0 -2011.6 -1.7349 7.0 -1928.3 -1.5622 -2.3314 -0.9986 3636079 DAlc3.1-H_000350 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4cccc(c4)N5CCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B09 compound treatment 2318.0 230.42 0.1987 1915.0 -20.344 -0.0165 0.1289 0.6462 3636081 DAlc3.1-H_000351 CC(C)CNC(=O)[C@]1(CC(=O)N(C2Cc3ccccc3C2)[C@@H]1c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)Sc5ccc(C)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B10 compound treatment 47.0 -2040.6 -1.7599 156.0 -1779.3 -1.4415 -2.2637 -0.9951 3636083 DAlc3.1-H_000352 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(cc43)N5CCC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B11 compound treatment 1881.0 -206.58 -0.1782 2007.0 71.656 0.058 -0.0849 -0.4533 3636084 DAlc3.1-H_000353 Cc1ccc(S[C@@]2(CC(=O)N([C@@H]2c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)C4CCCCC4)C(=O)NCc5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B12 compound treatment 1274.0 -813.58 -0.7017 1081.0 -854.34 -0.6921 -0.9856 -1.0 3636086 DAlc3.1-H_000354 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CC(=O)N4CCC[C@H]4COC(=O)NCCCCCC(=O)NO)C(=O)N(Cc5cccc(c5)N6CCOC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B13 mock treatment 1654.0 -433.58 -0.3739 2039.0 103.66 0.084 -0.205 -0.535 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B14 mock treatment 1110.0 -977.58 -0.8431 1743.0 -192.34 -0.1558 -0.7064 -0.8238 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B15 compound treatment 1620.0 -467.58 -0.4033 1562.0 -373.34 -0.3025 -0.499 -0.9899 3636088 DAlc3.1-H_000355 CC(C)N1[C@H](c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NCC(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B16 compound treatment 25.0 -2062.6 -1.7789 7.0 -1928.3 -1.5622 -2.3625 -0.9979 3636090 DAlc3.1-H_000356 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(Cc5ccc(cc5)N6CCC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B17 compound treatment 1550.0 -537.58 -0.4636 1609.0 -326.34 -0.2644 -0.5148 -0.9645 3636092 DAlc3.1-H_000357 COCCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(Cc4ccccc4)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B18 compound treatment 245.0 -1842.6 -1.5891 196.0 -1739.3 -1.4091 -2.1201 -0.9982 3636094 DAlc3.1-H_000358 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(CC=C)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B19 compound treatment 875.0 -1212.6 -1.0458 737.0 -1198.3 -0.9708 -1.4259 -0.9993 3636095 DAlc3.1-H_000359 CCCNC(=O)[C@]1(CC(=O)N(Cc2ccccc2)[C@@H]1c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B20 compound treatment 4.0 -2083.6 -1.797 0.0 -1935.3 -1.5678 -2.3793 -0.9977 3636097 DAlc3.1-H_000360 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4cccc(c4)N5CCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B21 compound treatment 944.0 -1143.6 -0.9863 999.0 -936.34 -0.7585 -1.2338 -0.9916 3636098 DAlc3.1-H_000361 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3)C(=O)c4ccccc4[C@]52Cc6ccccc6N(C7CC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B22 compound treatment 3.0 -2084.6 -1.7979 10.0 -1925.3 -1.5597 -2.3742 -0.9975 3636100 DAlc3.1-H_000362 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(Cc5ccc(cc5)N6CCC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B23 compound treatment 591.0 -1496.6 -1.2907 331.0 -1604.3 -1.2997 -1.8317 -1.0 3636101 DAlc3.1-H_000363 CCCNC(=O)[C@]1(CC(=O)N(C(C)C)[C@@H]1c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)Sc3ccc(C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 B24 compound treatment 1.0 -2086.6 -1.7996 5.0 -1930.3 -1.5638 -2.3783 -0.9976 3636103 DAlc3.1-H_000364 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(C)c5c3cc(C)cc5Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C01 compound treatment 1932.0 -155.58 -0.1342 1103.0 -832.34 -0.6743 -0.5717 -0.8315 3636105 DAlc3.1-H_000365 NC(=O)NCC#Cc1ccc2NC(=O)[C@]3([C@@H]([C@@H]4N([C@@H]3c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5)[C@H]([C@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C02 compound treatment 455.0 -1632.6 -1.408 506.0 -1429.3 -1.1579 -1.8144 -0.9953 3636107 DAlc3.1-H_000366 NC(=O)[C@]1(CC=C)N=C(O[C@@H]1c2ccccc2)c3ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C03 compound treatment 2595.0 507.42 0.4376 2025.0 89.656 0.0726 0.3608 0.8133 3636109 DAlc3.1-H_000367 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)NCC=C)[C@@]24C(=O)Nc5ccccc54)C(=O)O[C@H]([C@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C04 compound treatment 657.0 -1430.6 -1.2338 423.0 -1512.3 -1.2252 -1.7388 -1.0 3636111 DAlc3.1-H_000368 COC(=O)[C@@]1(CC=C)N=C(O[C@H]1c2ccccc2)c3ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C05 compound treatment 2015.0 -72.578 -0.0626 2188.0 252.66 0.2047 0.1005 0.4694 3636112 DAlc3.1-H_000369 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@@H]2N3[C@H]([C@H](C(=O)N4CCN(CC4)c5ncccn5)[C@@]26C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)C(=O)O[C@H]([C@H]3c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C06 compound treatment 1202.0 -885.58 -0.7638 1140.0 -795.34 -0.6443 -0.9957 -0.9964 3556560 DAlc3.1-H_000370 COC(=O)[C@]1(Cc2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C07 compound treatment 2412.0 324.42 0.2798 1793.0 -142.34 -0.1153 0.1163 0.3843 3636114 DAlc3.1-H_000371 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)NCC=C)[C@@]24C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)C(=O)O[C@H]([C@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C08 compound treatment 79.0 -2008.6 -1.7323 109.0 -1826.3 -1.4795 -2.2711 -0.9969 3636116 DAlc3.1-H_000372 COC(=O)[C@@]1(CCS(=O)(=O)c2ccccc2)N=C(O[C@H]1c3ccccc3)c4ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C09 compound treatment 215.0 -1872.6 -1.615 304.0 -1631.3 -1.3216 -2.0765 -0.995 3636117 DAlc3.1-H_000373 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)N4CCCCCCC4)[C@@]25C(=O)Nc6ccccc65)C(=O)O[C@H]([C@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C10 compound treatment 665.0 -1422.6 -1.2269 690.0 -1245.3 -1.0089 -1.5809 -0.9953 3636119 DAlc3.1-H_000374 CC(C)(C)OC(=O)CC[C@]12N=C(O[C@@H]2c3ccccc3CN(CCS(=O)(=O)c4ccccc4)C1=O)c5ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C11 mock treatment 1965.0 -122.58 -0.1057 2400.0 464.66 0.3764 0.1914 0.4896 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C12 mock treatment 2028.0 -59.578 -0.0514 2051.0 115.66 0.0937 0.0299 0.28 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C13 compound treatment 1442.0 -645.58 -0.5568 1503.0 -432.34 -0.3502 -0.6414 -0.975 3636121 DAlc3.1-H_000375 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5)[C@]36C(=O)Nc7ccccc76)[C@@H]([C@@H](OC4=O)c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C14 compound treatment 1303.0 -784.58 -0.6767 851.0 -1084.3 -0.8784 -1.0996 -0.9917 3636123 DAlc3.1-H_000376 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4)[C@H](O2)c5ccccc5CN(CCS(=O)(=O)c6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C15 mock treatment 2372.0 284.42 0.2453 2326.0 390.66 0.3165 0.3972 0.9921 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C16 mock treatment 1463.0 -624.58 -0.5387 1439.0 -496.34 -0.4021 -0.6652 -0.9896 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C17 compound treatment 1942.0 -145.58 -0.1256 1674.0 -261.34 -0.2117 -0.2385 -0.9689 3636125 DAlc3.1-H_000377 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@H]2N3[C@@H]([C@@H](C(=O)N4CCN(CC4)c5ncccn5)[C@]26C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)C(=O)O[C@@H]([C@@H]3c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C18 compound treatment 104.0 -1983.6 -1.7108 146.0 -1789.3 -1.4496 -2.2347 -0.9966 3636126 DAlc3.1-H_000378 CC(C)(C)OC(=O)CC[C@@]12N=C(O[C@H]2c3ccccc3CN(CC=C)C1=O)c4ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C19 compound treatment 1436.0 -651.58 -0.562 1462.0 -473.34 -0.3835 -0.6685 -0.9826 3636128 DAlc3.1-H_000379 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)NCC=C)[C@]24C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)C(=O)O[C@@H]([C@@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C20 compound treatment 86.0 -2001.6 -1.7263 125.0 -1810.3 -1.4666 -2.2577 -0.9967 3636129 DAlc3.1-H_000380 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(CC=C)[C@H](O2)c4ccccc4CN(CCS(=O)(=O)c5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C21 compound treatment 966.0 -1121.6 -0.9673 1075.0 -860.34 -0.697 -1.1768 -0.9871 3636131 DAlc3.1-H_000381 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCN(CC9)c%10ncccn%10)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C22 compound treatment 145.0 -1942.6 -1.6754 114.0 -1821.3 -1.4755 -2.228 -0.998 3636133 DAlc3.1-H_000382 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4CN(CCS(=O)(=O)c5ccccc5)C3=O)[C@@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C23 compound treatment 693.0 -1394.6 -1.2028 907.0 -1028.3 -0.8331 -1.4396 -0.9839 3636135 DAlc3.1-H_000383 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)N4CCN(CC4)c5ncccn5)[C@]26C(=O)Nc7ccc(C#CC8(O)CCCCCC8)cc76)C(=O)O[C@@H]([C@@H]3c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 C24 compound treatment 12.0 -2075.6 -1.7901 24.0 -1911.3 -1.5484 -2.3607 -0.9974 3636137 DAlc3.1-H_000384 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4CN(Cc5ccccc5)C3=O)[C@@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D01 compound treatment 1516.0 -571.58 -0.493 1679.0 -256.34 -0.2077 -0.4954 -0.9262 3636139 DAlc3.1-H_000385 Cc1ccc(S[C@@]2(CC(=O)N([C@@H]2c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)C4CCCCC4)C(=O)NC5CC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D02 compound treatment 26.0 -2061.6 -1.778 34.0 -1901.3 -1.5403 -2.3464 -0.9974 3636141 DAlc3.1-H_000386 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccccc4)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D03 compound treatment 1484.0 -603.58 -0.5206 1464.0 -471.34 -0.3818 -0.6381 -0.9884 3636142 DAlc3.1-H_000387 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3C(F)(F)F)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)C(=O)NCCN5CCOCC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D04 compound treatment 2222.0 134.42 0.1159 2134.0 198.66 0.1609 0.1958 0.987 3636144 DAlc3.1-H_000388 C[N+](C)(C)CCCC[C@@H]1NC(=O)[C@@H]2C[C@@H]([C@@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D05 compound treatment 2204.0 116.42 0.1004 1800.0 -135.34 -0.1096 -0.0065 -0.0439 3636146 DAlc3.1-H_000389 COc1ccc(CCNC(=O)[C@]2(CC(=O)N(Cc3ccccc3Cl)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)Sc5ccc(C)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D06 compound treatment 2536.0 448.42 0.3867 2127.0 191.66 0.1553 0.3833 0.9196 3636148 DAlc3.1-H_000390 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)CNC3=O)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D07 compound treatment 2878.0 790.42 0.6817 1859.0 -76.344 -0.0618 0.4383 0.6403 3636150 DAlc3.1-H_000391 Cc1ccc(S[C@@]2(CC(=O)N(C3Cc4ccccc4C3)[C@@H]2c5ccc(COC(=O)NCCCCCC(=O)NO)cc5)C(=O)NCC(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D08 compound treatment 2529.0 441.42 0.3807 2198.0 262.66 0.2128 0.4197 0.9622 3636152 DAlc3.1-H_000392 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@@H]4CCCN4C3=O)C(=O)NCc5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D09 compound treatment 2235.0 147.42 0.1271 2130.0 194.66 0.1577 0.2014 0.9943 3636154 DAlc3.1-H_000393 COc1ccc(CCNC(=O)[C@]2(CC(=O)N(Cc3ccccc3)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)Sc5ccc(C)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D10 compound treatment 1933.0 -154.58 -0.1333 1659.0 -276.34 -0.2239 -0.2526 -0.9693 3636156 DAlc3.1-H_000394 C[N+](C)(C)CCCCCCNC(=O)[C@@H]1C[C@H]2N([C@@H]1c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)[C@H](CCCC[N+](C)(C)C)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D11 mock treatment 2762.0 674.42 0.5817 2469.0 533.66 0.4323 0.717 0.9893 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D12 mock treatment 2074.0 -13.578 -0.0117 1853.0 -82.344 -0.0667 -0.0555 -0.8187 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D13 compound treatment 2339.0 251.42 0.2168 1951.0 15.656 0.0127 0.1623 0.7472 3636158 DAlc3.1-H_000395 CC(C)NC(=O)[C@]1(CC(=O)N(C(C)C)[C@@H]1c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)Sc3ccc(C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D14 compound treatment 1157.0 -930.58 -0.8026 1543.0 -392.34 -0.3178 -0.7923 -0.9178 3636160 DAlc3.1-H_000396 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)NCc5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D15 mock treatment 2038.0 -49.578 -0.0428 2085.0 149.66 0.1212 0.0555 0.4317 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D16 mock treatment 1580.0 -507.58 -0.4378 1881.0 -54.344 -0.044 -0.3407 -0.7743 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D17 compound treatment 2160.0 72.422 0.0625 2124.0 188.66 0.1528 0.1522 0.9221 3636162 DAlc3.1-H_000397 COc1ccccc1CN2[C@@H](c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)[C@]4(Cc5ccccc5N(CCN6CCOCC6)C4=O)c7ccccc7C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D18 compound treatment 1772.0 -315.58 -0.2722 1291.0 -644.34 -0.522 -0.5616 -0.9539 3636164 DAlc3.1-H_000398 C[N+](C)(C)CCCC[C@@H]1NC(=O)[C@@H]2C[C@@H]([C@@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D19 compound treatment 1845.0 -242.58 -0.2092 1777.0 -158.34 -0.1283 -0.2386 -0.9724 3636166 DAlc3.1-H_000399 COc1ccc(CCN2C(=O)[C@]3(Cc4ccccc24)[C@@H](N(C5CCCCC5)C(=O)c6ccccc63)c7ccc(COC(=O)NCCCCCC(=O)NO)cc7)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D20 compound treatment 990.0 -1097.6 -0.9466 1175.0 -760.34 -0.616 -1.1049 -0.9783 3636168 DAlc3.1-H_000400 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)CNC3=O)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D21 compound treatment 1371.0 -716.58 -0.618 1372.0 -563.34 -0.4564 -0.7597 -0.9889 3636170 DAlc3.1-H_000401 COCCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(C4CCCCC4)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D22 compound treatment 1025.0 -1062.6 -0.9164 1072.0 -863.34 -0.6994 -1.1426 -0.9911 3636172 DAlc3.1-H_000402 CN(C)CCCC[C@@H]1NC(=O)[C@@H]2C[C@@H]([C@@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D23 compound treatment 705.0 -1382.6 -1.1924 1026.0 -909.34 -0.7367 -1.3641 -0.9732 3636174 DAlc3.1-H_000403 CC(C)NC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 D24 compound treatment 829.0 -1258.6 -1.0855 614.0 -1321.3 -1.0704 -1.5245 -1.0 3636176 DAlc3.1-H_000404 C[N+](C)(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E01 mock treatment 1833.0 -254.58 -0.2196 1211.0 -724.34 -0.5868 -0.5702 -0.9101 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E02 mock treatment 2113.0 25.422 0.0219 2046.0 110.66 0.0896 0.0789 0.8549 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E03 compound treatment 2357.0 269.42 0.2324 1624.0 -311.34 -0.2522 -0.014 -0.0409 3636177 DAlc3.1-H_000405 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCc%10cc(OC)c(OC)cc%10C9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E04 compound treatment 498.0 -1589.6 -1.3709 102.0 -1833.3 -1.4852 -2.0196 -0.9992 3636179 DAlc3.1-H_000406 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4CN(Cc5ccccc5)C3=O)[C@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E05 compound treatment 2468.0 380.42 0.3281 1919.0 -16.344 -0.0132 0.2226 0.678 3636180 DAlc3.1-H_000407 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@H]2N3[C@@H]([C@@H](C(=O)N4CCCCCCC4)[C@]25C(=O)Nc6ccc(C#CC7(O)CCCCCC7)cc65)C(=O)O[C@@H]([C@@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E06 compound treatment 145.0 -1942.6 -1.6754 194.0 -1741.3 -1.4107 -2.1822 -0.9963 3636182 DAlc3.1-H_000408 CC(C)(C)OC(=O)CC[C@@]12N=C(O[C@H]2c3ccccc3CN(CCS(=O)(=O)c4ccccc4)C1=O)c5ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E07 compound treatment 3042.0 954.42 0.8231 2027.0 91.656 0.0743 0.6346 0.7678 3636183 DAlc3.1-H_000409 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)N4CCN(CC4)c5ncccn5)[C@@]26C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)C(=O)O[C@H]([C@H]3c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E08 compound treatment 762.0 -1325.6 -1.1433 311.0 -1624.3 -1.3159 -1.7389 -0.9975 3636185 DAlc3.1-H_000410 CC(C)(C)OC(=O)CC[C@]12N=C(O[C@@H]2c3ccccc3CN(CC=C)C1=O)c4ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E09 mock treatment 3004.0 916.42 0.7904 2585.0 649.66 0.5263 0.931 0.9805 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E10 mock treatment 2019.0 -68.578 -0.0591 1398.0 -537.34 -0.4353 -0.3496 -0.7959 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E11 compound treatment 2598.0 510.42 0.4402 2730.0 794.66 0.6438 0.7665 0.9828 3636186 DAlc3.1-H_000411 NC(=O)NCC#Cc1ccc2NC(=O)[C@@]3([C@H]([C@H]4N([C@H]3c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5)[C@@H]([C@@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E12 compound treatment 568.0 -1519.6 -1.3106 191.0 -1744.3 -1.4131 -1.9259 -0.9993 3636187 DAlc3.1-H_000412 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(CC=C)[C@@H](O2)c4ccccc4CN(CCS(=O)(=O)c5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E13 compound treatment 2815.0 727.42 0.6274 2104.0 168.66 0.1366 0.5402 0.8414 3636188 DAlc3.1-H_000413 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccccc3OCCOC(=O)NCCCCCC(=O)NO)[C@]14C(=O)Nc5ccc(C#CC6=CCCCC6)cc54)[C@@H]([C@@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E14 compound treatment 652.0 -1435.6 -1.2381 384.0 -1551.3 -1.2568 -1.7642 -1.0 3636190 DAlc3.1-H_000414 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4)[C@@H](O2)c5ccccc5CN(CC=C)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E15 compound treatment 1958.0 -129.58 -0.1118 1466.0 -469.34 -0.3802 -0.3479 -0.8778 3636192 DAlc3.1-H_000415 COc1cc2CCN(Cc2cc1OC)C(=O)[C@@H]3[C@@H]4N([C@H](c5ccccc5OCCOC(=O)NCCCCCC(=O)NO)[C@@]36C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)[C@H]([C@H](OC4=O)c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E16 compound treatment 1486.0 -601.58 -0.5188 1035.0 -900.34 -0.7294 -0.8826 -0.9861 3636194 DAlc3.1-H_000416 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4)[C@H](O2)c5ccccc5CN(CC=C)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E17 mock treatment 2195.0 107.42 0.0926 2161.0 225.66 0.1828 0.1948 0.9504 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E18 mock treatment 1643.0 -444.58 -0.3834 978.0 -957.34 -0.7756 -0.8195 -0.9473 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E19 compound treatment 1574.0 -513.58 -0.4429 898.0 -1037.3 -0.8404 -0.9074 -0.9552 3636195 DAlc3.1-H_000417 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@@H]2N3[C@H]([C@H](C(=O)N4CCCCCCC4)[C@@]25C(=O)Nc6ccccc65)C(=O)O[C@H]([C@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E20 compound treatment 17.0 -2070.6 -1.7858 13.0 -1922.3 -1.5573 -2.3639 -0.9977 3636197 DAlc3.1-H_000418 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@](CCS(=O)(=O)c3ccccc3)([C@H](O2)c4ccccc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E21 compound treatment 1382.0 -705.58 -0.6085 1279.0 -656.34 -0.5317 -0.8063 -0.9977 3636198 DAlc3.1-H_000419 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccccc3OCCOC(=O)NCCCCCC(=O)NO)[C@@]14C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)[C@H]([C@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E22 compound treatment 107.0 -1980.6 -1.7082 152.0 -1783.3 -1.4447 -2.2294 -0.9965 3636200 DAlc3.1-H_000420 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@](CCS(=O)(=O)c3ccccc3)(CO2)C(=O)NCCN4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E23 compound treatment 916.0 -1171.6 -1.0104 1149.0 -786.34 -0.637 -1.1649 -0.9753 3636202 DAlc3.1-H_000421 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccc(OCCOC(=O)NCCCCCC(=O)NO)cc6)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 E24 compound treatment 37.0 -2050.6 -1.7685 76.0 -1859.3 -1.5063 -2.3156 -0.9968 3636204 DAlc3.1-H_000422 COCCCNC(=O)[C@@]1(CC=C)COC(=N1)c2ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F01 mock treatment 2099.0 11.422 0.0099 1034.0 -901.34 -0.7302 -0.5094 -0.6975 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F02 mock treatment 2224.0 136.42 0.1177 2815.0 879.66 0.7126 0.5871 0.8128 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F03 compound treatment 1899.0 -188.58 -0.1626 1162.0 -773.34 -0.6265 -0.558 -0.8621 3636206 DAlc3.1-H_000423 CN(C)CCCNC(=O)[C@H]1[C@@H](N(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)c3ccccc13)c4ccc(COC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F04 compound treatment 2907.0 819.42 0.7067 1656.0 -279.34 -0.2263 0.3397 0.4578 3636208 DAlc3.1-H_000424 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F05 compound treatment 1710.0 -377.58 -0.3256 522.0 -1413.3 -1.145 -1.0399 -0.8736 3636210 DAlc3.1-H_000425 C[C@]1([C@@H](N(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)c3ccccc31)c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F06 compound treatment 2685.0 597.42 0.5153 1818.0 -117.34 -0.0951 0.2971 0.5671 3636212 DAlc3.1-H_000426 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)OCCOc5ccc(cc5)[C@@H]6N7[C@H]([C@H](C(=O)OCC=C)[C@@]68C(=O)Nc9ccccc98)C(=O)O[C@H]([C@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F07 compound treatment 1925.0 -162.58 -0.1402 1199.0 -736.34 -0.5965 -0.521 -0.8501 3636214 DAlc3.1-H_000427 CCCNC(=O)[C@H]1[C@@H](N(C2Cc3ccccc3C2)C(=O)c4ccccc14)c5ccc(COC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F08 compound treatment 2312.0 224.42 0.1936 1447.0 -488.34 -0.3956 -0.1429 -0.3244 3636216 DAlc3.1-H_000428 CC(C)C[C@@H]1NC(=O)[C@@H]2C[C@@H]([C@@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F09 mock treatment 2936.0 848.42 0.7317 1897.0 -38.344 -0.0311 0.4954 0.6765 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F10 mock treatment 3239.0 1151.4 0.9931 1647.0 -288.34 -0.2336 0.537 0.5264 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F11 compound treatment 2546.0 458.42 0.3954 1018.0 -917.34 -0.7432 -0.2459 -0.2921 3636217 DAlc3.1-H_000429 CCCNC(=O)[C@H]1[C@@H](N(Cc2ccccc2C(F)(F)F)C(=O)c3ccccc13)c4ccc(COC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F12 compound treatment 2626.0 538.42 0.4644 2406.0 470.66 0.3813 0.598 0.9952 3636219 DAlc3.1-H_000430 CN(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F13 compound treatment 3221.0 1133.4 0.9775 1888.0 -47.344 -0.0384 0.6641 0.6788 3636220 DAlc3.1-H_000431 CC(C)CNC(=O)[C@H]1[C@@H](N(Cc2ccccc2C(F)(F)F)C(=O)c3ccccc13)c4ccc(COC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F14 compound treatment 3142.0 1054.4 0.9094 1339.0 -596.34 -0.4831 0.3014 0.2927 3636222 DAlc3.1-H_000432 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)CNC3=O)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F15 compound treatment 3147.0 1059.4 0.9137 2243.0 307.66 0.2492 0.8223 0.8683 3636223 DAlc3.1-H_000433 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3Cl)C(=O)c4ccccc4[C@]52Cc6ccccc6N(CCN7CCOCC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F16 compound treatment 2960.0 872.42 0.7524 1515.0 -420.34 -0.3405 0.2913 0.3527 3636225 DAlc3.1-H_000434 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)OCCOc5ccc(cc5)[C@@H]6N7[C@H]([C@H](C(=O)OCC=C)[C@@]68C(=O)Nc9ccccc98)C(=O)O[C@H]([C@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F17 mock treatment 3142.0 1054.4 0.9094 1991.0 55.656 0.0451 0.6749 0.7413 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F18 mock treatment 2323.0 235.42 0.203 2682.0 746.66 0.6049 0.5713 0.8954 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F19 compound treatment 1810.0 -277.58 -0.2394 1799.0 -136.34 -0.1105 -0.2474 -0.9383 3636226 DAlc3.1-H_000435 CC(C)CN1C(=O)[C@]2(CC(=O)N(CC3C4CC5CC(C4)CC3C5)[C@@H]2c6ccc(COC(=O)NCCCCCC(=O)NO)cc16)c7ccc(cc7)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F20 compound treatment 1608.0 -479.58 -0.4136 1122.0 -813.34 -0.6589 -0.7584 -0.9748 3636228 DAlc3.1-H_000436 C[N+](C)(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F21 compound treatment 1160.0 -927.58 -0.8 451.0 -1484.3 -1.2025 -1.416 -0.9804 3636230 DAlc3.1-H_000437 CN1C(=O)C2C(C3C(N(Cc4cccc(OC(F)(F)F)c4)C2C=C3CCCOC(=O)NCCCCCC(=O)NO)c5ccc(CN6CCCC6)cc5)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F22 compound treatment 1801.0 -286.58 -0.2472 1244.0 -691.34 -0.5601 -0.5708 -0.9324 3636231 DAlc3.1-H_000438 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)CNC3=O)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F23 compound treatment 825.0 -1262.6 -1.0889 600.0 -1335.3 -1.0818 -1.5349 -1.0 3636233 DAlc3.1-H_000439 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)c2cc[n+](Cc3sc4ccccc4c3Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 F24 compound treatment 994.0 -1093.6 -0.9432 1355.0 -580.34 -0.4701 -0.9994 -0.9483 3636234 DAlc3.1-H_000440 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@H]5N6[C@@H]([C@@H](C(=O)OCC=C)[C@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@@H]([C@@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G01 compound treatment 1031.0 -1056.6 -0.9113 770.0 -1165.3 -0.9441 -1.3119 -0.9998 3636236 DAlc3.1-H_000441 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G02 compound treatment 21.0 -2066.6 -1.7823 17.0 -1918.3 -1.5541 -2.3592 -0.9977 3636238 DAlc3.1-H_000442 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@](Cc3ccccc3)([C@H](O2)c4ccccc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G03 mock treatment 1624.0 -463.58 -0.3998 1711.0 -224.34 -0.1817 -0.4112 -0.9363 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G04 mock treatment 1576.0 -511.58 -0.4412 1211.0 -724.34 -0.5868 -0.7269 -0.9901 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G05 compound treatment 523.0 -1564.6 -1.3494 306.0 -1629.3 -1.32 -1.8875 -0.9999 3636239 DAlc3.1-H_000443 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)NCC=C)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G06 compound treatment 372.0 -1715.6 -1.4796 328.0 -1607.3 -1.3021 -1.967 -0.998 3636241 DAlc3.1-H_000444 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@](CC=C)(CO2)C(=O)NCCN3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G07 compound treatment 1897.0 -190.58 -0.1644 1403.0 -532.34 -0.4313 -0.4212 -0.9126 3636243 DAlc3.1-H_000445 COc1cc2CCN(Cc2cc1OC)C(=O)[C@@H]3[C@@H]4N([C@H](c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5)[C@@]36C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)[C@H]([C@H](OC4=O)c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G08 compound treatment 7.0 -2080.6 -1.7944 4.0 -1931.3 -1.5646 -2.3752 -0.9977 3636245 DAlc3.1-H_000446 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@](Cc3ccccc3)(CO2)C(=O)NCCN4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G09 compound treatment 292.0 -1795.6 -1.5486 231.0 -1704.3 -1.3807 -2.0713 -0.9984 3636247 DAlc3.1-H_000447 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)N4CCN(CC4)c5ncccn5)[C@]26C(=O)Nc7ccccc76)C(=O)O[C@@H]([C@@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G10 compound treatment 221.0 -1866.6 -1.6098 12.0 -1923.3 -1.5581 -2.2401 -0.9999 3636249 DAlc3.1-H_000448 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@](Cc3ccccc3)([C@H](O2)c4ccccc4)C(=O)N5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G11 compound treatment 1022.0 -1065.6 -0.919 737.0 -1198.3 -0.9708 -1.3363 -0.9996 3636250 DAlc3.1-H_000449 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccc(OCCOC(=O)NCCCCCC(=O)NO)cc6)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G12 compound treatment 4.0 -2083.6 -1.797 8.0 -1927.3 -1.5614 -2.3747 -0.9975 3636251 DAlc3.1-H_000450 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(CCS(=O)(=O)c4ccccc4)[C@H](O2)c5ccccc5CN(Cc6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G13 compound treatment 236.0 -1851.6 -1.5969 375.0 -1560.3 -1.2641 -2.023 -0.9933 3636253 DAlc3.1-H_000451 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)N4CCCCCCC4)[C@]25C(=O)Nc6ccccc65)C(=O)O[C@@H]([C@@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G14 compound treatment 7.0 -2080.6 -1.7944 7.0 -1928.3 -1.5622 -2.3735 -0.9976 3556554 DAlc3.1-H_000452 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4)[C@@H](O2)c5ccccc5CN(Cc6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G15 compound treatment 73.0 -2014.6 -1.7375 111.0 -1824.3 -1.4779 -2.2736 -0.9968 3636254 DAlc3.1-H_000453 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCCCCCC9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G16 compound treatment 0.0 -2087.6 -1.8004 0.0 -1935.3 -1.5678 -2.3817 -0.9976 3636256 DAlc3.1-H_000454 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4CN(C(=O)c5ccccc5)C3=O)[C@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G17 compound treatment 271.0 -1816.6 -1.5667 265.0 -1670.3 -1.3532 -2.0647 -0.9973 3636258 DAlc3.1-H_000455 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)N4CCCCCCC4)[C@]25C(=O)Nc6ccc(C#CC7=CCCCC7)cc65)C(=O)O[C@@H]([C@@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G18 compound treatment 0.0 -2087.6 -1.8004 3.0 -1932.3 -1.5654 -2.38 -0.9976 3636260 DAlc3.1-H_000456 CC(C)(C)OC(=O)CC[C@@]12N=C(O[C@H]2c3ccccc3CN(C(=O)c4ccccc4)C1=O)c5ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G19 mock treatment 894.0 -1193.6 -1.0294 836.0 -1099.3 -0.8906 -1.3576 -0.9974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G20 mock treatment 685.0 -1402.6 -1.2097 518.0 -1417.3 -1.1482 -1.6673 -0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G21 compound treatment 431.0 -1656.6 -1.4287 323.0 -1612.3 -1.3062 -1.9339 -0.999 3636262 DAlc3.1-H_000457 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G22 compound treatment 1.0 -2086.6 -1.7996 0.0 -1935.3 -1.5678 -2.3811 -0.9976 3636263 DAlc3.1-H_000458 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(CC=C)[C@@H](O2)c4ccccc4CN(C(=O)c5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G23 compound treatment 366.0 -1721.6 -1.4848 261.0 -1674.3 -1.3564 -2.009 -0.999 3636265 DAlc3.1-H_000459 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccc(OCCOC(=O)NCCCCCC(=O)NO)cc3)[C@@]14C(=O)Nc5ccccc54)[C@H]([C@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 G24 compound treatment 3.0 -2084.6 -1.7979 0.0 -1935.3 -1.5678 -2.3799 -0.9977 3636267 DAlc3.1-H_000460 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4)[C@H](O2)c5ccccc5CN(Cc6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H01 compound treatment 1128.0 -959.58 -0.8276 1226.0 -709.34 -0.5746 -0.9915 -0.9841 3636268 DAlc3.1-H_000461 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)c2cc[n+](Cc3cc4OCOc4cc3Br)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H02 compound treatment 2163.0 75.422 0.065 2225.0 289.66 0.2347 0.2119 0.8703 3636269 DAlc3.1-H_000462 CN(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H03 mock treatment 3015.0 927.42 0.7999 3228.0 1292.7 1.0472 1.3061 0.9912 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H04 mock treatment 2483.0 395.42 0.341 2462.0 526.66 0.4267 0.5428 0.9938 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H05 compound treatment 1922.0 -165.58 -0.1428 1664.0 -271.34 -0.2198 -0.2564 -0.9782 3636271 DAlc3.1-H_000463 CN1C(=O)C2C(C3C(N(Cc4cccc(OC(F)(F)F)c4)C2C=C3CCCOC(=O)NCCCCCC(=O)NO)c5cccs5)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H06 compound treatment 2790.0 702.42 0.6058 2768.0 832.66 0.6745 0.9053 0.9986 3636272 DAlc3.1-H_000464 CC(=O)NCCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H07 compound treatment 3003.0 915.42 0.7895 2484.0 548.66 0.4445 0.8726 0.9631 3636274 DAlc3.1-H_000465 CN1C(=O)C2C(C3C(N(Cc4cc5OCOc5cc4Br)C2C=C3CCCOC(=O)NCCCCCC(=O)NO)c6ccc(CN7CCCC7)cc6)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H08 compound treatment 2836.0 748.42 0.6455 2277.0 341.66 0.2768 0.6521 0.9285 3636275 DAlc3.1-H_000466 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)OCCOc5ccc(cc5)[C@@H]6N7[C@H]([C@H](C(=O)OCC=C)[C@@]68C(=O)Nc9ccc(I)cc98)C(=O)O[C@H]([C@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H09 compound treatment 1258.0 -829.58 -0.7155 945.0 -990.34 -0.8023 -1.0732 -0.9984 3636277 DAlc3.1-H_000467 ONC(=O)CCCCCNC(=O)OCCCc1cc[n+](Cc2sc3ccccc3c2Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H10 compound treatment 2511.0 423.42 0.3652 2219.0 283.66 0.2298 0.4207 0.9751 3636278 DAlc3.1-H_000468 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H11 compound treatment 2159.0 71.422 0.0616 2342.0 406.66 0.3294 0.2765 0.825 3636279 DAlc3.1-H_000469 CN1C(=O)C2C(C3C(N(Cc4sc5ccccc5c4Cl)C2C=C3CCCOC(=O)NCCCCCC(=O)NO)c6ccc(CN7CCCC7)cc6)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H12 compound treatment 2292.0 204.42 0.1763 2158.0 222.66 0.1804 0.2522 0.9999 3636280 DAlc3.1-H_000470 CN(C)CCCCNC(=O)[C@@H]1C[C@H]2N([C@@H]1c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)[C@@H]4CCCN4C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H13 compound treatment 1368.0 -719.58 -0.6206 903.0 -1032.3 -0.8363 -1.0302 -0.9892 3636282 DAlc3.1-H_000471 CN1C(=O)C2C(C3C(C4CC4)N(Cc5sc6ccccc6c5Cl)C2C=C3CCCOC(=O)NCCCCCC(=O)NO)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H14 compound treatment 470.0 -1617.6 -1.3951 657.0 -1278.3 -1.0356 -1.7188 -0.9892 3636283 DAlc3.1-H_000472 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccc(cc4)N5CCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H15 compound treatment 1474.0 -613.58 -0.5292 1577.0 -358.34 -0.2903 -0.5795 -0.96 3636285 DAlc3.1-H_000473 ONC(=O)CCCCCNC(=O)OCCCC1=CC(N(Cc2cccc(OC(F)(F)F)c2)/C(=N\P(=O)(Oc3ccccc3)Oc4ccccc4)/C1)c5ccc(CN6CCCC6)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H16 compound treatment 749.0 -1338.6 -1.1545 487.0 -1448.3 -1.1733 -1.646 -1.0 3636287 DAlc3.1-H_000474 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CC(=O)N(CCOC(=O)NCCCCCC(=O)NO)Cc4ccccc4)C(=O)N(Cc5cccc(I)c5)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H17 compound treatment 690.0 -1397.6 -1.2054 947.0 -988.34 -0.8007 -1.4185 -0.9803 3636289 DAlc3.1-H_000475 ONC(=O)CCCCCNC(=O)OCCCC1=CC(C2CC2)N(Cc3cc4OCOc4cc3Br)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H18 compound treatment 1355.0 -732.58 -0.6318 1481.0 -454.34 -0.3681 -0.707 -0.9669 3636290 DAlc3.1-H_000476 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(Cc5cccc(c5)N6CCC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H19 mock treatment 1861.0 -226.58 -0.1954 2130.0 194.66 0.1577 -0.0267 -0.1062 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H20 mock treatment 1395.0 -692.58 -0.5973 1733.0 -202.34 -0.1639 -0.5383 -0.869 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H21 compound treatment 790.0 -1297.6 -1.1191 843.0 -1092.3 -0.8849 -1.4171 -0.9932 3636291 DAlc3.1-H_000477 CC1C=C(CCCOC(=O)NCCCCCC(=O)NO)CCN1Cc2cccc(OC(F)(F)F)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H22 compound treatment 5.0 -2082.6 -1.7961 21.0 -1914.3 -1.5508 -2.3667 -0.9973 3556685 DAlc3.1-H_000478 COc1ccc(NC(=O)O[C@H]([C@@H](C)C=C)c2ccc(OCCOC(=O)NCCCCCC(=O)NO)cc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H23 compound treatment 293.0 -1794.6 -1.5477 401.0 -1534.3 -1.243 -1.9734 -0.9941 3636292 DAlc3.1-H_000479 ONC(=O)CCCCCNC(=O)OCCCC1=CC(C2CC2)N(Cc3sc4ccccc4c3Cl)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 H24 compound treatment 57.0 -2030.6 -1.7513 81.0 -1854.3 -1.5022 -2.3006 -0.9971 3636293 DAlc3.1-H_000480 CO[C@H](C=C)[C@H](OC(=O)Nc1ccc(OC)cc1)c2ccc(OCCOC(=O)NCCCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I01 compound treatment 1104.0 -983.58 -0.8483 1370.0 -565.34 -0.458 -0.9237 -0.9581 3636295 DAlc3.1-H_000481 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@H]2N3[C@@H]([C@@H](C(=O)N4CCCCCCC4)[C@]25C(=O)Nc6ccccc65)C(=O)O[C@@H]([C@@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I02 compound treatment 234.0 -1853.6 -1.5986 144.0 -1791.3 -1.4512 -2.1566 -0.9988 3636296 DAlc3.1-H_000482 CC(C)(C)OC(=O)CC[C@]12N=C(O[C@@H]2c3ccccc3CN(C(=O)c4ccccc4)C1=O)c5ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I03 compound treatment 2372.0 284.42 0.2453 1458.0 -477.34 -0.3867 -0.1 -0.2183 3636297 DAlc3.1-H_000483 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)N4CCN(CC4)c5ncccn5)[C@@]26C(=O)Nc7ccccc76)C(=O)O[C@H]([C@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I04 compound treatment 930.0 -1157.6 -0.9984 181.0 -1754.3 -1.4212 -1.7109 -0.9851 3636298 DAlc3.1-H_000484 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(CC=C)[C@H](O2)c4ccccc4CN(C(=O)c5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I05 mock treatment 711.0 -1376.6 -1.1872 450.0 -1485.3 -1.2033 -1.6904 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I06 mock treatment 3263.0 1175.4 1.0138 2226.0 290.66 0.2355 0.8833 0.8488 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I07 compound treatment 2775.0 687.42 0.5929 2233.0 297.66 0.2411 0.5897 0.9214 3636299 DAlc3.1-H_000485 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCN(CC9)c%10ncccn%10)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I08 compound treatment 114.0 -1973.6 -1.7021 74.0 -1861.3 -1.5079 -2.2698 -0.9982 3636300 DAlc3.1-H_000486 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(CCS(=O)(=O)c4ccccc4)[C@@H](O2)c5ccccc5CN(C(=O)c6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I09 compound treatment 1999.0 -88.578 -0.0764 2029.0 93.656 0.0759 -4.0E-4 -0.0034 3636302 DAlc3.1-H_000487 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCc%10cc(OC)c(OC)cc%10C9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I10 compound treatment 1232.0 -855.58 -0.7379 444.0 -1491.3 -1.2082 -1.3761 -0.972 3636303 DAlc3.1-H_000488 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(CC=C)[C@@H](O2)c4ccccc4CN(Cc5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I11 compound treatment 2080.0 -7.5781 -0.0065 2135.0 199.66 0.1617 0.1097 0.678 3636305 DAlc3.1-H_000489 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccccc3OCCOC(=O)NCCCCCC(=O)NO)[C@]14C(=O)Nc5ccccc54)[C@@H]([C@@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I12 compound treatment 86.0 -2001.6 -1.7263 46.0 -1889.3 -1.5306 -2.3029 -0.9982 3636307 DAlc3.1-H_000490 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(CCS(=O)(=O)c4ccccc4)[C@H](O2)c5ccccc5CN(C(=O)c6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I13 compound treatment 2008.0 -79.578 -0.0686 1853.0 -82.344 -0.0667 -0.0957 -0.9999 3636308 DAlc3.1-H_000491 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5)[C@]36C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)[C@@H]([C@@H](OC4=O)c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I14 compound treatment 374.0 -1713.6 -1.4779 191.0 -1744.3 -1.4131 -2.0443 -0.9997 3636309 DAlc3.1-H_000492 CC(C)(C)OC(=O)CC[C@@]12N=C(O[C@H]2c3ccccc3CN(Cc4ccccc4)C1=O)c5ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I15 compound treatment 2283.0 195.42 0.1685 2018.0 82.656 0.067 0.1665 0.9182 3636311 DAlc3.1-H_000493 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccccc3OCCOC(=O)NCCCCCC(=O)NO)[C@@]14C(=O)Nc5ccc(C#CC6=CCCCC6)cc54)[C@H]([C@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I16 compound treatment 184.0 -1903.6 -1.6418 98.0 -1837.3 -1.4885 -2.2134 -0.9988 3636312 DAlc3.1-H_000494 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4)[C@H](O2)c5ccccc5CN(C(=O)c6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I17 compound treatment 1369.0 -718.58 -0.6197 1659.0 -276.34 -0.2239 -0.5965 -0.9053 3636314 DAlc3.1-H_000495 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccccc5OCCOC(=O)NCCCCCC(=O)NO)[C@]36C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)[C@@H]([C@@H](OC4=O)c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I18 compound treatment 2243.0 155.42 0.134 1953.0 17.656 0.0143 0.1049 0.7781 3636315 DAlc3.1-H_000496 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=NC(ON2c3ccccc3)C(=O)NCc4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I19 compound treatment 1516.0 -571.58 -0.493 1940.0 4.6563 0.0038 -0.3459 -0.7017 3636316 DAlc3.1-H_000497 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccc(OCCOC(=O)NCCCCCC(=O)NO)cc3)[C@]14C(=O)Nc5ccc(C#CC6=CCCCC6)cc54)[C@@H]([C@@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I20 compound treatment 1401.0 -686.58 -0.5921 1290.0 -645.34 -0.5228 -0.7884 -0.9981 3636318 DAlc3.1-H_000498 COc1ccc(CCNC(=O)[C@]2(CC(=O)N(Cc3ccccc3C(F)(F)F)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)Sc5ccc(C)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I21 mock treatment 1639.0 -448.58 -0.3869 1486.0 -449.34 -0.364 -0.531 -0.9995 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I22 mock treatment 1342.0 -745.58 -0.643 1406.0 -529.34 -0.4288 -0.7579 -0.9806 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I23 compound treatment 816.0 -1271.6 -1.0967 1051.0 -884.34 -0.7164 -1.2821 -0.9787 3636320 DAlc3.1-H_000499 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccccc3OCCOC(=O)NCCCCCC(=O)NO)[C@]14C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)[C@@H]([C@@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 I24 compound treatment 489.0 -1598.6 -1.3787 277.0 -1658.3 -1.3434 -1.9249 -0.9999 3636321 DAlc3.1-H_000500 COc1ccc(CCNC(=O)[C@]2(Cc3ccccc3I)[C@@H](N(Cc4ccccc4C(F)(F)F)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J01 compound treatment 126.0 -1961.6 -1.6918 227.0 -1708.3 -1.384 -2.1749 -0.995 3636323 DAlc3.1-H_000501 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)C2=CC(C3CC3)N(Cc4cc5OCOc5cc4Br)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J02 compound treatment 793.0 -1294.6 -1.1165 913.0 -1022.3 -0.8282 -1.3751 -0.9892 3636324 DAlc3.1-H_000502 CO[C@@H](C=C)[C@@H](OC(=O)Nc1ccc(OC)cc1)c2ccc(OCCOC(=O)NCCCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J03 compound treatment 2080.0 -7.5781 -0.0065 378.0 -1557.3 -1.2616 -0.8967 -0.7108 3636325 DAlc3.1-H_000503 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(CC=C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J04 compound treatment 1147.0 -940.58 -0.8112 918.0 -1017.3 -0.8242 -1.1564 -1.0 3636327 DAlc3.1-H_000504 COc1ccc(NC(=O)O[C@@H]([C@H](C)C=C)c2ccc(OCCOC(=O)NCCCCCC(=O)NO)cc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J05 mock treatment 2682.0 594.42 0.5127 2575.0 639.66 0.5182 0.7289 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J06 mock treatment 2375.0 287.42 0.2479 1883.0 -52.344 -0.0424 0.1453 0.5778 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J07 compound treatment 1118.0 -969.58 -0.8362 238.0 -1697.3 -1.375 -1.5636 -0.9716 3636328 DAlc3.1-H_000505 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J08 compound treatment 1729.0 -358.58 -0.3093 1683.0 -252.34 -0.2044 -0.3632 -0.9798 3636330 DAlc3.1-H_000506 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)NCc2ccccc2F)c3coc4ccccc4c3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J09 compound treatment 1409.0 -678.58 -0.5852 552.0 -1383.3 -1.1207 -1.2063 -0.9541 3556636 DAlc3.1-H_000507 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N2CCC[C@H]2COC(=O)NCCCCCC(=O)NO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J10 compound treatment 2177.0 89.422 0.0771 1754.0 -181.34 -0.1469 -0.0493 -0.2974 3636332 DAlc3.1-H_000508 COC(CN(C)C(=O)C1=C[C@@H](C[C@H](OCCCCOC(=O)NCCCCCC(=O)NO)O1)c2coc3ccccc3c2=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J11 compound treatment 150.0 -1937.6 -1.6711 28.0 -1907.3 -1.5452 -2.2742 -0.9992 3636334 DAlc3.1-H_000509 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(c5ccccc53)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J12 compound treatment 2823.0 735.42 0.6343 2716.0 780.66 0.6324 0.8957 1.0 3636336 DAlc3.1-H_000510 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCCOCCOCCOCC2)c3coc4ccccc4c3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J13 compound treatment 364.0 -1723.6 -1.4865 73.0 -1862.3 -1.5087 -2.1179 -1.0 3636338 DAlc3.1-H_000511 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(c4ccccc43)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J14 compound treatment 2647.0 559.42 0.4825 1943.0 7.6563 0.0062 0.3455 0.7161 3636340 DAlc3.1-H_000512 CN(C)CCCCCCNC(=O)[C@H]1C[C@@H]2N([C@H]1c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)[C@H](Cc4ccccc4)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J15 compound treatment 1346.0 -741.58 -0.6396 1558.0 -377.34 -0.3057 -0.6684 -0.9429 3636342 DAlc3.1-H_000513 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(c5ccccc53)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J16 compound treatment 2391.0 303.42 0.2617 2742.0 806.66 0.6535 0.6471 0.9193 3636343 DAlc3.1-H_000514 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)OCCOc4ccc(cc4)[C@H]5N6[C@@H]([C@@H](C(=O)OCC=C)[C@]57C(=O)Nc8ccccc87)C(=O)O[C@@H]([C@@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J17 compound treatment 10.0 -2077.6 -1.7918 8.0 -1927.3 -1.5614 -2.3711 -0.9976 3636344 DAlc3.1-H_000515 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccc(cc4)N5CCOC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J18 compound treatment 2717.0 629.42 0.5429 2619.0 683.66 0.5538 0.7755 0.9999 3636346 DAlc3.1-H_000516 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)NCCCCN(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J19 compound treatment 451.0 -1636.6 -1.4115 628.0 -1307.3 -1.0591 -1.747 -0.99 3556624 DAlc3.1-H_000517 COc1ccc(cc1)[Si](C)(C)[C@H](CCn2cc(CCOC(=O)NCCCCCC(=O)NO)nn2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J20 compound treatment 1756.0 -331.58 -0.286 1673.0 -262.34 -0.2125 -0.3525 -0.9893 3636348 DAlc3.1-H_000518 CC(=O)NCCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J21 mock treatment 2228.0 140.42 0.1211 2336.0 400.66 0.3246 0.3151 0.9097 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J22 mock treatment 1961.0 -126.58 -0.1092 1600.0 -335.34 -0.2717 -0.2693 -0.9198 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J23 compound treatment 811.0 -1276.6 -1.101 616.0 -1319.3 -1.0688 -1.5343 -0.9999 3556632 DAlc3.1-H_000519 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N2Cc3ccccc3C[C@H]2COC(=O)NCCCCCC(=O)NO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 J24 compound treatment 1733.0 -354.58 -0.3058 1161.0 -774.34 -0.6273 -0.6598 -0.9455 3636350 DAlc3.1-H_000520 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)OCCOc5ccc(cc5)[C@H]6N7[C@@H]([C@@H](C(=O)OCC=C)[C@]68C(=O)Nc9ccccc98)C(=O)O[C@@H]([C@@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K01 compound treatment 1619.0 -468.58 -0.4041 1806.0 -129.34 -0.1048 -0.3599 -0.8619 3636351 DAlc3.1-H_000521 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccc(OCCOC(=O)NCCCCCC(=O)NO)cc6)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCCCCCC9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K02 compound treatment 1994.0 -93.578 -0.0807 2291.0 355.66 0.2881 0.1467 0.4902 3636353 DAlc3.1-H_000522 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3Cl)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)C(=O)NCC(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K03 compound treatment 2367.0 279.42 0.241 2184.0 248.66 0.2014 0.3128 0.996 3636355 DAlc3.1-H_000523 COCCOC(=O)N1C(=O)[C@]2([C@@H]([C@@H]3N([C@@H]2c4ccccc4OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)NCC=C)c7cc(C#Cc8ccc(OC)cc8)ccc17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K04 compound treatment 2050.0 -37.578 -0.0324 1726.0 -209.34 -0.1696 -0.1428 -0.8273 3636357 DAlc3.1-H_000524 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)C(=O)NCCN5CCOCC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K05 compound treatment 1534.0 -553.58 -0.4774 1276.0 -659.34 -0.5341 -0.7153 -0.9984 3636359 DAlc3.1-H_000525 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccc(OCCOC(=O)NCCCCCC(=O)NO)cc4)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N)c7ccccc17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K06 compound treatment 2379.0 291.42 0.2513 2434.0 498.66 0.404 0.4634 0.9739 3636361 DAlc3.1-H_000526 CC(C)CNC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(COC(=O)NCCCCCC(=O)NO)cc3I)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K07 mock treatment 2707.0 619.42 0.5342 2488.0 552.66 0.4477 0.6943 0.9961 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K08 mock treatment 2580.0 492.42 0.4247 1922.0 -13.344 -0.0108 0.2927 0.6889 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K09 compound treatment 2236.0 148.42 0.128 2149.0 213.66 0.1731 0.2129 0.989 3636363 DAlc3.1-H_000527 NC(=O)NCC#Cc1ccc2NC(=O)[C@]3([C@@H]([C@@H]4N([C@@H]3c5ccccc5OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N8CCN(CC8)c9ncccn9)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K10 compound treatment 925.0 -1162.6 -1.0027 1298.0 -637.34 -0.5163 -1.0741 -0.9524 3636365 DAlc3.1-H_000528 CC(C)N1[C@H](c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NCCN4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K11 compound treatment 2111.0 23.422 0.0202 2186.0 250.66 0.2031 0.1579 0.7736 3636367 DAlc3.1-H_000529 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)O)[C@]24C(=O)Nc5ccccc54)C(=O)O[C@@H]([C@@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K12 compound treatment 1392.0 -695.58 -0.5999 1448.0 -487.34 -0.3948 -0.7034 -0.9794 3636369 DAlc3.1-H_000530 CN(C)CCCNC(=O)[C@]1(CC(=O)N(C2Cc3ccccc3C2)[C@@H]1c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)Sc5ccc(C)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K13 compound treatment 2282.0 194.42 0.1677 1867.0 -68.344 -0.0554 0.0794 0.4497 3636371 DAlc3.1-H_000531 NC(=O)NCC#Cc1ccc2NC(=O)[C@@]3([C@H]([C@H]4N([C@H]3c5ccccc5OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)NCC=C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K14 compound treatment 2113.0 25.422 0.0219 1673.0 -262.34 -0.2125 -0.1348 -0.6308 3636373 DAlc3.1-H_000532 COCCCNC(=O)[C@]1(CC(=O)N(C(C)C)[C@@H]1c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)Sc3ccc(C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K15 mock treatment 1976.0 -111.58 -0.0962 2087.0 151.66 0.1229 0.0188 0.1206 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K16 mock treatment 2242.0 154.42 0.1332 1898.0 -37.344 -0.0303 0.0728 0.5329 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K17 compound treatment 1375.0 -712.58 -0.6146 1696.0 -239.34 -0.1939 -0.5717 -0.8871 3636375 DAlc3.1-H_000533 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)NCC=C)[C@]24C(=O)Nc5ccccc54)C(=O)O[C@@H]([C@@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K18 compound treatment 2001.0 -86.578 -0.0747 1573.0 -362.34 -0.2935 -0.2604 -0.8596 3636376 DAlc3.1-H_000534 CC(C)CNC(=O)[C@]1(CC(=O)N([C@@H]1c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)C3CCCCC3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K19 compound treatment 1516.0 -571.58 -0.493 1638.0 -297.34 -0.2409 -0.5189 -0.9458 3636378 DAlc3.1-H_000535 ONC(=O)CCCCCNC(=O)OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)O)[C@@]24C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)C(=O)O[C@H]([C@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K20 compound treatment 1539.0 -548.58 -0.4731 1398.0 -537.34 -0.4353 -0.6424 -0.9991 3636380 DAlc3.1-H_000536 CN(C)CCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(C4CCCCC4)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K21 compound treatment 1620.0 -467.58 -0.4033 1192.0 -743.34 -0.6022 -0.711 -0.981 3636382 DAlc3.1-H_000537 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccc(O)cc3)[C@@]14C(=O)Nc5ccc(C#CCCOC(=O)NCCCCCC(=O)NO)cc54)[C@H]([C@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K22 compound treatment 1058.0 -1029.6 -0.888 1171.0 -764.34 -0.6192 -1.0657 -0.9845 3636384 DAlc3.1-H_000538 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3C(F)(F)F)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)C(=O)NC5CC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K23 mock treatment 1669.0 -418.58 -0.361 1459.0 -476.34 -0.3859 -0.5281 -0.9994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 K24 mock treatment 1112.0 -975.58 -0.8414 1059.0 -876.34 -0.7099 -1.097 -0.9964 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L01 compound treatment 429.0 -1658.6 -1.4305 523.0 -1412.3 -1.1442 -1.8205 -0.9939 3636386 DAlc3.1-H_000539 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(C)c4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L02 compound treatment 2415.0 327.42 0.2824 2323.0 387.66 0.314 0.4217 0.9986 3636387 DAlc3.1-H_000540 CN(C)CCCCNC(=O)[C@@H]1C[C@H]2N([C@@H]1c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)[C@H](CCCCN(C)C)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L03 compound treatment 11.0 -2076.6 -1.791 215.0 -1720.3 -1.3937 -2.2519 -0.9923 3636389 DAlc3.1-H_000541 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(I)cc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L04 compound treatment 2719.0 631.42 0.5446 2528.0 592.66 0.4801 0.7246 0.998 3636390 DAlc3.1-H_000542 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)CNC3=O)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L05 compound treatment 444.0 -1643.6 -1.4175 14.0 -1921.3 -1.5565 -2.103 -0.9989 3636391 DAlc3.1-H_000543 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(C)c4c3cc(C)cc4Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L06 compound treatment 2567.0 479.42 0.4135 2110.0 174.66 0.1415 0.3924 0.898 3636393 DAlc3.1-H_000544 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)NCc5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L07 mock treatment 3045.0 957.42 0.8257 2990.0 1054.7 0.8544 1.188 0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L08 mock treatment 2969.0 881.42 0.7602 2466.0 530.66 0.4299 0.8415 0.9636 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L09 compound treatment 423.0 -1664.6 -1.4356 513.0 -1422.3 -1.1523 -1.8299 -0.9941 3556635 DAlc3.1-H_000545 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N2Cc3ccccc3C[C@H]2COC(=O)NCCCCCC(=O)NO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L10 compound treatment 1422.0 -665.58 -0.574 2071.0 135.66 0.1099 -0.3282 -0.5615 3636394 DAlc3.1-H_000546 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@@H]4CCCN4C3=O)C(=O)OCCOc5ccc(cc5)[C@H]6N7[C@@H]([C@@H](C(=O)OCC=C)[C@]68C(=O)Nc9ccccc98)C(=O)O[C@@H]([C@@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L11 compound treatment 79.0 -2008.6 -1.7323 13.0 -1922.3 -1.5573 -2.3261 -0.9986 3636396 DAlc3.1-H_000547 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(I)cc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L12 compound treatment 2560.0 472.42 0.4074 2649.0 713.66 0.5781 0.6969 0.9853 3636397 DAlc3.1-H_000548 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L13 compound treatment 1836.0 -251.58 -0.217 782.0 -1153.3 -0.9343 -0.8141 -0.8487 3636399 DAlc3.1-H_000549 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(NC(=O)C)cc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L14 compound treatment 1570.0 -517.58 -0.4464 1736.0 -199.34 -0.1615 -0.4298 -0.9055 3636401 DAlc3.1-H_000550 CN(C)CCCCCCNC(=O)[C@H]1C[C@@H]2N([C@H]1c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)[C@H](CCCC[N+](C)(C)C)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L15 mock treatment 2500.0 412.42 0.3557 2180.0 244.66 0.1982 0.3917 0.9619 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L16 mock treatment 2586.0 498.42 0.4299 2429.0 493.66 0.3999 0.5867 0.9993 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L17 compound treatment 911.0 -1176.6 -1.0148 579.0 -1356.3 -1.0988 -1.4945 -0.9992 3556627 DAlc3.1-H_000551 COc1ccc(cc1)[Si](C)(C)[C@@H](CCn2cc(CCOC(=O)NCCCCCC(=O)NO)nn2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L18 compound treatment 2115.0 27.422 0.0237 2265.0 329.66 0.2671 0.2056 0.7667 3636403 DAlc3.1-H_000552 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)CNC3=O)C(=O)OCCOc4ccc(cc4)[C@H]5N6[C@@H]([C@@H](C(=O)OCC=C)[C@]57C(=O)Nc8ccccc87)C(=O)O[C@@H]([C@@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L19 compound treatment 4.0 -2083.6 -1.797 3.0 -1932.3 -1.5654 -2.3776 -0.9976 3636404 DAlc3.1-H_000553 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N4c5c3cc(OC)cc5C(=CC4(C)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L20 compound treatment 2020.0 -67.578 -0.0583 1742.0 -193.34 -0.1566 -0.152 -0.9093 3636406 DAlc3.1-H_000554 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)[C@@H]4CCCN4C3=O)C(=O)OCCOc5ccc(cc5)[C@H]6N7[C@@H]([C@@H](C(=O)OCC=C)[C@]68C(=O)Nc9ccccc98)C(=O)O[C@@H]([C@@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L21 compound treatment 95.0 -1992.6 -1.7185 167.0 -1768.3 -1.4326 -2.2281 -0.9959 3556631 DAlc3.1-H_000555 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N(CCOC(=O)NCCCCCC(=O)NO)Cc2ccccc2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L22 compound treatment 1610.0 -477.58 -0.4119 1791.0 -144.34 -0.1169 -0.3739 -0.8733 3636407 DAlc3.1-H_000556 CN(C)CCCCNC(=O)[C@@H]1C[C@H]2N([C@@H]1c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)[C@H](CCCCNC(=O)C)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L23 mock treatment 2079.0 -8.5781 -0.0074 1751.0 -184.34 -0.1493 -0.1108 -0.7412 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 L24 mock treatment 1053.0 -1034.6 -0.8923 1191.0 -744.34 -0.603 -1.0573 -0.9818 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M01 compound treatment 2157.0 69.422 0.0599 1991.0 55.656 0.0451 0.0742 0.9902 3636409 DAlc3.1-H_000557 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccc(OCCOC(=O)NCCCCCC(=O)NO)cc3)[C@@]14C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)[C@H]([C@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M02 compound treatment 2146.0 58.422 0.0504 2520.0 584.66 0.4736 0.3705 0.7779 3636411 DAlc3.1-H_000558 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)[C@@H]2N(C3CCCCC3)C(=O)c4ccccc4[C@]52Cc6ccccc6N(CCN7CCOCC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M03 compound treatment 1537.0 -550.58 -0.4749 1848.0 -87.344 -0.0708 -0.3858 -0.8036 3636413 DAlc3.1-H_000559 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCCCCCC9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M04 compound treatment 2517.0 429.42 0.3704 1901.0 -34.344 -0.0278 0.2422 0.6521 3636414 DAlc3.1-H_000560 COc1ccccc1CN2[C@@H](c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)[C@]4(Cc5ccccc5N(Cc6ccccc6)C4=O)c7ccccc7C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M05 compound treatment 1928.0 -159.58 -0.1376 1639.0 -296.34 -0.2401 -0.2671 -0.9651 3636416 DAlc3.1-H_000561 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccccc5OCCOC(=O)NCCCCCC(=O)NO)[C@]36C(=O)Nc7ccccc76)[C@@H]([C@@H](OC4=O)c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M06 compound treatment 2610.0 522.42 0.4506 1101.0 -834.34 -0.6759 -0.1593 -0.1962 3636418 DAlc3.1-H_000562 CC(C)N1[C@H](c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NC4CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M07 compound treatment 2922.0 834.42 0.7197 2325.0 389.66 0.3157 0.7321 0.9316 3636420 DAlc3.1-H_000563 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccccc5OCCOC(=O)NCCCCCC(=O)NO)[C@]36C(=O)Nc7ccc(C#CCNC(=O)N)cc76)[C@@H]([C@@H](OC4=O)c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M08 compound treatment 2136.0 48.422 0.0418 1088.0 -847.34 -0.6864 -0.4559 -0.6629 3636422 DAlc3.1-H_000564 COc1ccc(CCNC(=O)[C@]2(CC(=O)N([C@@H]2c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)C4CCCCC4)Sc5ccc(C)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M09 mock treatment 2460.0 372.42 0.3212 2594.0 658.66 0.5336 0.6044 0.9705 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M10 mock treatment 2650.0 562.42 0.4851 2824.0 888.66 0.7199 0.852 0.9815 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M11 compound treatment 1918.0 -169.58 -0.1463 2396.0 460.66 0.3732 0.1605 0.4003 3636424 DAlc3.1-H_000565 COc1cc2CCN(Cc2cc1OC)C(=O)[C@@H]3[C@@H]4N([C@H](c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5)[C@@]36C(=O)Nc7ccc(C#CCNC(=O)N)cc76)[C@H]([C@H](OC4=O)c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M12 compound treatment 1584.0 -503.58 -0.4343 1271.0 -664.34 -0.5382 -0.6877 -0.9943 3636426 DAlc3.1-H_000566 CC(C)NC(=O)[C@]1(CC(=O)N([C@@H]1c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)C3CCCCC3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M13 mock treatment 2244.0 156.42 0.1349 2493.0 557.66 0.4518 0.4148 0.8799 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M14 mock treatment 1089.0 -998.58 -0.8612 1411.0 -524.34 -0.4248 -0.9093 -0.9469 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M15 compound treatment 1919.0 -168.58 -0.1454 2311.0 375.66 0.3043 0.1124 0.3332 3636428 DAlc3.1-H_000567 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccccc3OCCOC(=O)NCCCCCC(=O)NO)[C@@]14C(=O)Nc5ccccc54)[C@H]([C@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M16 compound treatment 2255.0 167.42 0.1444 2210.0 274.66 0.2225 0.2594 0.9781 3636429 DAlc3.1-H_000568 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3Cl)C(=O)c4ccccc4[C@]2(Cc5ccccc5I)C(=O)NCc6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M17 compound treatment 1726.0 -361.58 -0.3118 1581.0 -354.34 -0.2871 -0.4235 -0.9991 3636431 DAlc3.1-H_000569 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccccc4OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N)c7cc(C#Cc8ccc(OC)cc8)ccc17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M18 compound treatment 2008.0 -79.578 -0.0686 2459.0 523.66 0.4242 0.2514 0.5851 3636433 DAlc3.1-H_000570 COCCCNC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M19 compound treatment 1422.0 -665.58 -0.574 1591.0 -344.34 -0.279 -0.6032 -0.9451 3636435 DAlc3.1-H_000571 COCCOC(=O)N1C(=O)[C@]2([C@@H]([C@@H]3N([C@@H]2c4ccccc4OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N7CCc8cc(OC)c(OC)cc8C7)c9cc(C#Cc%10ccc(OC)cc%10)ccc19 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M20 compound treatment 806.0 -1281.6 -1.1053 749.0 -1186.3 -0.9611 -1.4612 -0.9976 3636437 DAlc3.1-H_000572 COc1ccc(CCNC(=O)[C@]2(Cc3ccccc3I)[C@@H](N(Cc4ccccc4OC)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M21 compound treatment 936.0 -1151.6 -0.9932 930.0 -1005.3 -0.8144 -1.2782 -0.9951 3636439 DAlc3.1-H_000573 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccccc4OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N7CCc8cc(OC)c(OC)cc8C7)c9cc(C#Cc%10ccc(OC)cc%10)ccc19 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M22 compound treatment 1709.0 -378.58 -0.3265 1470.0 -465.34 -0.377 -0.4974 -0.9974 3636440 DAlc3.1-H_000574 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3)C(=O)c4ccccc4[C@]2(Cc5ccccc5I)C(=O)NCc6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M23 compound treatment 819.0 -1268.6 -1.0941 753.0 -1182.3 -0.9578 -1.4509 -0.9978 3636442 DAlc3.1-H_000575 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccccc4OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N7CCc8cc(OC)c(OC)cc8C7)c9cc(C#CCNC(=O)N)ccc19 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 M24 compound treatment 943.0 -1144.6 -0.9872 701.0 -1234.3 -1.0 -1.4051 -1.0 3636444 DAlc3.1-H_000576 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3Cl)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)C(=O)NC5CC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N01 compound treatment 399.0 -1688.6 -1.4563 244.0 -1691.3 -1.3702 -1.9986 -0.9995 3636446 DAlc3.1-H_000577 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N4c5c3cc(OC)cc5C(=CC4(C)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N02 compound treatment 2304.0 216.42 0.1867 2885.0 949.66 0.7693 0.676 0.8539 3636447 DAlc3.1-H_000578 CN(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCOC(=O)NCCCCCC(=O)NO)c3)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N03 compound treatment 2497.0 409.42 0.3531 2549.0 613.66 0.4971 0.6012 0.986 3636449 DAlc3.1-H_000579 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CC(=O)N4CCC[C@H]4COC(=O)NCCCCCC(=O)NO)C(=O)N(C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N04 compound treatment 2763.0 675.42 0.5825 2080.0 144.66 0.1172 0.4948 0.8327 3636451 DAlc3.1-H_000580 CCCCc1cn(C[C@@H]2CCCN2C(=O)N[C@@H](CCc3oc(C(=O)C)c(C(=O)OC)c3C(=O)OC)COC(=O)NCCCCCC(=O)NO)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N05 compound treatment 2265.0 177.42 0.153 506.0 -1429.3 -1.1579 -0.7106 -0.6084 3636453 DAlc3.1-H_000581 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(CC=C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N06 compound treatment 2259.0 171.42 0.1478 2034.0 98.656 0.0799 0.1611 0.9583 3636454 DAlc3.1-H_000582 COC(=O)c1c(CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc2ccccc2)Cn3cc(nn3)C4(O)CCCC4)oc(C(=O)N5CCOCC5)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N07 compound treatment 569.0 -1518.6 -1.3097 441.0 -1494.3 -1.2106 -1.7821 -0.9992 3636456 DAlc3.1-H_000583 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccccc4)c5ccc(NC(=O)C)cc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N08 compound treatment 2857.0 769.42 0.6636 2268.0 332.66 0.2695 0.6598 0.9212 3636458 DAlc3.1-H_000584 COCc1cn(C[C@H](Cc2ccccc2)NC(=O)N[C@@H](CCc3oc(C(=O)N4CCOCC4)c(C(=O)OC)c3C(=O)OC)COC(=O)NCCCCCC(=O)NO)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N09 mock treatment 1959.0 -128.58 -0.1109 2544.0 608.66 0.4931 0.2702 0.5347 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N10 mock treatment 2144.0 56.422 0.0487 2331.0 395.66 0.3205 0.2611 0.8052 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N11 compound treatment 1066.0 -1021.6 -0.8811 1057.0 -878.34 -0.7116 -1.1262 -0.9944 3556639 DAlc3.1-H_000585 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N2CCC[C@H]2COC(=O)NCCCCCC(=O)NO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N12 compound treatment 1723.0 -364.58 -0.3144 2713.0 777.66 0.63 0.2231 0.3169 3556538 DAlc3.1-H_000586 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](C)Cn3cc(CN(C)C2=O)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N13 mock treatment 2076.0 -11.578 -0.01 2475.0 539.66 0.4372 0.3021 0.6908 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N14 mock treatment 2860.0 772.42 0.6662 2816.0 880.66 0.7134 0.9755 0.9994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N15 compound treatment 655.0 -1432.6 -1.2355 910.0 -1025.3 -0.8306 -1.461 -0.9813 3556628 DAlc3.1-H_000587 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N(CCOC(=O)NCCCCCC(=O)NO)Cc2ccccc2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N16 compound treatment 2311.0 223.42 0.1927 2541.0 605.66 0.4907 0.4832 0.9167 3636460 DAlc3.1-H_000588 COC(=O)c1c(CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N2CCCC2)oc(C(=O)Cc3ccccc3)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N17 compound treatment 936.0 -1151.6 -0.9932 694.0 -1241.3 -1.0056 -1.4134 -1.0 3556640 DAlc3.1-H_000589 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(C)c4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N18 compound treatment 2401.0 313.42 0.2703 2630.0 694.66 0.5628 0.5891 0.9436 3636462 DAlc3.1-H_000590 COC(=O)c1c(CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)NCC(C)C)oc(C(=O)Cc2ccccc2)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N19 compound treatment 347.0 -1740.6 -1.5012 285.0 -1650.3 -1.337 -2.0069 -0.9983 3636464 DAlc3.1-H_000591 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(c4ccccc43)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N20 compound treatment 2450.0 362.42 0.3126 2149.0 213.66 0.1731 0.3434 0.9611 3636465 DAlc3.1-H_000592 COc1cccc(C[C@H]2C[C@@H](COC(=O)NCCCCCC(=O)NO)NC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N21 compound treatment 924.0 -1163.6 -1.0035 1173.0 -762.34 -0.6176 -1.1463 -0.9728 3636467 DAlc3.1-H_000593 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(CC=C)c5ccc(cc53)N6CCOC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N22 compound treatment 1669.0 -418.58 -0.361 1941.0 5.6563 0.0046 -0.252 -0.6981 3636469 DAlc3.1-H_000594 COC(=O)c1c(CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N(C)Cc2ccccc2)oc(C(=O)OCC=C)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N23 compound treatment 29.0 -2058.6 -1.7754 45.0 -1890.3 -1.5314 -2.3383 -0.9973 3636471 DAlc3.1-H_000595 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4cccc(NC(=O)C)c4)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 N24 compound treatment 2508.0 420.42 0.3626 891.0 -1044.3 -0.846 -0.3418 -0.3714 3636473 DAlc3.1-H_000596 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc3ccccc3)Cn4cc(COC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O01 compound treatment 1972.0 -115.58 -0.0997 1719.0 -216.34 -0.1753 -0.1944 -0.9642 3636475 DAlc3.1-H_000597 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccc(OCCOC(=O)NCCCCCC(=O)NO)cc3)[C@]14C(=O)Nc5ccccc54)[C@@H]([C@@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O02 compound treatment 1856.0 -231.58 -0.1997 1699.0 -236.34 -0.1915 -0.2766 -0.9998 3636476 DAlc3.1-H_000598 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3C(F)(F)F)C(=O)c4ccccc4[C@]52Cc6ccccc6N(CCN7CCOCC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O03 compound treatment 2431.0 343.42 0.2962 1497.0 -438.34 -0.3551 -0.0417 -0.0901 3636478 DAlc3.1-H_000599 COC(=O)C(CC#Cc1ccc2NC(=O)[C@]3([C@@H]([C@@H]4N([C@@H]3c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5)[C@H]([C@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N)c2c1)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O04 compound treatment 2214.0 126.42 0.109 2129.0 193.66 0.1569 0.188 0.9842 3636480 DAlc3.1-H_000600 CC(C)N1[C@H](c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NCc4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O05 compound treatment 2310.0 222.42 0.1918 1569.0 -366.34 -0.2968 -0.0742 -0.21 3636482 DAlc3.1-H_000601 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccccc4OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)NCC(OC(=O)NCCCCCC(=O)NO)c7ccccc7)c8ccccc18 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O06 compound treatment 2555.0 467.42 0.4031 2404.0 468.66 0.3797 0.5535 0.9996 3636484 DAlc3.1-H_000602 CC(C)CNC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O07 compound treatment 1580.0 -507.58 -0.4378 1311.0 -624.34 -0.5058 -0.6672 -0.9974 3636486 DAlc3.1-H_000603 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccc(OCCOC(=O)NCCCCCC(=O)NO)cc6)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCN(CC9)c%10ncccn%10)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O08 compound treatment 1380.0 -707.58 -0.6103 1224.0 -711.34 -0.5763 -0.839 -0.9996 3636488 DAlc3.1-H_000604 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3Cl)C(=O)c4ccccc4[C@]52Cc6ccccc6N(C7CC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O09 compound treatment 2781.0 693.42 0.598 2222.0 286.66 0.2322 0.5871 0.9151 3636490 DAlc3.1-H_000605 NC(=O)NCC#Cc1ccc2NC(=O)[C@@]3([C@H]([C@H]4N([C@H]3c5ccccc5OCCOC(=O)NCCCCCC(=O)NO)[C@@H]([C@@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O10 compound treatment 2132.0 44.422 0.0383 1202.0 -733.34 -0.5941 -0.393 -0.6601 3636492 DAlc3.1-H_000606 Cc1ccc(S[C@@]2(CC(=O)N(C3Cc4ccccc4C3)[C@@H]2c5ccc(COC(=O)NCCCCCC(=O)NO)cc5)C(=O)NCc6ccccc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O11 mock treatment 1669.0 -418.58 -0.361 2186.0 250.66 0.2031 -0.1117 -0.2696 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O12 mock treatment 1921.0 -166.58 -0.1437 1713.0 -222.34 -0.1801 -0.229 -0.9937 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O13 compound treatment 1990.0 -97.578 -0.0842 1444.0 -491.34 -0.398 -0.341 -0.8381 3636494 DAlc3.1-H_000607 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccc(OCCOC(=O)NCCCCCC(=O)NO)cc3)[C@]14C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)[C@@H]([C@@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O14 compound treatment 1229.0 -858.58 -0.7405 694.0 -1241.3 -1.0056 -1.2347 -0.9887 3636495 DAlc3.1-H_000608 CC(C)N1[C@H](c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NCCCN(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O15 compound treatment 1795.0 -292.58 -0.2523 1696.0 -239.34 -0.1939 -0.3155 -0.9915 3636497 DAlc3.1-H_000609 NC(=O)NCC#Cc1ccc2NC(=O)[C@]3([C@@H]([C@@H]4N([C@@H]3c5ccccc5OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)NCC=C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O16 compound treatment 1434.0 -653.58 -0.5637 1250.0 -685.34 -0.5552 -0.7912 -1.0 3636498 DAlc3.1-H_000610 CN(C)CCCNC(=O)[C@]1(CC(=O)N(Cc2ccccc2Cl)[C@@H]1c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O17 compound treatment 1209.0 -878.58 -0.7577 988.0 -947.34 -0.7675 -1.0785 -1.0 3636500 DAlc3.1-H_000611 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCOC(=O)NCCCCCC(=O)NO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)NCC=C)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O18 compound treatment 1557.0 -530.58 -0.4576 1880.0 -55.344 -0.0448 -0.3553 -0.7727 3636501 DAlc3.1-H_000612 CN(C)CCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(Cc4ccccc4Cl)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O19 compound treatment 1290.0 -797.58 -0.6879 1297.0 -638.34 -0.5171 -0.8521 -0.9901 3636503 DAlc3.1-H_000613 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@@H]2N3[C@H]([C@H](C(=O)N4CCCCCCC4)[C@@]25C(=O)Nc6ccc(C#CC7(O)CCCCCC7)cc65)C(=O)O[C@H]([C@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O20 compound treatment 1027.0 -1060.6 -0.9147 1178.0 -757.34 -0.6135 -1.0806 -0.9811 3636504 DAlc3.1-H_000614 CCCNC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(COC(=O)NCCCCCC(=O)NO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O21 compound treatment 1440.0 -647.58 -0.5585 1582.0 -353.34 -0.2862 -0.5973 -0.9518 3636506 DAlc3.1-H_000615 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2cccc(F)c2)[C@@H]3OC(=O)[C@H](Cc4cccc(Br)c4)C/C=C/C[C@@H](Cc5cccc(Br)c5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O22 compound treatment 1403.0 -684.58 -0.5904 1283.0 -652.34 -0.5285 -0.7912 -0.9985 3636508 DAlc3.1-H_000616 CN(C)CCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(Cc4ccccc4C(F)(F)F)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O23 compound treatment 1097.0 -990.58 -0.8543 1275.0 -660.34 -0.535 -0.9824 -0.9746 3636510 DAlc3.1-H_000617 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccc3OCOc3c2)[C@@H]4OC(=O)[C@H](Cc5cccc(Br)c5)C/C=C/C[C@@H](Cc6cccc(Br)c6)C(=O)O[C@@H]14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 O24 compound treatment 448.0 -1639.6 -1.4141 270.0 -1665.3 -1.3491 -1.9539 -0.9997 3636512 DAlc3.1-H_000618 CCCNC(=O)[C@]1(CC(=O)N([C@@H]1c2ccc(COC(=O)NCCCCCC(=O)NO)cc2)C3CCCCC3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P01 compound treatment 26.0 -2061.6 -1.778 23.0 -1912.3 -1.5492 -2.3527 -0.9976 3636514 DAlc3.1-H_000619 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(Cc5cccc(c5)N6CCOC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P02 compound treatment 1462.0 -625.58 -0.5395 1351.0 -584.34 -0.4734 -0.7162 -0.9979 3636516 DAlc3.1-H_000620 COc1cccc(C[C@]2(C[C@@H](COC(=O)NCCCCCC(=O)NO)NC2=O)C(=O)OCc3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P03 compound treatment 391.0 -1696.6 -1.4632 283.0 -1652.3 -1.3386 -1.9812 -0.999 3636518 DAlc3.1-H_000621 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4cccc(NC(=O)C)c4)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P04 compound treatment 1399.0 -688.58 -0.5939 1265.0 -670.34 -0.5431 -0.8039 -0.999 3636519 DAlc3.1-H_000622 COc1cccc(C[C@@]2(C[C@@H](COC(=O)NCCCCCC(=O)NO)NC2=O)C(=O)OCc3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P05 compound treatment 991.0 -1096.6 -0.9458 476.0 -1459.3 -1.1822 -1.5047 -0.9939 3636520 DAlc3.1-H_000623 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccccc4)c5ccc(NC(=O)C)cc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P06 compound treatment 1881.0 -206.58 -0.1782 1913.0 -22.344 -0.0181 -0.1388 -0.775 3636521 DAlc3.1-H_000624 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N(C)Cc3cn(C[C@H](Cc4ccccc4)NC2=O)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P07 compound treatment 1735.0 -352.58 -0.3041 650.0 -1285.3 -1.0413 -0.9513 -0.877 3636523 DAlc3.1-H_000625 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(cc43)N5CCOC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P08 compound treatment 1768.0 -319.58 -0.2756 1727.0 -208.34 -0.1688 -0.3142 -0.9723 3636525 DAlc3.1-H_000626 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N(Cc3ccccc3)Cc4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P09 compound treatment 69.0 -2018.6 -1.7409 118.0 -1817.3 -1.4723 -2.2721 -0.9965 3636527 DAlc3.1-H_000627 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(Cc5ccc(cc5)N6CCOC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P10 compound treatment 1347.0 -740.58 -0.6387 1560.0 -375.34 -0.3041 -0.6667 -0.9424 3636529 DAlc3.1-H_000628 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N(Cc3ccccc3)Cc4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P11 mock treatment 1827.0 -260.58 -0.2247 2019.0 83.656 0.0678 -0.111 -0.4728 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P12 mock treatment 1741.0 -346.58 -0.2989 1529.0 -406.34 -0.3292 -0.4441 -0.9988 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P13 compound treatment 639.0 -1448.6 -1.2493 625.0 -1310.3 -1.0615 -1.634 -0.9967 3636530 DAlc3.1-H_000629 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccc(NC(=O)C)cc4)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P14 compound treatment 1393.0 -694.58 -0.599 1547.0 -388.34 -0.3146 -0.646 -0.9548 3636532 DAlc3.1-H_000630 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N(Cc3ccccc3)Cc4cnnn4C[C@@H](Cc5ccccc5)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P15 compound treatment 853.0 -1234.6 -1.0648 1108.0 -827.34 -0.6702 -1.2268 -0.9751 3636534 DAlc3.1-H_000631 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(cc43)N5CCC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P16 compound treatment 1730.0 -357.58 -0.3084 1831.0 -104.34 -0.0845 -0.2778 -0.8689 3636535 DAlc3.1-H_000632 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N(Cc3ccccc3)Cc4cn(C[C@@H]5CCCN5C2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P17 compound treatment 1204.0 -883.58 -0.762 1316.0 -619.34 -0.5017 -0.8936 -0.9794 3636094 DAlc3.1-H_000633 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(CC=C)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P18 compound treatment 1783.0 -304.58 -0.2627 1614.0 -321.34 -0.2603 -0.3698 -1.0 3636537 DAlc3.1-H_000634 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)NC3(CCCCC3)c4cn(C[C@H](C)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P19 compound treatment 29.0 -2058.6 -1.7754 20.0 -1915.3 -1.5516 -2.3526 -0.9977 3636539 DAlc3.1-H_000635 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccc(cc4)N5CCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P20 compound treatment 7.0 -2080.6 -1.7944 0.0 -1935.3 -1.5678 -2.3775 -0.9977 3636540 DAlc3.1-H_000636 CC(=CCN(CC#Cc1ccccc1)[C@H](COC(=O)NCCCCCC(=O)NO)c2ccccc2)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P21 compound treatment 74.0 -2013.6 -1.7366 41.0 -1894.3 -1.5346 -2.3131 -0.9981 3636542 DAlc3.1-H_000637 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(C)c5c3cc(C)cc5Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P22 compound treatment 35.0 -2052.6 -1.7703 7.0 -1928.3 -1.5622 -2.3564 -0.9981 3636543 DAlc3.1-H_000638 C/C=C/CN([C@H](COC(=O)NCCCCCC(=O)NO)c1ccccc1)C(=O)C#Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P23 compound treatment 121.0 -1966.6 -1.6961 124.0 -1811.3 -1.4674 -2.2369 -0.9974 3636545 DAlc3.1-H_000639 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(Cc5cccc(c5)N6CCOC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2438 P24 compound treatment 784.0 -1303.6 -1.1243 558.0 -1377.3 -1.1158 -1.584 -1.0 3636546 DAlc3.1-H_000640 CCOC(=O)[C@@H]1[C@H]2O[C@@]3(C=C2)[C@@H](N(CCCCCCOC(=O)NCCCCCC(=O)NO)C(=O)[C@@H]13)C(=O)NCc4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A01 compound treatment 0.0 -1463.8 -1.2625 272.0 -712.55 -0.5772 -1.3009 -0.9371 3089766 DAlc3.1-H_000641 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccccc2c3ccccc3)[C@H](OC(=O)Nc4ccccc4)[C@@H]1OC(=O)Nc5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A02 compound treatment 392.0 -1071.8 -0.9244 2.0 -982.55 -0.796 -1.2165 -0.9972 3000700 DAlc3.1-H_000642 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)c2ccc(Br)cc2)[C@H](OC(=O)c3cc4ccccc4[nH]3)[C@H]1OC(=O)c5cc6ccccc6[nH]5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A03 compound treatment 1349.0 -114.83 -0.099 350.0 -634.55 -0.5141 -0.4335 -0.8281 3186911 DAlc3.1-H_000643 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)c2ccc(Br)cc2)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A04 compound treatment 889.0 -574.83 -0.4958 0.0 -984.55 -0.7976 -0.9145 -0.9738 3000701 DAlc3.1-H_000644 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)c2c(OC)cccc2OC)[C@H](OC(=O)c3cc4ccccc4[nH]3)[C@H]1OC(=O)c5cc6ccccc6[nH]5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A05 compound treatment 2152.0 688.17 0.5935 0.0 -984.55 -0.7976 -0.1443 -0.1451 3186912 DAlc3.1-H_000645 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)c2c(OC)cccc2OC)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A06 compound treatment 117.0 -1346.8 -1.1616 0.0 -984.55 -0.7976 -1.3853 -0.9832 3068272 DAlc3.1-H_000646 COC(=O)[C@]1(CC=C)N=C(O[C@@H]1c2ccccc2)c3ccc(OCCCO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A07 compound treatment 306.0 -1157.8 -0.9986 147.0 -837.55 -0.6785 -1.1859 -0.9823 3186914 DAlc3.1-H_000647 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2cccc(F)c2)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A08 compound treatment 1050.0 -413.83 -0.3569 719.0 -265.55 -0.2151 -0.4045 -0.9706 3068330 DAlc3.1-H_000648 COC(=O)[C@@]1(CC=C)COC(=N1)c2ccc(OCCCO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A09 compound treatment 10.0 -1453.8 -1.2539 10.0 -974.55 -0.7895 -1.4449 -0.9751 3186915 DAlc3.1-H_000649 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A10 compound treatment 718.0 -745.83 -0.6432 9.0 -975.55 -0.7903 -1.0137 -0.9948 3068421 DAlc3.1-H_000650 COC(=O)[C@@]1(Cc2ccccc2)COC(=N1)c3ccc(OCCCO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A11 compound treatment 7.0 -1456.8 -1.2565 0.0 -984.55 -0.7976 -1.4524 -0.9759 1952944 DAlc3.1-H_000651 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccc(C#N)cc2)[C@@H]3OC(=O)[C@@H](Cc4ccccc4)C/C=C/C[C@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A12 compound treatment 1496.0 32.172 0.0277 5.0 -979.55 -0.7935 -0.5415 -0.682 3068513 DAlc3.1-H_000652 COC(=O)[C@@]1(CCS(=O)(=O)c2ccccc2)COC(=N1)c3ccc(OCCCO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A13 mock treatment 2063.0 599.17 0.5168 1009.0 24.453 0.0198 0.3794 0.7337 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A14 mock treatment 1417.0 -46.828 -0.0404 939.0 -45.547 -0.0369 -0.0546 -0.999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A15 compound treatment 787.0 -676.83 -0.5837 997.0 12.453 0.0101 -0.4056 -0.6948 3413986 DAlc3.1-H_000653 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)c2c(OC)cccc2OC)[C@@H]3OC(=O)[C@H](Cc4ccccc4)C/C=C/C[C@@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A16 compound treatment 235.0 -1228.8 -1.0598 230.0 -754.55 -0.6113 -1.1816 -0.9658 3187528 DAlc3.1-H_000654 COC(=O)[C@]1(CCS(=O)(=O)c2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A17 compound treatment 4.0 -1459.8 -1.259 7.0 -977.55 -0.7919 -1.4503 -0.975 3413993 DAlc3.1-H_000655 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@@H]3OC(=O)[C@H](Cc4ccccc4)C/C=C/C[C@@H](Cc5ccccc5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A18 compound treatment 677.0 -786.83 -0.6786 603.0 -381.55 -0.3091 -0.6984 -0.9366 3068188 DAlc3.1-H_000656 NC(=O)[C@]1(CCS(=O)(=O)c2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A19 compound treatment 266.0 -1197.8 -1.0331 185.0 -799.55 -0.6477 -1.1885 -0.9747 1952969 DAlc3.1-H_000657 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccc3OCOc3c2)[C@@H]4OC(=O)[C@H](Cc5ccccc5)C/C=C/C[C@@H](Cc6ccccc6)C(=O)O[C@@H]14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A20 compound treatment 935.0 -528.83 -0.4561 0.0 -984.55 -0.7976 -0.8865 -0.9648 3187005 DAlc3.1-H_000658 OCCCOc1ccc(cc1)C2=N[C@@](CCS(=O)(=O)c3ccccc3)([C@@H](O2)c4ccccc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A21 compound treatment 730.0 -733.83 -0.6329 540.0 -444.55 -0.3601 -0.7022 -0.9643 3187027 DAlc3.1-H_000659 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)c2c(OC)cccc2OC)[C@@H]3OC(=O)[C@@H](Cc4ccc5ccccc5c4)C/C=C/C[C@H](Cc6ccc7ccccc7c6)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A22 compound treatment 22.0 -1441.8 -1.2435 46.0 -938.55 -0.7603 -1.4169 -0.9721 3187108 DAlc3.1-H_000660 OCCCOc1ccc(cc1)C2=N[C@@](Cc3ccccc3)([C@@H](O2)c4ccccc4)C(=O)N5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A23 compound treatment 36.0 -1427.8 -1.2314 41.0 -943.55 -0.7644 -1.4113 -0.9737 3187029 DAlc3.1-H_000661 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@@H]3OC(=O)[C@@H](Cc4ccc5ccccc5c4)C/C=C/C[C@H](Cc6ccc7ccccc7c6)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 A24 compound treatment 181.0 -1282.8 -1.1064 1.0 -983.55 -0.7968 -1.3457 -0.987 3068456 DAlc3.1-H_000662 OCCCOc1ccc(cc1)C2=N[C@@](Cc3ccccc3)([C@@H](O2)c4ccccc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B01 compound treatment 4.0 -1459.8 -1.259 428.0 -556.55 -0.4509 -1.2091 -0.9041 3068146 DAlc3.1-H_000663 CC(C)CNC(=O)[C@]1(Cc2ccccc2I)[C@@H](N(Cc3ccccc3Cl)C(=O)c4ccccc41)c5ccc(CO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B02 compound treatment 144.0 -1319.8 -1.1383 623.0 -361.55 -0.2929 -1.012 -0.861 3188760 DAlc3.1-H_000664 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(CC=C)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B03 compound treatment 1365.0 -98.828 -0.0852 300.0 -684.55 -0.5546 -0.4524 -0.8063 3186877 DAlc3.1-H_000665 CCCNC(=O)[C@]1(CC(=O)N(C2Cc3ccccc3C2)[C@@H]1c4ccc(CO)cc4)Sc5ccc(C)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B04 compound treatment 1.0 -1462.8 -1.2616 0.0 -984.55 -0.7976 -1.4561 -0.9755 3188761 DAlc3.1-H_000666 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(Cc4ccccc4)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B05 compound treatment 1649.0 185.17 0.1597 1382.0 397.45 0.322 0.3406 0.9477 3186628 DAlc3.1-H_000667 CC(C)CN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(Cc4ccccc4Cl)C(=O)c5ccccc52)c6ccc(CO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B06 compound treatment 2.0 -1461.8 -1.2608 0.0 -984.55 -0.7976 -1.4555 -0.9756 3069749 DAlc3.1-H_000668 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(Cc5cccc(c5)N6CCC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B07 compound treatment 1181.0 -282.83 -0.2439 1001.0 16.453 0.0133 -0.1631 -0.6675 3186557 DAlc3.1-H_000669 CC(C)CNC(=O)[C@]1(Cc2ccccc2I)[C@@H](N(Cc3ccccc3)C(=O)c4ccccc41)c5ccc(CO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B08 compound treatment 3.0 -1460.8 -1.2599 2.0 -982.55 -0.796 -1.4537 -0.9755 3189023 DAlc3.1-H_000670 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(Cc4cccc(c4)N5CCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B09 compound treatment 1765.0 301.17 0.2597 995.0 10.453 0.0085 0.1897 0.7298 3068366 DAlc3.1-H_000671 CC(C)CNC(=O)[C@]1(CC(=O)N(C2Cc3ccccc3C2)[C@@H]1c4ccc(CO)cc4)Sc5ccc(C)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B10 compound treatment 3.0 -1460.8 -1.2599 0.0 -984.55 -0.7976 -1.4549 -0.9757 3069917 DAlc3.1-H_000672 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(CC=C)c4ccc(cc43)N5CCC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B11 compound treatment 1526.0 62.172 0.0536 1251.0 266.45 0.2159 0.1905 0.8567 3186870 DAlc3.1-H_000673 Cc1ccc(S[C@@]2(CC(=O)N([C@@H]2c3ccc(CO)cc3)C4CCCCC4)C(=O)NCc5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B12 compound treatment 12.0 -1451.8 -1.2521 8.0 -976.55 -0.7911 -1.4448 -0.9755 3189025 DAlc3.1-H_000674 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CC(=O)N4CCC[C@H]4CO)C(=O)N(Cc5cccc(c5)N6CCOC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B13 mock treatment 2350.0 886.17 0.7643 952.0 -32.547 -0.0264 0.5218 0.6823 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B14 mock treatment 1356.0 -107.83 -0.093 993.0 8.4531 0.0068 -0.0609 -0.6533 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B15 compound treatment 1401.0 -62.828 -0.0542 970.0 -14.547 -0.0118 -0.0466 -0.8412 3186875 DAlc3.1-H_000675 CC(C)N1[C@H](c2ccc(CO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NCC(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B16 compound treatment 0.0 -1463.8 -1.2625 2.0 -982.55 -0.796 -1.4556 -0.9753 3189026 DAlc3.1-H_000676 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(Cc5ccc(cc5)N6CCC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B17 compound treatment 1490.0 26.172 0.0226 1528.0 543.45 0.4403 0.3273 0.7424 3068235 DAlc3.1-H_000677 COCCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(Cc4ccccc4)C(=O)c5ccccc52)c6ccc(CO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B18 compound treatment 46.0 -1417.8 -1.2228 214.0 -770.55 -0.6242 -1.3061 -0.9513 3069403 DAlc3.1-H_000678 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(CC=C)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B19 compound treatment 601.0 -862.83 -0.7442 1369.0 384.45 0.3115 -0.306 -0.3793 3068411 DAlc3.1-H_000679 CCCNC(=O)[C@]1(CC(=O)N(Cc2ccccc2)[C@@H]1c3ccc(CO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B20 compound treatment 25.0 -1438.8 -1.2409 11.0 -973.55 -0.7887 -1.4352 -0.9761 3070278 DAlc3.1-H_000680 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(Cc4cccc(c4)N5CCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B21 compound treatment 1481.0 17.172 0.0148 1006.0 21.453 0.0174 0.0228 0.9968 3186637 DAlc3.1-H_000681 OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3)C(=O)c4ccccc4[C@]52Cc6ccccc6N(C7CC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B22 compound treatment 12.0 -1451.8 -1.2521 7.0 -977.55 -0.7919 -1.4454 -0.9756 3070289 DAlc3.1-H_000682 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(Cc5ccc(cc5)N6CCC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B23 compound treatment 316.0 -1147.8 -0.99 614.0 -370.55 -0.3002 -0.9123 -0.8819 3186873 DAlc3.1-H_000683 CCCNC(=O)[C@]1(CC(=O)N(C(C)C)[C@@H]1c2ccc(CO)cc2)Sc3ccc(C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 B24 compound treatment 0.0 -1463.8 -1.2625 0.0 -984.55 -0.7976 -1.4567 -0.9755 3189394 DAlc3.1-H_000684 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(C)c5c3cc(C)cc5Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C01 compound treatment 515.0 -948.83 -0.8183 321.0 -663.55 -0.5375 -0.9587 -0.9792 2141518 DAlc3.1-H_000685 NC(=O)NCC#Cc1ccc2NC(=O)[C@]3([C@@H]([C@@H]4N([C@@H]3c5ccc(OCCO)cc5)[C@H]([C@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C02 compound treatment 111.0 -1352.8 -1.1668 46.0 -938.55 -0.7603 -1.3627 -0.9785 3186311 DAlc3.1-H_000686 NC(=O)[C@]1(CC=C)N=C(O[C@@H]1c2ccccc2)c3ccc(OCCCO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C03 compound treatment 68.0 -1395.8 -1.2038 35.0 -949.55 -0.7692 -1.3952 -0.9766 2141876 DAlc3.1-H_000687 OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)NCC=C)[C@@]24C(=O)Nc5ccccc54)C(=O)O[C@H]([C@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C04 compound treatment 69.0 -1394.8 -1.203 16.0 -968.55 -0.7846 -1.4055 -0.9786 3067612 DAlc3.1-H_000688 COC(=O)[C@@]1(CC=C)N=C(O[C@H]1c2ccccc2)c3ccc(OCCCO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C05 compound treatment 144.0 -1319.8 -1.1383 138.0 -846.55 -0.6858 -1.2898 -0.9706 2141223 DAlc3.1-H_000689 OCCOc1ccc(cc1)[C@@H]2N3[C@H]([C@H](C(=O)N4CCN(CC4)c5ncccn5)[C@@]26C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)C(=O)O[C@H]([C@H]3c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C06 compound treatment 23.0 -1440.8 -1.2427 15.0 -969.55 -0.7854 -1.4341 -0.9755 3068276 DAlc3.1-H_000690 COC(=O)[C@]1(Cc2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C07 compound treatment 14.0 -1449.8 -1.2504 23.0 -961.55 -0.779 -1.435 -0.9741 2141370 DAlc3.1-H_000691 OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)NCC=C)[C@@]24C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)C(=O)O[C@H]([C@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C08 compound treatment 14.0 -1449.8 -1.2504 4.0 -980.55 -0.7944 -1.4459 -0.976 3187188 DAlc3.1-H_000692 COC(=O)[C@@]1(CCS(=O)(=O)c2ccccc2)N=C(O[C@H]1c3ccccc3)c4ccc(OCCCO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C09 compound treatment 2.0 -1461.8 -1.2608 2.0 -982.55 -0.796 -1.4543 -0.9754 2141878 DAlc3.1-H_000693 OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)N4CCCCCCC4)[C@@]25C(=O)Nc6ccccc65)C(=O)O[C@H]([C@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C10 compound treatment 6.0 -1457.8 -1.2573 9.0 -975.55 -0.7903 -1.4479 -0.975 3187193 DAlc3.1-H_000694 CC(C)(C)OC(=O)CC[C@]12N=C(O[C@@H]2c3ccccc3CN(CCS(=O)(=O)c4ccccc4)C1=O)c5ccc(OCCCO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C11 mock treatment 933.0 -530.83 -0.4578 1048.0 63.453 0.0514 -0.2874 -0.6238 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C12 mock treatment 1090.0 -373.83 -0.3224 1104.0 119.45 0.0968 -0.1596 -0.474 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C13 compound treatment 309.0 -1154.8 -0.996 207.0 -777.55 -0.6299 -1.1497 -0.9756 2141863 DAlc3.1-H_000695 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccc(OCCO)cc5)[C@]36C(=O)Nc7ccccc76)[C@@H]([C@@H](OC4=O)c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C14 compound treatment 17.0 -1446.8 -1.2478 4.0 -980.55 -0.7944 -1.444 -0.9762 3068368 DAlc3.1-H_000696 OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4)[C@H](O2)c5ccccc5CN(CCS(=O)(=O)c6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C15 mock treatment 1035.0 -428.83 -0.3698 1198.0 213.45 0.1729 -0.1392 -0.3411 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C16 mock treatment 863.0 -600.83 -0.5182 485.0 -499.55 -0.4047 -0.6526 -0.9925 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C17 compound treatment 24.0 -1439.8 -1.2418 58.0 -926.55 -0.7506 -1.4088 -0.9709 2141575 DAlc3.1-H_000697 OCCOc1ccc(cc1)[C@H]2N3[C@@H]([C@@H](C(=O)N4CCN(CC4)c5ncccn5)[C@]26C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)C(=O)O[C@@H]([C@@H]3c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C18 compound treatment 1.0 -1462.8 -1.2616 1.0 -983.55 -0.7968 -1.4555 -0.9754 3187285 DAlc3.1-H_000698 CC(C)(C)OC(=O)CC[C@@]12N=C(O[C@H]2c3ccccc3CN(CC=C)C1=O)c4ccc(OCCCO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C19 compound treatment 0.0 -1463.8 -1.2625 0.0 -984.55 -0.7976 -1.4567 -0.9755 2141722 DAlc3.1-H_000699 OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)NCC=C)[C@]24C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)C(=O)O[C@@H]([C@@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C20 compound treatment 2.0 -1461.8 -1.2608 5.0 -979.55 -0.7935 -1.4526 -0.9751 3068402 DAlc3.1-H_000700 OCCCOc1ccc(cc1)C2=N[C@]3(CC=C)[C@H](O2)c4ccccc4CN(CCS(=O)(=O)c5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C21 compound treatment 340.0 -1123.8 -0.9693 349.0 -635.55 -0.5149 -1.0494 -0.9562 2141333 DAlc3.1-H_000701 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCN(CC9)c%10ncccn%10)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C22 compound treatment 0.0 -1463.8 -1.2625 8.0 -976.55 -0.7911 -1.4521 -0.9747 3187376 DAlc3.1-H_000702 OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4CN(CCS(=O)(=O)c5ccccc5)C3=O)[C@@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C23 compound treatment 39.0 -1424.8 -1.2289 31.0 -953.55 -0.7725 -1.4152 -0.975 2141729 DAlc3.1-H_000703 OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)N4CCN(CC4)c5ncccn5)[C@]26C(=O)Nc7ccc(C#CC8(O)CCCCCC8)cc76)C(=O)O[C@@H]([C@@H]3c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 C24 compound treatment 2.0 -1461.8 -1.2608 3.0 -981.55 -0.7952 -1.4538 -0.9753 3187378 DAlc3.1-H_000704 OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4CN(Cc5ccccc5)C3=O)[C@@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D01 compound treatment 1635.0 171.17 0.1476 599.0 -385.55 -0.3123 -0.1165 -0.3371 3186868 DAlc3.1-H_000705 Cc1ccc(S[C@@]2(CC(=O)N([C@@H]2c3ccc(CO)cc3)C4CCCCC4)C(=O)NC5CC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D02 compound treatment 1.0 -1462.8 -1.2616 0.0 -984.55 -0.7976 -1.4561 -0.9755 3189400 DAlc3.1-H_000706 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(Cc4ccccc4)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D03 compound treatment 1285.0 -178.83 -0.1542 782.0 -202.55 -0.1641 -0.2251 -0.9995 3068379 DAlc3.1-H_000707 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3C(F)(F)F)[C@@H]2c4ccc(CO)cc4)C(=O)NCCN5CCOCC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D04 compound treatment 1561.0 97.172 0.0838 753.0 -231.55 -0.1876 -0.0734 -0.3572 3176371 DAlc3.1-H_000708 C[N+](C)(C)CCCC[C@@H]1NC(=O)[C@@H]2C[C@@H]([C@@H](N2C1=O)c3cccc(OCCO)c3)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D05 compound treatment 952.0 -511.83 -0.4414 650.0 -334.55 -0.271 -0.5038 -0.9726 3186886 DAlc3.1-H_000709 COc1ccc(CCNC(=O)[C@]2(CC(=O)N(Cc3ccccc3Cl)[C@@H]2c4ccc(CO)cc4)Sc5ccc(C)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D06 compound treatment 589.0 -874.83 -0.7545 987.0 2.4531 0.002 -0.5321 -0.7052 3176261 DAlc3.1-H_000710 OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)CNC3=O)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D07 compound treatment 1647.0 183.17 0.158 1575.0 590.45 0.4783 0.4499 0.8932 3068369 DAlc3.1-H_000711 Cc1ccc(S[C@@]2(CC(=O)N(C3Cc4ccccc4C3)[C@@H]2c5ccc(CO)cc5)C(=O)NCC(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D08 compound treatment 1260.0 -203.83 -0.1758 1355.0 370.45 0.3001 0.0879 0.2527 3052596 DAlc3.1-H_000712 OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@@H]4CCCN4C3=O)C(=O)NCc5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D09 compound treatment 789.0 -674.83 -0.582 657.0 -327.55 -0.2654 -0.5992 -0.9367 3186984 DAlc3.1-H_000713 COc1ccc(CCNC(=O)[C@]2(CC(=O)N(Cc3ccccc3)[C@@H]2c4ccc(CO)cc4)Sc5ccc(C)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D10 compound treatment 1336.0 -127.83 -0.1102 964.0 -20.547 -0.0166 -0.0897 -0.8047 3176323 DAlc3.1-H_000714 C[N+](C)(C)CCCCCCNC(=O)[C@@H]1C[C@H]2N([C@@H]1c3cccc(OCCO)c3)C(=O)[C@H](CCCC[N+](C)(C)C)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D11 mock treatment 2285.0 821.17 0.7082 2035.0 1050.5 0.851 1.1025 0.9958 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D12 mock treatment 1467.0 3.1719 0.0027 813.0 -171.55 -0.139 -0.0963 -0.6931 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D13 compound treatment 1498.0 34.172 0.0295 1449.0 464.45 0.3763 0.2869 0.7602 3068363 DAlc3.1-H_000715 CC(C)NC(=O)[C@]1(CC(=O)N(C(C)C)[C@@H]1c2ccc(CO)cc2)Sc3ccc(C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D14 compound treatment 888.0 -575.83 -0.4966 787.0 -197.55 -0.16 -0.4643 -0.8899 3052586 DAlc3.1-H_000716 OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)NCc5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D15 mock treatment 1618.0 154.17 0.133 1772.0 787.45 0.6379 0.5451 0.8365 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D16 mock treatment 904.0 -559.83 -0.4828 921.0 -63.547 -0.0515 -0.3778 -0.7781 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D17 compound treatment 1249.0 -214.83 -0.1853 1924.0 939.45 0.7611 0.4071 0.5198 3068196 DAlc3.1-H_000717 COc1ccccc1CN2[C@@H](c3ccc(CO)cc3)[C@]4(Cc5ccccc5N(CCN6CCOCC6)C4=O)c7ccccc7C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D18 compound treatment 814.0 -649.83 -0.5604 840.0 -144.55 -0.1171 -0.4791 -0.8368 3052707 DAlc3.1-H_000718 C[N+](C)(C)CCCC[C@@H]1NC(=O)[C@@H]2C[C@@H]([C@@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D19 compound treatment 1058.0 -405.83 -0.35 914.0 -70.547 -0.0572 -0.2879 -0.8118 3068157 DAlc3.1-H_000719 COc1ccc(CCN2C(=O)[C@]3(Cc4ccccc24)[C@@H](N(C5CCCCC5)C(=O)c6ccccc63)c7ccc(CO)cc7)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D20 compound treatment 746.0 -717.83 -0.6191 590.0 -394.55 -0.3196 -0.6638 -0.9527 3052652 DAlc3.1-H_000720 OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)CNC3=O)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D21 compound treatment 966.0 -497.83 -0.4294 1027.0 42.453 0.0344 -0.2793 -0.6484 3068192 DAlc3.1-H_000721 COCCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(C4CCCCC4)C(=O)c5ccccc52)c6ccc(CO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D22 compound treatment 289.0 -1174.8 -1.0132 179.0 -805.55 -0.6526 -1.1779 -0.9774 3176328 DAlc3.1-H_000722 CN(C)CCCC[C@@H]1NC(=O)[C@@H]2C[C@@H]([C@@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D23 compound treatment 467.0 -996.83 -0.8597 1148.0 163.45 0.1324 -0.5143 -0.5912 3068381 DAlc3.1-H_000723 CC(C)NC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(CO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 D24 compound treatment 371.0 -1092.8 -0.9425 233.0 -751.55 -0.6088 -1.097 -0.9776 3176378 DAlc3.1-H_000724 C[N+](C)(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E01 mock treatment 1488.0 24.172 0.0208 724.0 -260.55 -0.2111 -0.1345 -0.6342 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E02 mock treatment 1196.0 -267.83 -0.231 773.0 -211.55 -0.1714 -0.2845 -0.9892 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E03 compound treatment 983.0 -480.83 -0.4147 744.0 -240.55 -0.1949 -0.431 -0.9407 2141687 DAlc3.1-H_000725 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCc%10cc(OC)c(OC)cc%10C9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E04 compound treatment 35.0 -1428.8 -1.2323 21.0 -963.55 -0.7806 -1.4233 -0.9757 3187379 DAlc3.1-H_000726 OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4CN(Cc5ccccc5)C3=O)[C@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E05 compound treatment 13.0 -1450.8 -1.2513 7.0 -977.55 -0.7919 -1.4448 -0.9756 2141548 DAlc3.1-H_000727 OCCOc1ccc(cc1)[C@H]2N3[C@@H]([C@@H](C(=O)N4CCCCCCC4)[C@]25C(=O)Nc6ccc(C#CC7(O)CCCCCC7)cc65)C(=O)O[C@@H]([C@@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E06 compound treatment 7.0 -1456.8 -1.2565 11.0 -973.55 -0.7887 -1.4461 -0.9748 3187458 DAlc3.1-H_000728 CC(C)(C)OC(=O)CC[C@@]12N=C(O[C@H]2c3ccccc3CN(CCS(=O)(=O)c4ccccc4)C1=O)c5ccc(OCCCO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E07 compound treatment 342.0 -1121.8 -0.9675 375.0 -609.55 -0.4938 -1.0333 -0.9513 2141399 DAlc3.1-H_000729 OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)N4CCN(CC4)c5ncccn5)[C@@]26C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)C(=O)O[C@H]([C@H]3c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E08 compound treatment 1.0 -1462.8 -1.2616 2.0 -982.55 -0.796 -1.4549 -0.9753 3068520 DAlc3.1-H_000730 CC(C)(C)OC(=O)CC[C@]12N=C(O[C@@H]2c3ccccc3CN(CC=C)C1=O)c4ccc(OCCCO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E09 mock treatment 2038.0 574.17 0.4952 1073.0 88.453 0.0717 0.4008 0.8011 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E10 mock treatment 1963.0 499.17 0.4305 1239.0 254.45 0.2061 0.4502 0.9431 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E11 compound treatment 1137.0 -326.83 -0.2819 970.0 -14.547 -0.0118 -0.2076 -0.736 2141166 DAlc3.1-H_000731 NC(=O)NCC#Cc1ccc2NC(=O)[C@@]3([C@H]([C@H]4N([C@H]3c5ccc(OCCO)cc5)[C@@H]([C@@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E12 compound treatment 46.0 -1417.8 -1.2228 48.0 -936.55 -0.7587 -1.4012 -0.9737 3068545 DAlc3.1-H_000732 OCCCOc1ccc(cc1)C2=N[C@@]3(CC=C)[C@@H](O2)c4ccccc4CN(CCS(=O)(=O)c5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E13 compound treatment 4.0 -1459.8 -1.259 7.0 -977.55 -0.7919 -1.4503 -0.975 2141397 DAlc3.1-H_000733 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccccc3OCCO)[C@]14C(=O)Nc5ccc(C#CC6=CCCCC6)cc54)[C@@H]([C@@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E14 compound treatment 5.0 -1458.8 -1.2582 4.0 -980.55 -0.7944 -1.4514 -0.9754 3067960 DAlc3.1-H_000734 OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4)[C@@H](O2)c5ccccc5CN(CC=C)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E15 compound treatment 86.0 -1377.8 -1.1883 89.0 -895.55 -0.7255 -1.3533 -0.972 2141753 DAlc3.1-H_000735 COc1cc2CCN(Cc2cc1OC)C(=O)[C@@H]3[C@@H]4N([C@H](c5ccccc5OCCO)[C@@]36C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)[C@H]([C@H](OC4=O)c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E16 compound treatment 9.0 -1454.8 -1.2547 6.0 -978.55 -0.7927 -1.4478 -0.9755 3067970 DAlc3.1-H_000736 OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4)[C@H](O2)c5ccccc5CN(CC=C)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E17 mock treatment 1849.0 385.17 0.3322 1355.0 370.45 0.3001 0.4471 0.9987 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E18 mock treatment 1093.0 -370.83 -0.3198 850.0 -134.55 -0.109 -0.3032 -0.8974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E19 compound treatment 3.0 -1460.8 -1.2599 11.0 -973.55 -0.7887 -1.4486 -0.9746 2141856 DAlc3.1-H_000737 OCCOc1ccc(cc1)[C@@H]2N3[C@H]([C@H](C(=O)N4CCCCCCC4)[C@@]25C(=O)Nc6ccccc65)C(=O)O[C@H]([C@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E20 compound treatment 188.0 -1275.8 -1.1003 128.0 -856.55 -0.6939 -1.2687 -0.9753 3186904 DAlc3.1-H_000738 OCCCOc1ccc(cc1)C2=N[C@](CCS(=O)(=O)c3ccccc3)([C@H](O2)c4ccccc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E21 compound treatment 0.0 -1463.8 -1.2625 1.0 -983.55 -0.7968 -1.4561 -0.9754 2141727 DAlc3.1-H_000739 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccccc3OCCO)[C@@]14C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)[C@H]([C@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E22 compound treatment 489.0 -974.83 -0.8407 391.0 -593.55 -0.4808 -0.9345 -0.9649 3187292 DAlc3.1-H_000740 OCCCOc1ccc(cc1)C2=N[C@](CCS(=O)(=O)c3ccccc3)(CO2)C(=O)NCCN4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E23 compound treatment 4.0 -1459.8 -1.259 16.0 -968.55 -0.7846 -1.4451 -0.9741 2141507 DAlc3.1-H_000741 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccc(OCCO)cc6)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 E24 compound treatment 28.0 -1435.8 -1.2383 86.0 -898.55 -0.7279 -1.3904 -0.9679 3187375 DAlc3.1-H_000742 COCCCNC(=O)[C@@]1(CC=C)COC(=N1)c2ccc(OCCCO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F01 mock treatment 1345.0 -118.83 -0.1025 509.0 -475.55 -0.3852 -0.3449 -0.8651 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F02 mock treatment 1390.0 -73.828 -0.0637 382.0 -602.55 -0.4881 -0.3902 -0.7926 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F03 compound treatment 684.0 -779.83 -0.6726 589.0 -395.55 -0.3204 -0.7022 -0.9425 3187075 DAlc3.1-H_000743 CN(C)CCCNC(=O)[C@H]1[C@@H](N(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)c3ccccc13)c4ccc(CO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F04 compound treatment 1342.0 -121.83 -0.1051 613.0 -371.55 -0.301 -0.2871 -0.9006 3176047 DAlc3.1-H_000744 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F05 compound treatment 981.0 -482.83 -0.4164 486.0 -498.55 -0.4039 -0.58 -0.9999 3187429 DAlc3.1-H_000745 C[C@]1([C@@H](N(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)c3ccccc31)c4ccc(CO)cc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F06 compound treatment 1580.0 116.17 0.1002 768.0 -216.55 -0.1754 -0.0532 -0.2633 3052591 DAlc3.1-H_000746 OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)OCCOc5ccc(cc5)[C@@H]6N7[C@H]([C@H](C(=O)OCC=C)[C@@]68C(=O)Nc9ccccc98)C(=O)O[C@H]([C@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F07 compound treatment 1184.0 -279.83 -0.2413 930.0 -54.547 -0.0442 -0.2019 -0.8229 3068521 DAlc3.1-H_000747 CCCNC(=O)[C@H]1[C@@H](N(C2Cc3ccccc3C2)C(=O)c4ccccc14)c5ccc(CO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F08 compound treatment 1538.0 74.172 0.064 653.0 -331.55 -0.2686 -0.1447 -0.524 3052581 DAlc3.1-H_000748 CC(C)C[C@@H]1NC(=O)[C@@H]2C[C@@H]([C@@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F09 mock treatment 2072.0 608.17 0.5245 1334.0 349.45 0.2831 0.5711 0.9581 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F10 mock treatment 1753.0 289.17 0.2494 594.0 -390.55 -0.3164 -0.0474 -0.1176 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F11 compound treatment 547.0 -916.83 -0.7907 421.0 -563.55 -0.4565 -0.8819 -0.9659 3068461 DAlc3.1-H_000749 CCCNC(=O)[C@H]1[C@@H](N(Cc2ccccc2C(F)(F)F)C(=O)c3ccccc13)c4ccc(CO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F12 compound treatment 1183.0 -280.83 -0.2422 521.0 -463.55 -0.3755 -0.4368 -0.9775 3052698 DAlc3.1-H_000750 CN(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F13 compound treatment 1427.0 -36.828 -0.0318 860.0 -124.55 -0.1009 -0.0938 -0.8868 3187077 DAlc3.1-H_000751 CC(C)CNC(=O)[C@H]1[C@@H](N(Cc2ccccc2C(F)(F)F)C(=O)c3ccccc13)c4ccc(CO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F14 compound treatment 1538.0 74.172 0.064 819.0 -165.55 -0.1341 -0.0496 -0.3338 3176270 DAlc3.1-H_000752 OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)CNC3=O)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccccc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F15 compound treatment 1782.0 318.17 0.2744 1340.0 355.45 0.288 0.3977 0.9997 3186629 DAlc3.1-H_000753 OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3Cl)C(=O)c4ccccc4[C@]52Cc6ccccc6N(CCN7CCOCC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F16 compound treatment 1234.0 -229.83 -0.1982 762.0 -222.55 -0.1803 -0.2676 -0.9989 3176122 DAlc3.1-H_000754 OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)OCCOc5ccc(cc5)[C@@H]6N7[C@H]([C@H](C(=O)OCC=C)[C@@]68C(=O)Nc9ccccc98)C(=O)O[C@H]([C@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F17 mock treatment 2124.0 660.17 0.5694 1408.0 423.45 0.343 0.6452 0.9706 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F18 mock treatment 2203.0 739.17 0.6375 884.0 -100.55 -0.0815 0.3932 0.6118 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F19 compound treatment 887.0 -576.83 -0.4975 917.0 -67.547 -0.0547 -0.3905 -0.7802 3187128 DAlc3.1-H_000755 CC(C)CN1C(=O)[C@]2(CC(=O)N(CC3C4CC5CC(C4)CC3C5)[C@@H]2c6ccc(CO)cc16)c7ccc(cc7)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F20 compound treatment 462.0 -1001.8 -0.864 305.0 -679.55 -0.5505 -1.0002 -0.9763 3176375 DAlc3.1-H_000756 C[N+](C)(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F21 compound treatment 0.0 -1463.8 -1.2625 0.0 -984.55 -0.7976 -1.4567 -0.9755 3187117 DAlc3.1-H_000757 CN1C(=O)C2C(C3C(N(Cc4cccc(OC(F)(F)F)c4)C2C=C3CCCO)c5ccc(CN6CCCC6)cc5)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F22 compound treatment 1180.0 -283.83 -0.2448 731.0 -253.55 -0.2054 -0.3183 -0.9962 3176267 DAlc3.1-H_000758 OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)CNC3=O)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F23 compound treatment 28.0 -1435.8 -1.2383 21.0 -963.55 -0.7806 -1.4276 -0.9752 3187120 DAlc3.1-H_000759 OCc1ccc(cc1)c2cc[n+](Cc3sc4ccccc4c3Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 F24 compound treatment 959.0 -504.83 -0.4354 349.0 -635.55 -0.5149 -0.6719 -0.9965 3176046 DAlc3.1-H_000760 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@H]5N6[C@@H]([C@@H](C(=O)OCC=C)[C@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@@H]([C@@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G01 compound treatment 4.0 -1459.8 -1.259 0.0 -984.55 -0.7976 -1.4543 -0.9757 2141683 DAlc3.1-H_000761 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G02 compound treatment 43.0 -1420.8 -1.2254 1.0 -983.55 -0.7968 -1.4299 -0.9783 3186367 DAlc3.1-H_000762 OCCCOc1ccc(cc1)C2=N[C@](Cc3ccccc3)([C@H](O2)c4ccccc4)C(=O)NCCN5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G03 mock treatment 721.0 -742.83 -0.6407 373.0 -611.55 -0.4954 -0.8033 -0.9919 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G04 mock treatment 400.0 -1063.8 -0.9175 64.0 -920.55 -0.7457 -1.1761 -0.9947 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G05 compound treatment 20.0 -1443.8 -1.2452 9.0 -975.55 -0.7903 -1.4393 -0.9759 2141326 DAlc3.1-H_000763 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)NCC=C)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G06 compound treatment 217.0 -1246.8 -1.0753 52.0 -932.55 -0.7555 -1.2946 -0.9851 3186580 DAlc3.1-H_000764 OCCCOc1ccc(cc1)C2=N[C@](CC=C)(CO2)C(=O)NCCN3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G07 compound treatment 76.0 -1387.8 -1.1969 94.0 -890.55 -0.7214 -1.3565 -0.9706 2141577 DAlc3.1-H_000765 COc1cc2CCN(Cc2cc1OC)C(=O)[C@@H]3[C@@H]4N([C@H](c5ccc(OCCO)cc5)[C@@]36C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)[C@H]([C@H](OC4=O)c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G08 compound treatment 154.0 -1309.8 -1.1297 65.0 -919.55 -0.7449 -1.3255 -0.9796 3067934 DAlc3.1-H_000766 OCCCOc1ccc(cc1)C2=N[C@](Cc3ccccc3)(CO2)C(=O)NCCN4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G09 compound treatment 16.0 -1447.8 -1.2487 6.0 -978.55 -0.7927 -1.4435 -0.976 2141927 DAlc3.1-H_000767 OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)N4CCN(CC4)c5ncccn5)[C@]26C(=O)Nc7ccccc76)C(=O)O[C@@H]([C@@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G10 compound treatment 39.0 -1424.8 -1.2289 22.0 -962.55 -0.7798 -1.4203 -0.9759 3186582 DAlc3.1-H_000768 OCCCOc1ccc(cc1)C2=N[C@](Cc3ccccc3)([C@H](O2)c4ccccc4)C(=O)N5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G11 compound treatment 54.0 -1409.8 -1.2159 1.0 -983.55 -0.7968 -1.4232 -0.979 2141155 DAlc3.1-H_000769 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccc(OCCO)cc6)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G12 compound treatment 2.0 -1461.8 -1.2608 6.0 -978.55 -0.7927 -1.452 -0.975 3186443 DAlc3.1-H_000770 OCCCOc1ccc(cc1)C2=N[C@]3(CCS(=O)(=O)c4ccccc4)[C@H](O2)c5ccccc5CN(Cc6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G13 compound treatment 14.0 -1449.8 -1.2504 8.0 -976.55 -0.7911 -1.4436 -0.9756 2141922 DAlc3.1-H_000771 OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)N4CCCCCCC4)[C@]25C(=O)Nc6ccccc65)C(=O)O[C@@H]([C@@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G14 compound treatment 3.0 -1460.8 -1.2599 7.0 -977.55 -0.7919 -1.4509 -0.975 3186444 DAlc3.1-H_000772 OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4)[C@@H](O2)c5ccccc5CN(Cc6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G15 compound treatment 0.0 -1463.8 -1.2625 8.0 -976.55 -0.7911 -1.4521 -0.9747 2141680 DAlc3.1-H_000773 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCCCCCC9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G16 compound treatment 1.0 -1462.8 -1.2616 0.0 -984.55 -0.7976 -1.4561 -0.9755 3186519 DAlc3.1-H_000774 OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4CN(C(=O)c5ccccc5)C3=O)[C@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G17 compound treatment 2.0 -1461.8 -1.2608 9.0 -975.55 -0.7903 -1.4503 -0.9747 2141746 DAlc3.1-H_000775 OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)N4CCCCCCC4)[C@]25C(=O)Nc6ccc(C#CC7=CCCCC7)cc65)C(=O)O[C@@H]([C@@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G18 compound treatment 0.0 -1463.8 -1.2625 0.0 -984.55 -0.7976 -1.4567 -0.9755 3068073 DAlc3.1-H_000776 CC(C)(C)OC(=O)CC[C@@]12N=C(O[C@H]2c3ccccc3CN(C(=O)c4ccccc4)C1=O)c5ccc(OCCCO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G19 mock treatment 370.0 -1093.8 -0.9434 329.0 -655.55 -0.5311 -1.0426 -0.9631 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G20 mock treatment 403.0 -1060.8 -0.9149 130.0 -854.55 -0.6923 -1.1365 -0.9905 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G21 compound treatment 1.0 -1462.8 -1.2616 0.0 -984.55 -0.7976 -1.4561 -0.9755 2141331 DAlc3.1-H_000777 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G22 compound treatment 6.0 -1457.8 -1.2573 1.0 -983.55 -0.7968 -1.4525 -0.9758 3186520 DAlc3.1-H_000778 OCCCOc1ccc(cc1)C2=N[C@@]3(CC=C)[C@@H](O2)c4ccccc4CN(C(=O)c5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G23 compound treatment 520.0 -943.83 -0.814 228.0 -756.55 -0.6129 -1.009 -0.9902 2141903 DAlc3.1-H_000779 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccc(OCCO)cc3)[C@@]14C(=O)Nc5ccccc54)[C@H]([C@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 G24 compound treatment 169.0 -1294.8 -1.1167 1.0 -983.55 -0.7968 -1.3531 -0.9863 3068074 DAlc3.1-H_000780 OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4)[C@H](O2)c5ccccc5CN(Cc6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H01 compound treatment 130.0 -1333.8 -1.1504 84.0 -900.55 -0.7295 -1.3293 -0.9758 3068866 DAlc3.1-H_000781 OCc1ccc(cc1)c2cc[n+](Cc3cc4OCOc4cc3Br)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H02 compound treatment 1035.0 -428.83 -0.3698 615.0 -369.55 -0.2994 -0.4732 -0.9945 3176326 DAlc3.1-H_000782 CN(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H03 mock treatment 1986.0 522.17 0.4504 1793.0 808.45 0.6549 0.7816 0.9833 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H04 mock treatment 1652.0 188.17 0.1623 904.0 -80.547 -0.0653 0.0686 0.3923 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H05 compound treatment 542.0 -921.83 -0.795 237.0 -747.55 -0.6056 -0.9904 -0.991 3187208 DAlc3.1-H_000783 CN1C(=O)C2C(C3C(N(Cc4cccc(OC(F)(F)F)c4)C2C=C3CCCO)c5cccs5)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H06 compound treatment 1443.0 -20.828 -0.018 1436.0 451.45 0.3657 0.2459 0.6716 3175964 DAlc3.1-H_000784 CC(=O)NCCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H07 compound treatment 1467.0 3.1719 0.0027 1157.0 172.45 0.1397 0.1007 0.7208 3187221 DAlc3.1-H_000785 CN1C(=O)C2C(C3C(N(Cc4cc5OCOc5cc4Br)C2C=C3CCCO)c6ccc(CN7CCCC7)cc6)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H08 compound treatment 1449.0 -14.828 -0.0128 1409.0 424.45 0.3439 0.2341 0.6803 3176120 DAlc3.1-H_000786 OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)OCCOc5ccc(cc5)[C@@H]6N7[C@H]([C@H](C(=O)OCC=C)[C@@]68C(=O)Nc9ccc(I)cc98)C(=O)O[C@H]([C@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H09 compound treatment 96.0 -1367.8 -1.1797 105.0 -879.55 -0.7125 -1.338 -0.9708 3068988 DAlc3.1-H_000787 OCCCc1cc[n+](Cc2sc3ccccc3c2Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H10 compound treatment 1159.0 -304.83 -0.2629 1441.0 456.45 0.3698 0.0756 0.1666 3052545 DAlc3.1-H_000788 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@@H]5N6[C@H]([C@H](C(=O)OCC=C)[C@@]57C(=O)Nc8ccc(I)cc87)C(=O)O[C@H]([C@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H11 compound treatment 675.0 -788.83 -0.6803 721.0 -263.55 -0.2135 -0.632 -0.8864 3189534 DAlc3.1-H_000789 CN1C(=O)C2C(C3C(N(Cc4sc5ccccc5c4Cl)C2C=C3CCCO)c6ccc(CN7CCCC7)cc6)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H12 compound treatment 1300.0 -163.83 -0.1413 1110.0 125.45 0.1016 -0.028 -0.1611 3176127 DAlc3.1-H_000790 CN(C)CCCCNC(=O)[C@@H]1C[C@H]2N([C@@H]1c3cccc(OCCO)c3)C(=O)[C@@H]4CCCN4C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H13 compound treatment 13.0 -1450.8 -1.2513 29.0 -955.55 -0.7741 -1.4322 -0.9734 3189538 DAlc3.1-H_000791 CN1C(=O)C2C(C3C(C4CC4)N(Cc5sc6ccccc6c5Cl)C2C=C3CCCO)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H14 compound treatment 0.0 -1463.8 -1.2625 6.0 -978.55 -0.7927 -1.4533 -0.9749 3188106 DAlc3.1-H_000792 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(Cc4ccc(cc4)N5CCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H15 compound treatment 3.0 -1460.8 -1.2599 1.0 -983.55 -0.7968 -1.4543 -0.9756 3189665 DAlc3.1-H_000793 OCCCC1=CC(N(Cc2cccc(OC(F)(F)F)c2)/C(=N\P(=O)(Oc3ccccc3)Oc4ccccc4)/C1)c5ccc(CN6CCCC6)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H16 compound treatment 2.0 -1461.8 -1.2608 4.0 -980.55 -0.7944 -1.4532 -0.9752 3069352 DAlc3.1-H_000794 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CC(=O)N(CCO)Cc4ccccc4)C(=O)N(Cc5cccc(I)c5)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H17 compound treatment 88.0 -1375.8 -1.1866 176.0 -808.55 -0.655 -1.3022 -0.9608 3187714 DAlc3.1-H_000795 OCCCC1=CC(C2CC2)N(Cc3cc4OCOc4cc3Br)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H18 compound treatment 1.0 -1462.8 -1.2616 60.0 -924.55 -0.749 -1.4217 -0.969 3188229 DAlc3.1-H_000796 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(Cc5cccc(c5)N6CCC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H19 mock treatment 1036.0 -427.83 -0.369 1494.0 509.45 0.4127 0.0309 0.0559 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H20 mock treatment 1112.0 -351.83 -0.3034 772.0 -212.55 -0.1722 -0.3363 -0.964 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H21 compound treatment 58.0 -1405.8 -1.2125 89.0 -895.55 -0.7255 -1.3703 -0.9698 3070498 DAlc3.1-H_000797 CC1C=C(CCCO)CCN1Cc2cccc(OC(F)(F)F)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H22 compound treatment 59.0 -1404.8 -1.2116 92.0 -892.55 -0.7231 -1.368 -0.9696 3069912 DAlc3.1-H_000798 COc1ccc(NC(=O)O[C@H]([C@@H](C)C=C)c2ccc(OCCO)cc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H23 compound treatment 4.0 -1459.8 -1.259 14.0 -970.55 -0.7863 -1.4462 -0.9743 3070552 DAlc3.1-H_000799 OCCCC1=CC(C2CC2)N(Cc3sc4ccccc4c3Cl)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 H24 compound treatment 108.0 -1355.8 -1.1693 138.0 -846.55 -0.6858 -1.3118 -0.9677 3069961 DAlc3.1-H_000800 CO[C@H](C=C)[C@H](OC(=O)Nc1ccc(OC)cc1)c2ccc(OCCO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I01 compound treatment 12.0 -1451.8 -1.2521 2.0 -982.55 -0.796 -1.4482 -0.9761 2141900 DAlc3.1-H_000801 OCCOc1ccc(cc1)[C@H]2N3[C@@H]([C@@H](C(=O)N4CCCCCCC4)[C@]25C(=O)Nc6ccccc65)C(=O)O[C@@H]([C@@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I02 compound treatment 27.0 -1436.8 -1.2392 10.0 -974.55 -0.7895 -1.4345 -0.9763 3068119 DAlc3.1-H_000802 CC(C)(C)OC(=O)CC[C@]12N=C(O[C@@H]2c3ccccc3CN(C(=O)c4ccccc4)C1=O)c5ccc(OCCCO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I03 compound treatment 27.0 -1436.8 -1.2392 14.0 -970.55 -0.7863 -1.4322 -0.9759 2141883 DAlc3.1-H_000803 OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)N4CCN(CC4)c5ncccn5)[C@@]26C(=O)Nc7ccccc76)C(=O)O[C@H]([C@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I04 compound treatment 330.0 -1133.8 -0.9779 33.0 -951.55 -0.7709 -1.2365 -0.9931 3186593 DAlc3.1-H_000804 OCCCOc1ccc(cc1)C2=N[C@]3(CC=C)[C@H](O2)c4ccccc4CN(C(=O)c5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I05 mock treatment 1898.0 434.17 0.3745 1644.0 659.45 0.5342 0.6425 0.9849 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I06 mock treatment 1569.0 105.17 0.0907 1265.0 280.45 0.2272 0.2248 0.9189 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I07 compound treatment 988.0 -475.83 -0.4104 1061.0 76.453 0.0619 -0.2464 -0.5937 2141685 DAlc3.1-H_000805 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCN(CC9)c%10ncccn%10)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I08 compound treatment 176.0 -1287.8 -1.1107 24.0 -960.55 -0.7782 -1.3356 -0.9849 3186594 DAlc3.1-H_000806 OCCCOc1ccc(cc1)C2=N[C@@]3(CCS(=O)(=O)c4ccccc4)[C@@H](O2)c5ccccc5CN(C(=O)c6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I09 compound treatment 1095.0 -368.83 -0.3181 959.0 -25.547 -0.0207 -0.2396 -0.7515 2141335 DAlc3.1-H_000807 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCc%10cc(OC)c(OC)cc%10C9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I10 compound treatment 0.0 -1463.8 -1.2625 3.0 -981.55 -0.7952 -1.455 -0.9752 3068123 DAlc3.1-H_000808 OCCCOc1ccc(cc1)C2=N[C@@]3(CC=C)[C@@H](O2)c4ccccc4CN(Cc5ccccc5)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I11 compound treatment 4.0 -1459.8 -1.259 2.0 -982.55 -0.796 -1.4531 -0.9755 2141881 DAlc3.1-H_000809 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccccc3OCCO)[C@]14C(=O)Nc5ccccc54)[C@@H]([C@@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I12 compound treatment 43.0 -1420.8 -1.2254 41.0 -943.55 -0.7644 -1.407 -0.9742 3068612 DAlc3.1-H_000810 OCCCOc1ccc(cc1)C2=N[C@]3(CCS(=O)(=O)c4ccccc4)[C@H](O2)c5ccccc5CN(C(=O)c6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I13 compound treatment 83.0 -1380.8 -1.1909 86.0 -898.55 -0.7279 -1.3568 -0.9721 2141225 DAlc3.1-H_000811 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccc(OCCO)cc5)[C@]36C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)[C@@H]([C@@H](OC4=O)c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I14 compound treatment 0.0 -1463.8 -1.2625 8.0 -976.55 -0.7911 -1.4521 -0.9747 3186665 DAlc3.1-H_000812 CC(C)(C)OC(=O)CC[C@@]12N=C(O[C@H]2c3ccccc3CN(Cc4ccccc4)C1=O)c5ccc(OCCCO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I15 compound treatment 0.0 -1463.8 -1.2625 0.0 -984.55 -0.7976 -1.4567 -0.9755 2141749 DAlc3.1-H_000813 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccccc3OCCO)[C@@]14C(=O)Nc5ccc(C#CC6=CCCCC6)cc54)[C@H]([C@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I16 compound treatment 117.0 -1346.8 -1.1616 4.0 -980.55 -0.7944 -1.3831 -0.9828 3068616 DAlc3.1-H_000814 OCCCOc1ccc(cc1)C2=N[C@]3(Cc4ccccc4)[C@H](O2)c5ccccc5CN(C(=O)c6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I17 compound treatment 186.0 -1277.8 -1.1021 250.0 -734.55 -0.5951 -1.2001 -0.9582 2141401 DAlc3.1-H_000815 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccccc5OCCO)[C@]36C(=O)Nc7ccc(C#CC8=CCCCC8)cc76)[C@@H]([C@@H](OC4=O)c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I18 compound treatment 264.0 -1199.8 -1.0348 203.0 -781.55 -0.6331 -1.1794 -0.9722 3067928 DAlc3.1-H_000816 OCCCOc1ccc(cc1)C2=NC(ON2c3ccccc3)C(=O)NCc4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I19 compound treatment 7.0 -1456.8 -1.2565 3.0 -981.55 -0.7952 -1.4507 -0.9756 2141221 DAlc3.1-H_000817 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccc(OCCO)cc3)[C@]14C(=O)Nc5ccc(C#CC6=CCCCC6)cc54)[C@@H]([C@@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I20 compound treatment 243.0 -1220.8 -1.0529 175.0 -809.55 -0.6558 -1.2083 -0.974 3186974 DAlc3.1-H_000818 COc1ccc(CCNC(=O)[C@]2(CC(=O)N(Cc3ccccc3C(F)(F)F)[C@@H]2c4ccc(CO)cc4)Sc5ccc(C)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I21 mock treatment 972.0 -491.83 -0.4242 1375.0 390.45 0.3163 -0.0763 -0.1442 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I22 mock treatment 978.0 -485.83 -0.419 469.0 -515.55 -0.4177 -0.5916 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I23 compound treatment 1.0 -1462.8 -1.2616 3.0 -981.55 -0.7952 -1.4544 -0.9752 2141375 DAlc3.1-H_000819 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccccc3OCCO)[C@]14C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)[C@@H]([C@@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 I24 compound treatment 151.0 -1312.8 -1.1323 123.0 -861.55 -0.698 -1.2942 -0.973 3186553 DAlc3.1-H_000820 COc1ccc(CCNC(=O)[C@]2(Cc3ccccc3I)[C@@H](N(Cc4ccccc4C(F)(F)F)C(=O)c5ccccc52)c6ccc(CO)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J01 compound treatment 9.0 -1454.8 -1.2547 2.0 -982.55 -0.796 -1.4501 -0.9759 3070555 DAlc3.1-H_000821 OCc1ccc(cc1)C2=CC(C3CC3)N(Cc4cc5OCOc5cc4Br)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J02 compound treatment 534.0 -929.83 -0.8019 245.0 -739.55 -0.5991 -0.9907 -0.9897 3189269 DAlc3.1-H_000822 CO[C@@H](C=C)[C@@H](OC(=O)Nc1ccc(OC)cc1)c2ccc(OCCO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J03 compound treatment 38.0 -1425.8 -1.2297 4.0 -980.55 -0.7944 -1.4312 -0.9776 3188092 DAlc3.1-H_000823 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(CC=C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J04 compound treatment 751.0 -712.83 -0.6148 201.0 -783.55 -0.6348 -0.8836 -0.9999 3070295 DAlc3.1-H_000824 COc1ccc(NC(=O)O[C@@H]([C@H](C)C=C)c2ccc(OCCO)cc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J05 mock treatment 1818.0 354.17 0.3055 1341.0 356.45 0.2888 0.4202 0.9996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J06 mock treatment 1453.0 -10.828 -0.0093 913.0 -71.547 -0.058 -0.0476 -0.8106 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J07 compound treatment 5.0 -1458.8 -1.2582 0.0 -984.55 -0.7976 -1.4537 -0.9758 3069304 DAlc3.1-H_000825 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(CC=C)c4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J08 compound treatment 368.0 -1095.8 -0.9451 187.0 -797.55 -0.6461 -1.1252 -0.9828 3221197 DAlc3.1-H_000826 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)NCc2ccccc2F)c3coc4ccccc4c3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J09 compound treatment 73.0 -1390.8 -1.1995 69.0 -915.55 -0.7417 -1.3727 -0.9733 3069305 DAlc3.1-H_000827 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N2CCC[C@H]2CO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J10 compound treatment 653.0 -810.83 -0.6993 548.0 -436.55 -0.3537 -0.7446 -0.9501 2019446 DAlc3.1-H_000828 COC(CN(C)C(=O)C1=C[C@@H](C[C@H](OCCCCO)O1)c2coc3ccccc3c2=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J11 compound treatment 3.0 -1460.8 -1.2599 6.0 -978.55 -0.7927 -1.4514 -0.9751 3069306 DAlc3.1-H_000829 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(c5ccccc53)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J12 compound treatment 1680.0 216.17 0.1864 826.0 -158.55 -0.1284 0.041 0.1811 2019463 DAlc3.1-H_000830 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCCOCCOCCOCC2)c3coc4ccccc4c3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J13 compound treatment 1.0 -1462.8 -1.2616 2.0 -982.55 -0.796 -1.4549 -0.9753 3188099 DAlc3.1-H_000831 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(c4ccccc43)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J14 compound treatment 1251.0 -212.83 -0.1836 565.0 -419.55 -0.3399 -0.3701 -0.9582 3052584 DAlc3.1-H_000832 CN(C)CCCCCCNC(=O)[C@H]1C[C@@H]2N([C@H]1c3cccc(OCCO)c3)C(=O)[C@H](Cc4ccccc4)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J15 compound treatment 0.0 -1463.8 -1.2625 0.0 -984.55 -0.7976 -1.4567 -0.9755 3188488 DAlc3.1-H_000833 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(c5ccccc53)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J16 compound treatment 1294.0 -169.83 -0.1465 675.0 -309.55 -0.2508 -0.2809 -0.9672 3176048 DAlc3.1-H_000834 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)OCCOc4ccc(cc4)[C@H]5N6[C@@H]([C@@H](C(=O)OCC=C)[C@]57C(=O)Nc8ccccc87)C(=O)O[C@@H]([C@@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J17 compound treatment 8.0 -1455.8 -1.2556 20.0 -964.55 -0.7814 -1.4404 -0.974 3069450 DAlc3.1-H_000835 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(Cc4ccc(cc4)N5CCOC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J18 compound treatment 1355.0 -108.83 -0.0939 836.0 -148.55 -0.1203 -0.1515 -0.9924 3175970 DAlc3.1-H_000836 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)NCCCCN(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J19 compound treatment 2.0 -1461.8 -1.2608 16.0 -968.55 -0.7846 -1.4463 -0.974 3069320 DAlc3.1-H_000837 COc1ccc(cc1)[Si](C)(C)[C@H](CCn2cc(CCO)nn2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J20 compound treatment 1097.0 -366.83 -0.3164 671.0 -313.55 -0.254 -0.4033 -0.9941 3052531 DAlc3.1-H_000838 CC(=O)NCCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J21 mock treatment 1519.0 55.172 0.0476 1127.0 142.45 0.1154 0.1152 0.9233 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J22 mock treatment 1276.0 -187.83 -0.162 364.0 -620.55 -0.5027 -0.47 -0.8899 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J23 compound treatment 5.0 -1458.8 -1.2582 0.0 -984.55 -0.7976 -1.4537 -0.9758 3069321 DAlc3.1-H_000839 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N2Cc3ccccc3C[C@H]2CO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 J24 compound treatment 757.0 -706.83 -0.6096 401.0 -583.55 -0.4727 -0.7653 -0.9921 3052592 DAlc3.1-H_000840 OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)OCCOc5ccc(cc5)[C@H]6N7[C@@H]([C@@H](C(=O)OCC=C)[C@]68C(=O)Nc9ccccc98)C(=O)O[C@@H]([C@@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K01 compound treatment 23.0 -1440.8 -1.2427 5.0 -979.55 -0.7935 -1.4398 -0.9765 2141152 DAlc3.1-H_000841 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccc(OCCO)cc6)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCCCCCC9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K02 compound treatment 950.0 -513.83 -0.4432 986.0 1.4531 0.0012 -0.3125 -0.7052 3186888 DAlc3.1-H_000842 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3Cl)[C@@H]2c4ccc(CO)cc4)C(=O)NCC(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K03 compound treatment 483.0 -980.83 -0.8459 204.0 -780.55 -0.6323 -1.0453 -0.9897 2143865 DAlc3.1-H_000843 COCCOC(=O)N1C(=O)[C@]2([C@@H]([C@@H]3N([C@@H]2c4ccccc4OCCO)[C@H]([C@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)NCC=C)c7cc(C#Cc8ccc(OC)cc8)ccc17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K04 compound treatment 951.0 -512.83 -0.4423 264.0 -720.55 -0.5837 -0.7255 -0.9906 3186983 DAlc3.1-H_000844 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3)[C@@H]2c4ccc(CO)cc4)C(=O)NCCN5CCOCC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K05 compound treatment 1470.0 6.1719 0.0053 870.0 -114.55 -0.0928 -0.0619 -0.6655 2144653 DAlc3.1-H_000845 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccc(OCCO)cc4)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N)c7ccccc17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K06 compound treatment 370.0 -1093.8 -0.9434 468.0 -516.55 -0.4185 -0.963 -0.9331 3186791 DAlc3.1-H_000846 CC(C)CNC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(CO)cc3I)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K07 mock treatment 1354.0 -109.83 -0.0947 1354.0 369.45 0.2993 0.1447 0.4608 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K08 mock treatment 1496.0 32.172 0.0277 1249.0 264.45 0.2142 0.1711 0.7921 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K09 compound treatment 471.0 -992.83 -0.8563 385.0 -599.55 -0.4857 -0.9489 -0.9639 2141696 DAlc3.1-H_000847 NC(=O)NCC#Cc1ccc2NC(=O)[C@]3([C@@H]([C@@H]4N([C@@H]3c5ccccc5OCCO)[C@H]([C@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N8CCN(CC8)c9ncccn9)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K10 compound treatment 1486.0 22.172 0.0191 1023.0 38.453 0.0312 0.0355 0.9725 3068360 DAlc3.1-H_000848 CC(C)N1[C@H](c2ccc(CO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NCCN4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K11 compound treatment 1179.0 -284.83 -0.2457 1208.0 223.45 0.181 -0.0457 -0.1498 2141089 DAlc3.1-H_000849 OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)O)[C@]24C(=O)Nc5ccccc54)C(=O)O[C@@H]([C@@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K12 compound treatment 445.0 -1018.8 -0.8787 514.0 -470.55 -0.3812 -0.8909 -0.9301 3186882 DAlc3.1-H_000850 CN(C)CCCNC(=O)[C@]1(CC(=O)N(C2Cc3ccccc3C2)[C@@H]1c4ccc(CO)cc4)Sc5ccc(C)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K13 compound treatment 489.0 -974.83 -0.8407 324.0 -660.55 -0.5351 -0.9729 -0.9762 2141337 DAlc3.1-H_000851 NC(=O)NCC#Cc1ccc2NC(=O)[C@@]3([C@H]([C@H]4N([C@H]3c5ccccc5OCCO)[C@@H]([C@@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)NCC=C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K14 compound treatment 962.0 -501.83 -0.4328 561.0 -423.55 -0.3431 -0.5487 -0.9934 3068364 DAlc3.1-H_000852 COCCCNC(=O)[C@]1(CC(=O)N(C(C)C)[C@@H]1c2ccc(CO)cc2)Sc3ccc(C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K15 mock treatment 1441.0 -22.828 -0.0197 1481.0 496.45 0.4022 0.2705 0.6717 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K16 mock treatment 1376.0 -87.828 -0.0757 209.0 -775.55 -0.6283 -0.4978 -0.7867 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K17 compound treatment 61.0 -1402.8 -1.2099 23.0 -961.55 -0.779 -1.4063 -0.9773 2141920 DAlc3.1-H_000853 OCCOc1ccccc1[C@H]2N3[C@@H]([C@@H](C(=O)NCC=C)[C@]24C(=O)Nc5ccccc54)C(=O)O[C@@H]([C@@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K18 compound treatment 756.0 -707.83 -0.6105 733.0 -251.55 -0.2038 -0.5758 -0.8946 3186807 DAlc3.1-H_000854 CC(C)CNC(=O)[C@]1(CC(=O)N([C@@H]1c2ccc(CO)cc2)C3CCCCC3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K19 compound treatment 367.0 -1096.8 -0.946 517.0 -467.55 -0.3788 -0.9367 -0.9193 2141111 DAlc3.1-H_000855 OCCOc1ccccc1[C@@H]2N3[C@H]([C@H](C(=O)O)[C@@]24C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)C(=O)O[C@H]([C@H]3c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K20 compound treatment 258.0 -1205.8 -1.04 276.0 -708.55 -0.574 -1.1413 -0.9608 3186567 DAlc3.1-H_000856 CN(C)CCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(C4CCCCC4)C(=O)c5ccccc52)c6ccc(CO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K21 compound treatment 685.0 -778.83 -0.6717 741.0 -243.55 -0.1973 -0.6145 -0.8777 2141793 DAlc3.1-H_000857 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccc(O)cc3)[C@@]14C(=O)Nc5ccc(C#CCCO)cc54)[C@H]([C@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K22 compound treatment 517.0 -946.83 -0.8166 342.0 -642.55 -0.5205 -0.9455 -0.9764 3186973 DAlc3.1-H_000858 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3C(F)(F)F)[C@@H]2c4ccc(CO)cc4)C(=O)NC5CC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K23 mock treatment 859.0 -604.83 -0.5216 829.0 -155.55 -0.126 -0.458 -0.8534 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 K24 mock treatment 336.0 -1127.8 -0.9727 313.0 -671.55 -0.544 -1.0725 -0.9623 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L01 compound treatment 5.0 -1458.8 -1.2582 0.0 -984.55 -0.7976 -1.4537 -0.9758 3069362 DAlc3.1-H_000859 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(C)c4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L02 compound treatment 1667.0 203.17 0.1752 1345.0 360.45 0.292 0.3304 0.9702 3052654 DAlc3.1-H_000860 CN(C)CCCCNC(=O)[C@@H]1C[C@H]2N([C@@H]1c3cccc(OCCO)c3)C(=O)[C@H](CCCCN(C)C)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L03 compound treatment 0.0 -1463.8 -1.2625 0.0 -984.55 -0.7976 -1.4567 -0.9755 3188630 DAlc3.1-H_000861 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(CC=C)c4ccc(I)cc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L04 compound treatment 1394.0 -69.828 -0.0602 779.0 -205.55 -0.1665 -0.1603 -0.9054 3052647 DAlc3.1-H_000862 OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)CNC3=O)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L05 compound treatment 2.0 -1461.8 -1.2608 0.0 -984.55 -0.7976 -1.4555 -0.9756 3069365 DAlc3.1-H_000863 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(C)c4c3cc(C)cc4Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L06 compound treatment 1086.0 -377.83 -0.3259 819.0 -165.55 -0.1341 -0.3252 -0.923 3176113 DAlc3.1-H_000864 OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)[C@H](Cc4ccccc4)NC3=O)C(=O)NCc5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L07 mock treatment 2125.0 661.17 0.5702 1762.0 777.45 0.6298 0.8486 0.9988 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L08 mock treatment 1986.0 522.17 0.4504 1637.0 652.45 0.5286 0.6922 0.9968 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L09 compound treatment 3.0 -1460.8 -1.2599 0.0 -984.55 -0.7976 -1.4549 -0.9757 3188633 DAlc3.1-H_000865 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N2Cc3ccccc3C[C@H]2CO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L10 compound treatment 1227.0 -236.83 -0.2043 1332.0 347.45 0.2815 0.0546 0.157 3176203 DAlc3.1-H_000866 OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)[C@@H]4CCCN4C3=O)C(=O)OCCOc5ccc(cc5)[C@H]6N7[C@@H]([C@@H](C(=O)OCC=C)[C@]68C(=O)Nc9ccccc98)C(=O)O[C@@H]([C@@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L11 compound treatment 0.0 -1463.8 -1.2625 6.0 -978.55 -0.7927 -1.4533 -0.9749 3188769 DAlc3.1-H_000867 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(CC=C)c4ccc(I)cc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L12 compound treatment 1294.0 -169.83 -0.1465 901.0 -83.547 -0.0677 -0.1514 -0.9385 3176038 DAlc3.1-H_000868 CC(C)C[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L13 compound treatment 9.0 -1454.8 -1.2547 59.0 -925.55 -0.7498 -1.4174 -0.9697 3069645 DAlc3.1-H_000869 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(CC=C)c4ccc(NC(=O)C)cc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L14 compound treatment 869.0 -594.83 -0.513 1047.0 62.453 0.0506 -0.327 -0.6343 3176331 DAlc3.1-H_000870 CN(C)CCCCCCNC(=O)[C@H]1C[C@@H]2N([C@H]1c3cccc(OCCO)c3)C(=O)[C@H](CCCC[N+](C)(C)C)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L15 mock treatment 1762.0 298.17 0.2572 1352.0 367.45 0.2977 0.3923 0.9973 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L16 mock treatment 1459.0 -4.8281 -0.0042 1243.0 258.45 0.2094 0.1451 0.6929 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L17 compound treatment 39.0 -1424.8 -1.2289 58.0 -926.55 -0.7506 -1.3997 -0.972 3069787 DAlc3.1-H_000871 COc1ccc(cc1)[Si](C)(C)[C@@H](CCn2cc(CCO)nn2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L18 compound treatment 1203.0 -260.83 -0.225 1054.0 69.453 0.0563 -0.1193 -0.5144 3176271 DAlc3.1-H_000872 OCCOc1cccc(c1)[C@H]2[C@H](C[C@@H]3N2C(=O)CNC3=O)C(=O)OCCOc4ccc(cc4)[C@H]5N6[C@@H]([C@@H](C(=O)OCC=C)[C@]57C(=O)Nc8ccccc87)C(=O)O[C@@H]([C@@H]6c9ccccc9)c%10ccccc%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L19 compound treatment 1.0 -1462.8 -1.2616 1.0 -983.55 -0.7968 -1.4555 -0.9754 3069825 DAlc3.1-H_000873 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N4c5c3cc(OC)cc5C(=CC4(C)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L20 compound treatment 807.0 -656.83 -0.5665 781.0 -203.55 -0.1649 -0.5172 -0.8766 3052642 DAlc3.1-H_000874 OCCOc1cccc(c1)[C@@H]2[C@@H](C[C@H]3N2C(=O)[C@@H]4CCCN4C3=O)C(=O)OCCOc5ccc(cc5)[C@H]6N7[C@@H]([C@@H](C(=O)OCC=C)[C@]68C(=O)Nc9ccccc98)C(=O)O[C@@H]([C@@H]7c%10ccccc%10)c%11ccccc%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L21 compound treatment 0.0 -1463.8 -1.2625 0.0 -984.55 -0.7976 -1.4567 -0.9755 3069277 DAlc3.1-H_000875 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N(CCO)Cc2ccccc2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L22 compound treatment 1119.0 -344.83 -0.2974 1169.0 184.45 0.1494 -0.1046 -0.3144 3052529 DAlc3.1-H_000876 CN(C)CCCCNC(=O)[C@@H]1C[C@H]2N([C@@H]1c3cccc(OCCO)c3)C(=O)[C@H](CCCCNC(=O)C)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L23 mock treatment 1035.0 -428.83 -0.3698 1094.0 109.45 0.0887 -0.1988 -0.5228 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 L24 mock treatment 1244.0 -219.83 -0.1896 378.0 -606.55 -0.4914 -0.4815 -0.9142 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M01 compound treatment 429.0 -1034.8 -0.8925 460.0 -524.55 -0.4249 -0.9316 -0.9424 2141551 DAlc3.1-H_000877 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccc(OCCO)cc3)[C@@]14C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)[C@H]([C@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M02 compound treatment 1587.0 123.17 0.1062 406.0 -578.55 -0.4687 -0.2563 -0.5333 3186564 DAlc3.1-H_000878 OCc1ccc(cc1)[C@@H]2N(C3CCCCC3)C(=O)c4ccccc4[C@]52Cc6ccccc6N(CCN7CCOCC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M03 compound treatment 90.0 -1373.8 -1.1849 32.0 -952.55 -0.7717 -1.3835 -0.9784 2141328 DAlc3.1-H_000879 COc1ccc(C#Cc2ccc3NC(=O)[C@@]4([C@H]([C@H]5N([C@H]4c6ccccc6OCCO)[C@@H]([C@@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCCCCCC9)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M04 compound treatment 1723.0 259.17 0.2235 1238.0 253.45 0.2053 0.3032 0.9991 3068198 DAlc3.1-H_000880 COc1ccccc1CN2[C@@H](c3ccc(CO)cc3)[C@]4(Cc5ccccc5N(Cc6ccccc6)C4=O)c7ccccc7C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M05 compound treatment 409.0 -1054.8 -0.9097 386.0 -598.55 -0.4849 -0.9862 -0.9566 2141885 DAlc3.1-H_000881 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccccc5OCCO)[C@]36C(=O)Nc7ccccc76)[C@@H]([C@@H](OC4=O)c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M06 compound treatment 1285.0 -178.83 -0.1542 765.0 -219.55 -0.1779 -0.2348 -0.9975 3068359 DAlc3.1-H_000882 CC(C)N1[C@H](c2ccc(CO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NC4CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M07 compound treatment 213.0 -1250.8 -1.0788 183.0 -801.55 -0.6493 -1.222 -0.9705 2141346 DAlc3.1-H_000883 COc1cc2CCN(Cc2cc1OC)C(=O)[C@H]3[C@H]4N([C@@H](c5ccccc5OCCO)[C@]36C(=O)Nc7ccc(C#CCNC(=O)N)cc76)[C@@H]([C@@H](OC4=O)c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M08 compound treatment 1286.0 -177.83 -0.1534 412.0 -572.55 -0.4638 -0.4364 -0.8933 3186869 DAlc3.1-H_000884 COc1ccc(CCNC(=O)[C@]2(CC(=O)N([C@@H]2c3ccc(CO)cc3)C4CCCCC4)Sc5ccc(C)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M09 mock treatment 2230.0 766.17 0.6608 1221.0 236.45 0.1916 0.6027 0.876 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M10 mock treatment 2045.0 581.17 0.5012 1384.0 399.45 0.3236 0.5832 0.9776 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M11 compound treatment 227.0 -1236.8 -1.0667 192.0 -792.55 -0.6421 -1.2083 -0.9705 2141522 DAlc3.1-H_000885 COc1cc2CCN(Cc2cc1OC)C(=O)[C@@H]3[C@@H]4N([C@H](c5ccc(OCCO)cc5)[C@@]36C(=O)Nc7ccc(C#CCNC(=O)N)cc76)[C@H]([C@H](OC4=O)c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M12 compound treatment 781.0 -682.83 -0.5889 726.0 -258.55 -0.2095 -0.5645 -0.9032 3068329 DAlc3.1-H_000886 CC(C)NC(=O)[C@]1(CC(=O)N([C@@H]1c2ccc(CO)cc2)C3CCCCC3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M13 mock treatment 1616.0 152.17 0.1312 1115.0 130.45 0.1057 0.1675 0.9942 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M14 mock treatment 1734.0 270.17 0.233 1076.0 91.453 0.0741 0.2172 0.8881 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M15 compound treatment 22.0 -1441.8 -1.2435 54.0 -930.55 -0.7538 -1.4124 -0.9712 2141925 DAlc3.1-H_000887 NC(=O)[C@@H]1[C@@H]2N([C@H](c3ccccc3OCCO)[C@@]14C(=O)Nc5ccccc54)[C@H]([C@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M16 compound treatment 1120.0 -343.83 -0.2965 1146.0 161.45 0.1308 -0.1172 -0.3616 3186502 DAlc3.1-H_000888 OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3Cl)C(=O)c4ccccc4[C@]2(Cc5ccccc5I)C(=O)NCc6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M17 compound treatment 2.0 -1461.8 -1.2608 0.0 -984.55 -0.7976 -1.4555 -0.9756 2142605 DAlc3.1-H_000889 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccccc4OCCO)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N)c7cc(C#Cc8ccc(OC)cc8)ccc17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M18 compound treatment 1148.0 -315.83 -0.2724 1517.0 532.45 0.4313 0.1124 0.2203 3068404 DAlc3.1-H_000890 COCCCNC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(CO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M19 compound treatment 500.0 -963.83 -0.8313 921.0 -63.547 -0.0515 -0.6242 -0.7495 2143897 DAlc3.1-H_000891 COCCOC(=O)N1C(=O)[C@]2([C@@H]([C@@H]3N([C@@H]2c4ccccc4OCCO)[C@H]([C@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N7CCc8cc(OC)c(OC)cc8C7)c9cc(C#Cc%10ccc(OC)cc%10)ccc19 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M20 compound treatment 24.0 -1439.8 -1.2418 6.0 -978.55 -0.7927 -1.4386 -0.9765 3186496 DAlc3.1-H_000892 COc1ccc(CCNC(=O)[C@]2(Cc3ccccc3I)[C@@H](N(Cc4ccccc4OC)C(=O)c5ccccc52)c6ccc(CO)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M21 compound treatment 771.0 -692.83 -0.5975 695.0 -289.55 -0.2346 -0.5884 -0.9166 2142617 DAlc3.1-H_000893 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccccc4OCCO)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N7CCc8cc(OC)c(OC)cc8C7)c9cc(C#Cc%10ccc(OC)cc%10)ccc19 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M22 compound treatment 986.0 -477.83 -0.4121 635.0 -349.55 -0.2832 -0.4916 -0.9832 3068154 DAlc3.1-H_000894 OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3)C(=O)c4ccccc4[C@]2(Cc5ccccc5I)C(=O)NCc6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M23 compound treatment 319.0 -1144.8 -0.9874 89.0 -895.55 -0.7255 -1.2112 -0.9885 2142657 DAlc3.1-H_000895 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccccc4OCCO)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)N7CCc8cc(OC)c(OC)cc8C7)c9cc(C#CCNC(=O)N)ccc19 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 M24 compound treatment 257.0 -1206.8 -1.0408 329.0 -655.55 -0.5311 -1.1115 -0.9512 3068372 DAlc3.1-H_000896 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3Cl)[C@@H]2c4ccc(CO)cc4)C(=O)NC5CC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N01 compound treatment 2.0 -1461.8 -1.2608 0.0 -984.55 -0.7976 -1.4555 -0.9756 3189143 DAlc3.1-H_000897 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N4c5c3cc(OC)cc5C(=CC4(C)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N02 compound treatment 1301.0 -162.83 -0.1404 387.0 -597.55 -0.4841 -0.4416 -0.8761 3052693 DAlc3.1-H_000898 CN(C)CCCC[C@@H]1NC(=O)[C@H]2C[C@H]([C@H](N2C1=O)c3cccc(OCCO)c3)C(=O)NCc4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N03 compound treatment 1349.0 -114.83 -0.099 508.0 -476.55 -0.3861 -0.343 -0.8606 3189144 DAlc3.1-H_000899 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CC(=O)N4CCC[C@H]4CO)C(=O)N(C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N04 compound treatment 1417.0 -46.828 -0.0404 1887.0 902.45 0.7311 0.4884 0.667 3414057 DAlc3.1-H_000900 CCCCc1cn(C[C@@H]2CCCN2C(=O)N[C@H](CO)CCc3oc(C(=O)C)c(C(=O)OC)c3C(=O)OC)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N05 compound treatment 191.0 -1272.8 -1.0978 12.0 -972.55 -0.7879 -1.3333 -0.9868 3189146 DAlc3.1-H_000901 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(CC=C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N06 compound treatment 1560.0 96.172 0.0829 992.0 7.4531 0.006 0.0629 0.7566 3220741 DAlc3.1-H_000902 COC(=O)c1c(CC[C@@H](CO)NC(=O)N[C@@H](Cc2ccccc2)Cn3cc(nn3)C4(O)CCCC4)oc(C(=O)N5CCOCC5)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N07 compound treatment 6.0 -1457.8 -1.2573 0.0 -984.55 -0.7976 -1.453 -0.9759 3069327 DAlc3.1-H_000903 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(Cc4ccccc4)c5ccc(NC(=O)C)cc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N08 compound treatment 1515.0 51.172 0.0441 297.0 -687.55 -0.557 -0.3626 -0.649 3220743 DAlc3.1-H_000904 COCc1cn(C[C@H](Cc2ccccc2)NC(=O)N[C@H](CO)CCc3oc(C(=O)N4CCOCC4)c(C(=O)OC)c3C(=O)OC)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N09 mock treatment 1965.0 501.17 0.4322 437.0 -547.55 -0.4436 -0.008 -0.0129 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N10 mock treatment 1707.0 243.17 0.2097 624.0 -360.55 -0.2921 -0.0582 -0.162 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N11 compound treatment 27.0 -1436.8 -1.2392 44.0 -940.55 -0.7619 -1.415 -0.9727 3189272 DAlc3.1-H_000905 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N2CCC[C@H]2CO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N12 compound treatment 1031.0 -432.83 -0.3733 1153.0 168.45 0.1365 -0.1675 -0.4213 3188912 DAlc3.1-H_000906 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N[C@H](C)Cn3cc(CN(C)C2=O)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N13 mock treatment 1647.0 183.17 0.158 1169.0 184.45 0.1494 0.2174 0.9996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N14 mock treatment 1629.0 165.17 0.1425 1195.0 210.45 0.1705 0.2213 0.996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N15 compound treatment 1.0 -1462.8 -1.2616 2.0 -982.55 -0.796 -1.4549 -0.9753 3070282 DAlc3.1-H_000907 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N(CCO)Cc2ccccc2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N16 compound treatment 1348.0 -115.83 -0.0999 1468.0 483.45 0.3917 0.2063 0.5104 3220747 DAlc3.1-H_000908 COC(=O)c1c(CC[C@@H](CO)NC(=O)N2CCCC2)oc(C(=O)Cc3ccccc3)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N17 compound treatment 11.0 -1452.8 -1.253 13.0 -971.55 -0.7871 -1.4425 -0.9749 3189277 DAlc3.1-H_000909 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(C)c4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N18 compound treatment 1369.0 -94.828 -0.0818 842.0 -142.55 -0.1155 -0.1395 -0.9857 3220749 DAlc3.1-H_000910 COC(=O)c1c(CC[C@@H](CO)NC(=O)NCC(C)C)oc(C(=O)Cc2ccccc2)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N19 compound treatment 0.0 -1463.8 -1.2625 7.0 -977.55 -0.7919 -1.4527 -0.9748 3070285 DAlc3.1-H_000911 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(c4ccccc43)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N20 compound treatment 1351.0 -112.83 -0.0973 522.0 -462.55 -0.3747 -0.3338 -0.8621 3071252 DAlc3.1-H_000912 COc1cccc(C[C@H]2C[C@@H](CO)NC2=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N21 compound treatment 157.0 -1306.8 -1.1271 175.0 -809.55 -0.6558 -1.2607 -0.9668 3188627 DAlc3.1-H_000913 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(CC=C)c5ccc(cc53)N6CCOC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N22 compound treatment 808.0 -655.83 -0.5656 627.0 -357.55 -0.2897 -0.6048 -0.9517 3071253 DAlc3.1-H_000914 COC(=O)c1c(CC[C@@H](CO)NC(=O)N(C)Cc2ccccc2)oc(C(=O)OCC=C)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N23 compound treatment 5.0 -1458.8 -1.2582 5.0 -979.55 -0.7935 -1.4508 -0.9753 3069370 DAlc3.1-H_000915 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(Cc4cccc(NC(=O)C)c4)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 N24 compound treatment 603.0 -860.83 -0.7424 622.0 -362.55 -0.2937 -0.7327 -0.9176 3189417 DAlc3.1-H_000916 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N[C@@H](Cc3ccccc3)Cn4cc(COC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O01 compound treatment 1022.0 -441.83 -0.3811 45.0 -939.55 -0.7611 -0.8077 -0.9488 2141859 DAlc3.1-H_000917 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccc(OCCO)cc3)[C@]14C(=O)Nc5ccccc54)[C@@H]([C@@H](OC2=O)c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O02 compound treatment 1395.0 -68.828 -0.0594 1203.0 218.45 0.177 0.0832 0.4455 3186632 DAlc3.1-H_000918 OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3C(F)(F)F)C(=O)c4ccccc4[C@]52Cc6ccccc6N(CCN7CCOCC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O03 compound treatment 1334.0 -129.83 -0.112 525.0 -459.55 -0.3723 -0.3424 -0.8808 2141540 DAlc3.1-H_000919 COC(=O)C(CC#Cc1ccc2NC(=O)[C@]3([C@@H]([C@@H]4N([C@@H]3c5ccc(OCCO)cc5)[C@H]([C@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N)c2c1)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O04 compound treatment 1788.0 324.17 0.2796 882.0 -102.55 -0.0831 0.139 0.4764 3186874 DAlc3.1-H_000920 CC(C)N1[C@H](c2ccc(CO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NCc4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O05 compound treatment 17.0 -1446.8 -1.2478 2.0 -982.55 -0.796 -1.4452 -0.9764 2144725 DAlc3.1-H_000921 COCCOC(=O)N1C(=O)[C@@]2([C@H]([C@H]3N([C@H]2c4ccccc4OCCO)[C@@H]([C@@H](OC3=O)c5ccccc5)c6ccccc6)C(=O)NC[C@H](O)c7ccccc7)c8ccccc18 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O06 compound treatment 1180.0 -283.83 -0.2448 726.0 -258.55 -0.2095 -0.3212 -0.997 3186972 DAlc3.1-H_000922 CC(C)CNC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(CO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O07 compound treatment 1049.0 -414.83 -0.3578 886.0 -98.547 -0.0798 -0.3094 -0.8441 2141509 DAlc3.1-H_000923 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccc(OCCO)cc6)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)N9CCN(CC9)c%10ncccn%10)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O08 compound treatment 1158.0 -305.83 -0.2638 278.0 -706.55 -0.5724 -0.5912 -0.9381 3068201 DAlc3.1-H_000924 OCc1ccc(cc1)[C@@H]2N(Cc3ccccc3Cl)C(=O)c4ccccc4[C@]52Cc6ccccc6N(C7CC7)C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O09 compound treatment 1524.0 60.172 0.0519 730.0 -254.55 -0.2062 -0.1091 -0.5132 2141342 DAlc3.1-H_000925 NC(=O)NCC#Cc1ccc2NC(=O)[C@@]3([C@H]([C@H]4N([C@H]3c5ccccc5OCCO)[C@@H]([C@@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)N)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O10 compound treatment 1211.0 -252.83 -0.2181 473.0 -511.55 -0.4144 -0.4472 -0.955 3186880 DAlc3.1-H_000926 Cc1ccc(S[C@@]2(CC(=O)N(C3Cc4ccccc4C3)[C@@H]2c5ccc(CO)cc5)C(=O)NCc6ccccc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O11 mock treatment 1182.0 -281.83 -0.2431 1052.0 67.453 0.0546 -0.1332 -0.5348 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O12 mock treatment 1600.0 136.17 0.1174 685.0 -299.55 -0.2427 -0.0885 -0.3284 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O13 compound treatment 730.0 -733.83 -0.6329 763.0 -221.55 -0.1795 -0.5744 -0.8732 2141199 DAlc3.1-H_000927 NC(=O)[C@H]1[C@H]2N([C@@H](c3ccc(OCCO)cc3)[C@]14C(=O)Nc5ccc(C#CC6(O)CCCCCC6)cc54)[C@@H]([C@@H](OC2=O)c7ccccc7)c8ccccc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O14 compound treatment 925.0 -538.83 -0.4647 689.0 -295.55 -0.2394 -0.4979 -0.9524 3186876 DAlc3.1-H_000928 CC(C)N1[C@H](c2ccc(CO)cc2)[C@@](CC1=O)(Sc3ccc(C)cc3)C(=O)NCCCN(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O15 compound treatment 370.0 -1093.8 -0.9434 465.0 -519.55 -0.4209 -0.9647 -0.9339 2141689 DAlc3.1-H_000929 NC(=O)NCC#Cc1ccc2NC(=O)[C@]3([C@@H]([C@@H]4N([C@@H]3c5ccccc5OCCO)[C@H]([C@H](OC4=O)c6ccccc6)c7ccccc7)C(=O)NCC=C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O16 compound treatment 632.0 -831.83 -0.7174 899.0 -85.547 -0.0693 -0.5563 -0.7718 3068376 DAlc3.1-H_000930 CN(C)CCCNC(=O)[C@]1(CC(=O)N(Cc2ccccc2Cl)[C@@H]1c3ccc(CO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O17 compound treatment 33.0 -1430.8 -1.234 11.0 -973.55 -0.7887 -1.4303 -0.9766 2141678 DAlc3.1-H_000931 COc1ccc(C#Cc2ccc3NC(=O)[C@]4([C@@H]([C@@H]5N([C@@H]4c6ccccc6OCCO)[C@H]([C@H](OC5=O)c7ccccc7)c8ccccc8)C(=O)NCC=C)c3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O18 compound treatment 1012.0 -451.83 -0.3897 610.0 -374.55 -0.3034 -0.4901 -0.9923 3068221 DAlc3.1-H_000932 CN(C)CCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(Cc4ccccc4Cl)C(=O)c5ccccc52)c6ccc(CO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O19 compound treatment 5.0 -1458.8 -1.2582 9.0 -975.55 -0.7903 -1.4485 -0.9749 2141196 DAlc3.1-H_000933 OCCOc1ccc(cc1)[C@@H]2N3[C@H]([C@H](C(=O)N4CCCCCCC4)[C@@]25C(=O)Nc6ccc(C#CC7(O)CCCCCC7)cc65)C(=O)O[C@H]([C@H]3c8ccccc8)c9ccccc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O20 compound treatment 686.0 -777.83 -0.6708 216.0 -768.55 -0.6226 -0.9146 -0.9993 3068377 DAlc3.1-H_000934 CCCNC(=O)[C@]1(CC(=O)N(Cc2ccccc2C(F)(F)F)[C@@H]1c3ccc(CO)cc3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O21 compound treatment 454.0 -1009.8 -0.8709 415.0 -569.55 -0.4614 -0.9421 -0.9559 3413990 DAlc3.1-H_000935 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2cccc(F)c2)[C@@H]3OC(=O)[C@H](Cc4cccc(Br)c4)C/C=C/C[C@@H](Cc5cccc(Br)c5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O22 compound treatment 1192.0 -271.83 -0.2344 797.0 -187.55 -0.1519 -0.2732 -0.978 3186635 DAlc3.1-H_000936 CN(C)CCCN1C(=O)[C@]2(Cc3ccccc13)[C@@H](N(Cc4ccccc4C(F)(F)F)C(=O)c5ccccc52)c6ccc(CO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O23 compound treatment 504.0 -959.83 -0.8278 190.0 -794.55 -0.6437 -1.0405 -0.9923 3413998 DAlc3.1-H_000937 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccc3OCOc3c2)[C@@H]4OC(=O)[C@H](Cc5cccc(Br)c5)C/C=C/C[C@@H](Cc6cccc(Br)c6)C(=O)O[C@@H]14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 O24 compound treatment 449.0 -1014.8 -0.8752 254.0 -730.55 -0.5918 -1.0374 -0.9818 3068326 DAlc3.1-H_000938 CCCNC(=O)[C@]1(CC(=O)N([C@@H]1c2ccc(CO)cc2)C3CCCCC3)Sc4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P01 compound treatment 0.0 -1463.8 -1.2625 147.0 -837.55 -0.6785 -1.3725 -0.9576 3188637 DAlc3.1-H_000939 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(Cc5cccc(c5)N6CCOC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P02 compound treatment 1022.0 -441.83 -0.3811 671.0 -313.55 -0.254 -0.4491 -0.9806 3189550 DAlc3.1-H_000940 COc1cccc(C[C@]2(C[C@@H](CO)NC2=O)C(=O)OCc3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P03 compound treatment 1.0 -1462.8 -1.2616 0.0 -984.55 -0.7976 -1.4561 -0.9755 3069594 DAlc3.1-H_000941 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(Cc4cccc(NC(=O)C)c4)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P04 compound treatment 1408.0 -55.828 -0.0481 837.0 -147.55 -0.1195 -0.1186 -0.9201 3189551 DAlc3.1-H_000942 COc1cccc(C[C@@]2(C[C@@H](CO)NC2=O)C(=O)OCc3ccccc3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P05 compound treatment 28.0 -1435.8 -1.2383 256.0 -728.55 -0.5902 -1.293 -0.9425 3069867 DAlc3.1-H_000943 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(Cc4ccccc4)c5ccc(NC(=O)C)cc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P06 compound treatment 1129.0 -334.83 -0.2888 706.0 -278.55 -0.2257 -0.3638 -0.9926 3414058 DAlc3.1-H_000944 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N(C)Cc3cn(C[C@H](Cc4ccccc4)NC2=O)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P07 compound treatment 88.0 -1375.8 -1.1866 28.0 -956.55 -0.7749 -1.387 -0.9787 3189148 DAlc3.1-H_000945 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(CC=C)c4ccc(cc43)N5CCOC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P08 compound treatment 1485.0 21.172 0.0183 1017.0 32.453 0.0263 0.0315 0.9841 3189555 DAlc3.1-H_000946 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N(Cc3ccccc3)Cc4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P09 compound treatment 44.0 -1419.8 -1.2245 4.0 -980.55 -0.7944 -1.4276 -0.978 3070284 DAlc3.1-H_000947 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(Cc5ccc(cc5)N6CCOC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P10 compound treatment 425.0 -1038.8 -0.8959 344.0 -640.55 -0.5189 -1.0005 -0.9663 3189556 DAlc3.1-H_000948 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N(Cc3ccccc3)Cc4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P11 mock treatment 1504.0 40.172 0.0346 710.0 -274.55 -0.2224 -0.1328 -0.5898 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P12 mock treatment 1295.0 -168.83 -0.1456 691.0 -293.55 -0.2378 -0.2711 -0.9723 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P13 compound treatment 4.0 -1459.8 -1.259 3.0 -981.55 -0.7952 -1.4525 -0.9754 3189284 DAlc3.1-H_000949 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(Cc4ccc(NC(=O)C)cc4)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P14 compound treatment 1212.0 -251.83 -0.2172 632.0 -352.55 -0.2856 -0.3555 -0.9909 3189558 DAlc3.1-H_000950 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N(Cc3ccccc3)Cc4cnnn4C[C@@H](Cc5ccccc5)NC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P15 compound treatment 7.0 -1456.8 -1.2565 12.0 -972.55 -0.7879 -1.4456 -0.9747 3069350 DAlc3.1-H_000951 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(CC=C)c4ccc(cc43)N5CCC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P16 compound treatment 945.0 -518.83 -0.4475 1133.0 148.45 0.1203 -0.2314 -0.4993 3189560 DAlc3.1-H_000952 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N(Cc3ccccc3)Cc4cn(C[C@@H]5CCCN5C2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P17 compound treatment 257.0 -1206.8 -1.0408 463.0 -521.55 -0.4225 -1.0347 -0.9211 3069403 DAlc3.1-H_000953 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(CC=C)c5ccc(cc53)N6CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P18 compound treatment 1088.0 -375.83 -0.3241 844.0 -140.55 -0.1139 -0.3097 -0.9015 3071396 DAlc3.1-H_000954 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)NC3(CCCCC3)c4cn(C[C@H](C)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P19 compound treatment 0.0 -1463.8 -1.2625 2.0 -982.55 -0.796 -1.4556 -0.9753 3188499 DAlc3.1-H_000955 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCO)C(=O)N(Cc4ccc(cc4)N5CCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P20 compound treatment 1.0 -1462.8 -1.2616 0.0 -984.55 -0.7976 -1.4561 -0.9755 3187737 DAlc3.1-H_000956 CC(=CCN(CC#Cc1ccccc1)[C@H](CO)c2ccccc2)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P21 compound treatment 3.0 -1460.8 -1.2599 2.0 -982.55 -0.796 -1.4537 -0.9755 3188501 DAlc3.1-H_000957 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(C)c5c3cc(C)cc5Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P22 compound treatment 1.0 -1462.8 -1.2616 0.0 -984.55 -0.7976 -1.4561 -0.9755 3071583 DAlc3.1-H_000958 C/C=C/CN([C@H](CO)c1ccccc1)C(=O)C#Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P23 compound treatment 0.0 -1463.8 -1.2625 4.0 -980.55 -0.7944 -1.4544 -0.9751 3188758 DAlc3.1-H_000959 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(Cc5cccc(c5)N6CCOC6=O)c7ccccc73 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2439 P24 compound treatment 528.0 -935.83 -0.8071 181.0 -803.55 -0.651 -1.031 -0.9943 3562085 DAlc3.1-H_000960 CCOC(=O)[C@@H]1[C@H]2O[C@@]3(C=C2)[C@@H](N(CCCCCCO)C(=O)[C@@H]13)C(=O)NCc4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A01 compound treatment 406.0 -450.31 -0.3884 880.0 -362.47 -0.2936 -0.4823 -0.9905 3652012 DAlcMix-H_000001 CC(C)(C)[C@@H]1C[C@H](OCc2ccc(COC(=O)NCCCCCC(=O)NO)cc2)OC(=C1)C(=O)N3CCCCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A02 compound treatment 469.0 -387.31 -0.334 473.0 -769.47 -0.6234 -0.677 -0.9572 3652155 DAlcMix-H_000002 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A03 compound treatment 12.0 -844.31 -0.7282 913.0 -329.47 -0.2669 -0.7036 -0.9073 3652014 DAlcMix-H_000003 CC(C)(C)[C@@H]1C[C@H](OCc2ccc(COC(=O)NCCCCCC(=O)NO)cc2)OC(=C1)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A04 compound treatment 817.0 -39.313 -0.0339 991.0 -251.47 -0.2037 -0.168 -0.8136 3652157 DAlcMix-H_000004 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A05 compound treatment 184.0 -672.31 -0.5798 1618.0 375.53 0.3042 -0.1949 -0.2976 3652016 DAlcMix-H_000005 CC(C)(C)[C@@H]1C[C@H](OCc2ccc(COC(=O)NCCCCCC(=O)NO)cc2)OC(=C1)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A06 compound treatment 738.0 -118.31 -0.102 1023.0 -219.47 -0.1778 -0.1979 -0.9653 3652159 DAlcMix-H_000006 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A07 compound treatment 364.0 -492.31 -0.4246 400.0 -842.47 -0.6825 -0.7828 -0.9739 3652018 DAlcMix-H_000007 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)C4CCCCC4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A08 compound treatment 593.0 -263.31 -0.2271 992.0 -250.47 -0.2029 -0.3041 -0.9984 3652161 DAlcMix-H_000008 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A09 compound treatment 473.0 -383.31 -0.3306 655.0 -587.47 -0.4759 -0.5703 -0.9842 3652020 DAlcMix-H_000009 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)C6CCCCC6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A10 compound treatment 351.0 -505.31 -0.4358 704.0 -538.47 -0.4362 -0.6166 -1.0 3652163 DAlcMix-H_000010 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A11 compound treatment 205.0 -651.31 -0.5617 468.0 -774.47 -0.6274 -0.8408 -0.9985 3652022 DAlcMix-H_000011 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4ccccc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A12 compound treatment 755.0 -101.31 -0.0874 840.0 -402.47 -0.326 -0.2923 -0.866 3652165 DAlcMix-H_000012 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)N4CCCCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A13 mock treatment 735.0 -121.31 -0.1046 1204.0 -38.469 -0.0312 -0.096 -0.8795 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A14 mock treatment 633.0 -223.31 -0.1926 1135.0 -107.47 -0.0871 -0.1977 -0.9356 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A15 compound treatment 192.0 -664.31 -0.5729 1204.0 -38.469 -0.0312 -0.4272 -0.7445 3652024 DAlcMix-H_000013 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccccc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A16 compound treatment 879.0 22.688 0.0196 1013.0 -229.47 -0.1859 -0.1176 -0.6292 3652167 DAlcMix-H_000014 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A17 compound treatment 335.0 -521.31 -0.4496 542.0 -700.47 -0.5675 -0.7192 -0.9934 3652026 DAlcMix-H_000015 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4ccc5OCOc5c4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A18 compound treatment 853.0 -3.3125 -0.0029 1119.0 -123.47 -0.1 -0.0727 -0.727 3652169 DAlcMix-H_000016 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A19 compound treatment 224.0 -632.31 -0.5453 641.0 -601.47 -0.4873 -0.7302 -0.9984 3652028 DAlcMix-H_000017 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc7OCOc7c6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A20 compound treatment 476.0 -380.31 -0.328 982.0 -260.47 -0.211 -0.3811 -0.9772 3652171 DAlcMix-H_000018 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A21 compound treatment 164.0 -692.31 -0.5971 429.0 -813.47 -0.659 -0.8882 -0.9988 3652030 DAlcMix-H_000019 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4ccc(cc4)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A22 compound treatment 39.0 -817.31 -0.7049 104.0 -1138.5 -0.9223 -1.1506 -0.9912 3652173 DAlcMix-H_000020 CCO[C@H]1OC(=C[C@@H](C)[C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A23 compound treatment 188.0 -668.31 -0.5764 144.0 -1098.5 -0.8899 -1.0368 -0.9779 3652032 DAlcMix-H_000021 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc(cc6)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 A24 compound treatment 356.0 -500.31 -0.4315 151.0 -1091.5 -0.8842 -0.9303 -0.9456 3652174 DAlcMix-H_000022 CCO[C@H]1OC(=C[C@@H](C)[C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B01 compound treatment 1121.0 264.69 0.2283 952.0 -290.47 -0.2353 -0.005 -0.0152 3556439 DAlcMix-H_000023 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@@H]2N3[C@H]([C@H](C(=O)OCC=C)[C@]24C(=O)Nc5ccccc54)C(=O)O[C@H]([C@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B02 compound treatment 554.0 -302.31 -0.2607 292.0 -950.47 -0.77 -0.7288 -0.8965 3652278 DAlcMix-H_000024 C[C@@]1(Oc2ccccc2[C@H]3NC(=S)N1CC=C)[C@@H]3COC(=O)NCCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B03 compound treatment 1438.0 581.69 0.5017 1461.0 218.53 0.177 0.4799 0.9021 3556442 DAlcMix-H_000025 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@H]2N3[C@@H]([C@@H](C(=O)OCC=C)[C@@]24C(=O)Nc5ccccc54)C(=O)O[C@@H]([C@@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B04 compound treatment 554.0 -302.31 -0.2607 548.0 -694.47 -0.5626 -0.5822 -0.9389 3652280 DAlcMix-H_000026 COc1ccc(COC[C@]2(Oc3ccccc3[C@H]4NC(=O)N2CC=C)[C@@H]4COC(=O)NCCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B05 compound treatment 1164.0 307.69 0.2654 1447.0 204.53 0.1657 0.3048 0.9743 3556444 DAlcMix-H_000027 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@@H]2N3[C@H]([C@H](C(=O)OCC=C)[C@]24C(=O)Nc5ccc(I)cc54)C(=O)O[C@H]([C@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B06 compound treatment 717.0 -139.31 -0.1202 620.0 -622.47 -0.5043 -0.4415 -0.8517 3652282 DAlcMix-H_000028 COc1ccc(COC[C@]2(NC(=O)N[C@H]3[C@H]2COC(=O)NCCCCCC(=O)NO)Oc4ccccc34)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B07 compound treatment 1132.0 275.69 0.2378 1722.0 479.53 0.3885 0.4428 0.9722 3556446 DAlcMix-H_000029 ONC(=O)CCCCCNC(=O)OCCOc1ccc(cc1)[C@H]2N3[C@@H]([C@@H](C(=O)OCC=C)[C@@]24C(=O)Nc5ccc(I)cc54)C(=O)O[C@@H]([C@@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B08 compound treatment 797.0 -59.313 -0.0512 342.0 -900.47 -0.7295 -0.552 -0.7548 3652284 DAlcMix-H_000030 C[C@@]1(NC(=S)N[C@H]2[C@H]1COC(=O)NCCCCCC(=O)NO)Oc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B09 compound treatment 1083.0 226.69 0.1955 1880.0 637.53 0.5165 0.5034 0.9116 3556448 DAlcMix-H_000031 ONC(=O)CCCCCNC(=O)OCCOc1cccc(c1)[C@@H]2N3[C@H]([C@H](C(=O)OCC=C)[C@]24C(=O)Nc5ccc(I)cc54)C(=O)O[C@H]([C@H]3c6ccccc6)c7ccccc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B10 compound treatment 453.0 -403.31 -0.3478 599.0 -643.47 -0.5213 -0.6146 -0.9807 3652286 DAlcMix-H_000032 COc1ccc(COC[C@]2(NC(=S)N[C@H]3[C@H]2COC(=O)NCCCCCC(=O)NO)Oc4ccccc34)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B11 compound treatment 888.0 31.688 0.0273 1549.0 306.53 0.2483 0.1949 0.7802 3556451 DAlcMix-H_000033 CN1C(=O)[C@@H]2C[C@]/3(C)OC[C@H]([C@@H]2C1=O)\C3=C/c4cccc(COC(=O)NCCCCCC(=O)NO)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B12 compound treatment 675.0 -181.31 -0.1564 1115.0 -127.47 -0.1033 -0.1836 -0.9797 3652288 DAlcMix-H_000034 C[C@@]1(NC(=O)N[C@H]2[C@H]1COC(=O)NCCCCCC(=O)NO)Oc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B13 mock treatment 1329.0 472.69 0.4077 1916.0 673.53 0.5456 0.6741 0.9897 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B14 mock treatment 1163.0 306.69 0.2645 870.0 -372.47 -0.3017 -0.0263 -0.0656 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B15 compound treatment 1048.0 191.69 0.1653 2262.0 1019.5 0.8259 0.7009 0.8321 3556455 DAlcMix-H_000035 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCOCCOCCOC(=O)NCCCCCC(=O)NO)c2ccc(cc2)C(=O)OC)C(=O)N3CCC(CC3)N4CCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B16 compound treatment 773.0 -83.313 -0.0719 661.0 -581.47 -0.4711 -0.3839 -0.8056 3652290 DAlcMix-H_000036 C[C@]1(Oc2ccccc2[C@@H]3[C@H]1COC(=O)NCCCCCC(=O)NO)N=C4SCc5ccccc5CN34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B17 compound treatment 601.0 -255.31 -0.2202 1692.0 449.53 0.3642 0.1018 0.2392 3556457 DAlcMix-H_000037 COc1cc2CCN3CCC[C@H]4C(=NO[C@]43c2cc1OC)c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B18 compound treatment 618.0 -238.31 -0.2055 185.0 -1057.5 -0.8567 -0.7511 -0.8526 3652292 DAlcMix-H_000038 CC1(Oc2ccccc2C3C1COC(=O)NCCCCCC(=O)NO)N=C4SCC(=O)N34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B19 compound treatment 788.0 -68.313 -0.0589 1609.0 366.53 0.2969 0.1683 0.556 3556461 DAlcMix-H_000039 COc1cc2CCN3CC[C@H]4C(=NO[C@]43c2cc1OC)c5ccc(OCCOC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B20 compound treatment 375.0 -481.31 -0.4151 0.0 -1242.5 -1.0065 -1.0053 -0.9233 3652293 DAlcMix-H_000040 CN1C(=O)N[C@H]2[C@@H](COC(=O)NCCCCCC(=O)NO)[C@@]1(C)Oc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B21 compound treatment 390.0 -466.31 -0.4022 865.0 -377.47 -0.3058 -0.5006 -0.9909 3556463 DAlcMix-H_000041 COc1cc2CCN(CC=C)CCc3c(noc3-c2cc1OC)c4ccc(OCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B22 compound treatment 299.0 -557.31 -0.4807 0.0 -1242.5 -1.0065 -1.0516 -0.9428 3652295 DAlcMix-H_000042 CN1C(=S)N[C@H]2[C@@H](COC(=O)NCCCCCC(=O)NO)[C@@]1(C)Oc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B23 compound treatment 224.0 -632.31 -0.5453 601.0 -641.47 -0.5197 -0.7531 -0.9997 3556466 DAlcMix-H_000043 ONC(=O)CCCCCNC(=O)OC[C@@H]1N2CC(=C[C@@H]2[C@H](Cc3ccccc3)OC1=O)/C=C/C4CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 B24 compound treatment 109.0 -747.31 -0.6445 0.0 -1242.5 -1.0065 -1.1675 -0.9768 3652297 DAlcMix-H_000044 COc1ccc(COC[C@]2(Oc3ccccc3[C@H]4NC(=O)N2C)[C@@H]4COC(=O)NCCCCCC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C01 compound treatment 146.0 -710.31 -0.6126 167.0 -1075.5 -0.8713 -1.0493 -0.9851 3652034 DAlcMix-H_000045 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)NC3CC3)c4ccc(cc4)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C02 compound treatment 231.0 -625.31 -0.5393 41.0 -1201.5 -0.9733 -1.0696 -0.9612 3652175 DAlcMix-H_000046 CCO[C@H]1OC(=C[C@@H](C2CC2)[C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C03 compound treatment 593.0 -263.31 -0.2271 661.0 -581.47 -0.4711 -0.4937 -0.944 3652036 DAlcMix-H_000047 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4ccc(Br)cc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C04 compound treatment 348.0 -508.31 -0.4384 305.0 -937.47 -0.7595 -0.847 -0.9659 3652176 DAlcMix-H_000048 CCO[C@H]1OC(=C[C@@H](C2CC2)[C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C05 compound treatment 439.0 -417.31 -0.3599 437.0 -805.47 -0.6525 -0.7159 -0.9607 3652038 DAlcMix-H_000049 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc(Br)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C06 compound treatment 262.0 -594.31 -0.5126 284.0 -958.47 -0.7765 -0.9115 -0.9797 3652178 DAlcMix-H_000050 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C2CCCCC2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C07 compound treatment 333.0 -523.31 -0.4513 672.0 -570.47 -0.4621 -0.6459 -0.9999 3652040 DAlcMix-H_000051 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4csc5ccccc45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C08 compound treatment 336.0 -520.31 -0.4487 235.0 -1007.5 -0.8162 -0.8944 -0.9603 3652179 DAlcMix-H_000052 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C2CCCCC2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C09 compound treatment 211.0 -645.31 -0.5566 373.0 -869.47 -0.7044 -0.8916 -0.9932 3652042 DAlcMix-H_000053 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6csc7ccccc67)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C10 compound treatment 594.0 -262.31 -0.2262 759.0 -483.47 -0.3917 -0.4369 -0.966 3652181 DAlcMix-H_000054 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccccc2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C11 mock treatment 799.0 -57.313 -0.0494 994.0 -248.47 -0.2013 -0.1773 -0.8553 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C12 mock treatment 662.0 -194.31 -0.1676 292.0 -950.47 -0.77 -0.663 -0.8413 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C13 compound treatment 456.0 -400.31 -0.3453 694.0 -548.47 -0.4443 -0.5583 -0.9922 3652044 DAlcMix-H_000055 CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(COC(=O)NCCCCCC(=O)NO)cc3)OC(=C2)C(=O)N4CCCCCCC4)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C14 compound treatment 353.0 -503.31 -0.4341 575.0 -667.47 -0.5407 -0.6893 -0.9941 3652182 DAlcMix-H_000056 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccccc2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C15 mock treatment 887.0 30.688 0.0265 1240.0 -2.4688 -0.002 0.0173 0.6518 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C16 mock treatment 537.0 -319.31 -0.2754 759.0 -483.47 -0.3917 -0.4717 -0.9851 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C17 compound treatment 468.0 -388.31 -0.3349 442.0 -800.47 -0.6485 -0.6954 -0.9527 3652046 DAlcMix-H_000057 CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(COC(=O)NCCCCCC(=O)NO)cc3)OC(=C2)C(=O)N4CCOCC4)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C18 compound treatment 155.0 -701.31 -0.6049 539.0 -703.47 -0.5699 -0.8307 -0.9996 3652184 DAlcMix-H_000058 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccccc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C19 compound treatment 72.0 -784.31 -0.6764 105.0 -1137.5 -0.9215 -1.1299 -0.9884 3652048 DAlcMix-H_000059 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4coc5ccccc5c4=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C20 compound treatment 4.0 -852.31 -0.7351 331.0 -911.47 -0.7384 -1.0419 -1.0 3652185 DAlcMix-H_000060 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc3OCOc3c2)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C21 compound treatment 12.0 -844.31 -0.7282 22.0 -1220.5 -0.9887 -1.214 -0.9887 3652050 DAlcMix-H_000061 C[C@@H]1C[C@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C1)C(=O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C22 compound treatment 150.0 -706.31 -0.6092 843.0 -399.47 -0.3236 -0.6596 -0.9562 3652187 DAlcMix-H_000062 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc3OCOc3c2)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C23 compound treatment 42.0 -814.31 -0.7023 47.0 -1195.5 -0.9685 -1.1814 -0.9875 3652052 DAlcMix-H_000063 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCC2)c3ccc4OCOc4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 C24 compound treatment 250.0 -606.31 -0.5229 467.0 -775.47 -0.6282 -0.814 -0.9958 3652189 DAlcMix-H_000064 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc3OCOc3c2)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D01 compound treatment 1449.0 592.69 0.5112 2155.0 912.53 0.7393 0.8842 0.9838 3556470 DAlcMix-H_000065 Cn1c(=O)n2[C@H]3[C@@H]4[C@H](Cc5ccccc5)OC(=O)[C@H](COC(=O)NCCCCCC(=O)NO)N4CC3=C[C@@H](C6CC6)n2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D02 compound treatment 1001.0 144.69 0.1248 1275.0 32.531 0.0264 0.1069 0.838 3652299 DAlcMix-H_000066 CN1C(=O)N[C@H]2[C@@H](COC(=O)c3ccccc3)[C@]1(COC(=O)NCCCCCC(=O)NO)Oc4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D03 compound treatment 980.0 123.69 0.1067 1580.0 337.53 0.2734 0.2688 0.9157 3556474 DAlcMix-H_000067 ONC(=O)CCCCCNC(=O)OC[C@@H]1N2CC3=CC(=O)[C@H](C4CC4)[C@H]3[C@@H]2[C@H](Cc5ccccc5)OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D04 compound treatment 944.0 87.688 0.0756 1473.0 230.53 0.1868 0.1855 0.9208 3652301 DAlcMix-H_000068 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2COC(=O)NCCCCCC(=O)NO)N=C5SCc6ccccc6CN45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D05 compound treatment 673.0 -183.31 -0.1581 2088.0 845.53 0.685 0.3726 0.53 3556478 DAlcMix-H_000069 ONC(=O)CCCCCNC(=O)OC[C@@H]1N2CC3=CCCC=C[C@H]3[C@@H]2[C@H](Cc4ccccc4)OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D06 compound treatment 863.0 6.6875 0.0058 1548.0 305.53 0.2475 0.1791 0.7234 3652303 DAlcMix-H_000070 ONC(=O)CCCCCNC(=O)OC[C@@]1(Oc2ccccc2[C@@H]3[C@H]1COC(=O)c4ccccc4)N=C5SCc6ccccc6CN35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D07 compound treatment 69.0 -787.31 -0.679 38.0 -1204.5 -0.9758 -1.1701 -0.9843 3556482 DAlcMix-H_000071 CC(=CCN(C(COC(=O)NCCCCCC(=O)NO)c1ccccc1)C(=O)C#Cc2ccccc2)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D08 compound treatment 656.0 -200.31 -0.1728 1312.0 69.531 0.0563 -0.0823 -0.4531 3652305 DAlcMix-H_000072 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2COC(=O)NCCCCCC(=O)NO)N=C5SCCCN45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D09 compound treatment 886.0 29.688 0.0256 1519.0 276.53 0.224 0.1765 0.7828 3556485 DAlcMix-H_000073 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4I)C(=O)NCc5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D10 compound treatment 935.0 78.688 0.0679 1561.0 318.53 0.258 0.2305 0.8637 3652307 DAlcMix-H_000074 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2COC(=O)NCCCCCC(=O)NO)N(C)c5c6C(=O)N(C)C(=O)c6c(C(=O)C)c(=O)n45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D11 mock treatment 1254.0 397.69 0.343 1766.0 523.53 0.4241 0.5424 0.9945 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D12 mock treatment 928.0 71.688 0.0618 1185.0 -57.469 -0.0466 0.0108 0.1395 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D13 compound treatment 1172.0 315.69 0.2723 1490.0 247.53 0.2005 0.3343 0.9887 3556522 DAlcMix-H_000075 COc1ccc(CCNC(=O)[C@]2(CC(=O)N(Cc3ccccc3)[C@@H]2c4ccc(COC(=O)NCCCCCC(=O)NO)cc4I)c5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D14 compound treatment 592.0 -264.31 -0.228 882.0 -360.47 -0.292 -0.3677 -0.9925 3652309 DAlcMix-H_000076 ONC(=O)CCCCCNC(=O)OC[C@@]1(Oc2ccccc2[C@@H]3[C@H]1COC(=O)c4ccccc4)N=C5SCCCN35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D15 mock treatment 1075.0 218.69 0.1886 1990.0 747.53 0.6056 0.5616 0.8854 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D16 mock treatment 677.0 -179.31 -0.1546 441.0 -801.47 -0.6493 -0.5685 -0.8517 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D17 compound treatment 883.0 26.688 0.023 1240.0 -2.4688 -0.002 0.0149 0.6432 3556524 DAlcMix-H_000077 ONC(=O)CCCCCNC(=O)OCc1ccc(cc1)[C@H]2[C@H](C(=O)NCc3ccccc3)c4ccccc4C(=O)N2Cc5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D18 compound treatment 668.0 -188.31 -0.1624 1053.0 -189.47 -0.1535 -0.2234 -0.9996 3652311 DAlcMix-H_000078 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2COC(=O)NCCCCCC(=O)NO)N=C5SCC(=O)N45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D19 compound treatment 431.0 -425.31 -0.3668 599.0 -643.47 -0.5213 -0.628 -0.9852 3556526 DAlcMix-H_000079 C[C@]1([C@@H](N(Cc2ccccc2)C(=O)c3ccccc31)c4ccc(COC(=O)NCCCCCC(=O)NO)cc4)C(=O)NCc5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D20 compound treatment 650.0 -206.31 -0.1779 883.0 -359.47 -0.2912 -0.3317 -0.9721 3652313 DAlcMix-H_000080 ONC(=O)CCCCCNC(=O)OC[C@@]1(Oc2ccccc2[C@@H]3[C@H]1COC(=O)c4ccccc4)N=C5SCC(=O)N35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D21 compound treatment 359.0 -497.31 -0.4289 748.0 -494.47 -0.4006 -0.5865 -0.9994 3556528 DAlcMix-H_000081 COc1ccc(CCNC(=O)[C@]2(Cc3ccccc3I)[C@@H](N(Cc4ccccc4)C(=O)c5ccccc52)c6ccc(COC(=O)NCCCCCC(=O)NO)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D22 compound treatment 452.0 -404.31 -0.3487 817.0 -425.47 -0.3447 -0.4903 -1.0 3652315 DAlcMix-H_000082 CCOC(=O)OC[C@@H]1[C@@H]2NC(=O)N(C)[C@@]1(COC(=O)NCCCCCC(=O)NO)Oc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D23 compound treatment 48.0 -808.31 -0.6971 143.0 -1099.5 -0.8907 -1.1228 -0.9927 3556530 DAlcMix-H_000083 COc1ccc(CCN2C(=O)[C@]3(Cc4ccccc24)[C@@H](N(Cc5ccccc5)C(=O)c6ccccc63)c7ccc(COC(=O)NCCCCCC(=O)NO)cc7)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 D24 compound treatment 215.0 -641.31 -0.5531 417.0 -825.47 -0.6687 -0.864 -0.9956 3652317 DAlcMix-H_000084 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2COC(=O)NCCCCCC(=O)NO)N=C5Sc6ccc(cc6C(=O)N45)[N+](=O)[O-])cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E01 mock treatment 1214.0 357.69 0.3085 1780.0 537.53 0.4355 0.5261 0.9857 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E02 mock treatment 979.0 122.69 0.1058 1190.0 -52.469 -0.0425 0.0448 0.3926 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E03 compound treatment 611.0 -245.31 -0.2116 642.0 -600.47 -0.4864 -0.4936 -0.9305 3652054 DAlcMix-H_000085 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCC2)c3ccc(cc3)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E04 compound treatment 682.0 -174.31 -0.1503 939.0 -303.47 -0.2458 -0.2801 -0.9722 3652190 DAlcMix-H_000086 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E05 compound treatment 722.0 -134.31 -0.1158 1422.0 179.53 0.1454 0.0209 0.1126 3652056 DAlcMix-H_000087 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)OCC=C)c2ccc(cc2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E06 compound treatment 695.0 -161.31 -0.1391 718.0 -524.47 -0.4249 -0.3988 -0.892 3652191 DAlcMix-H_000088 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E07 compound treatment 634.0 -222.31 -0.1917 937.0 -305.47 -0.2475 -0.3106 -0.992 3652058 DAlcMix-H_000089 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCC2)c3ccc(C#C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E08 compound treatment 477.0 -379.31 -0.3271 1081.0 -161.47 -0.1308 -0.3238 -0.9191 3652192 DAlcMix-H_000090 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(cc2)C(F)(F)F)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E09 mock treatment 1376.0 519.69 0.4482 1025.0 -217.47 -0.1762 0.1924 0.3994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E10 mock treatment 1219.0 362.69 0.3128 1389.0 146.53 0.1187 0.3051 0.912 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E11 compound treatment 644.0 -212.31 -0.1831 978.0 -264.47 -0.2142 -0.281 -0.9969 3652060 DAlcMix-H_000091 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)OCC=C)c2csc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E12 compound treatment 910.0 53.688 0.0463 1300.0 57.531 0.0466 0.0657 1.0 3652193 DAlcMix-H_000092 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(C#C)cc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E13 compound treatment 554.0 -302.31 -0.2607 612.0 -630.47 -0.5108 -0.5455 -0.9513 3652062 DAlcMix-H_000093 CC(=O)n1cc([C@@H]2C[C@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C2)C(=O)N3CCOCC3)c4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E14 compound treatment 506.0 -350.31 -0.3021 1137.0 -105.47 -0.0854 -0.2741 -0.8728 3652194 DAlcMix-H_000094 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E15 compound treatment 45.0 -811.31 -0.6997 133.0 -1109.5 -0.8988 -1.1303 -0.9923 3652064 DAlcMix-H_000095 CC(=O)n1cc([C@@H]2C[C@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C2)C(=O)OCC=C)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E16 compound treatment 765.0 -91.313 -0.0788 1030.0 -212.47 -0.1721 -0.1774 -0.9372 3652195 DAlcMix-H_000096 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)N3CCN(C)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E17 mock treatment 604.0 -252.31 -0.2176 1397.0 154.53 0.1252 -0.0654 -0.2603 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E18 mock treatment 608.0 -248.31 -0.2142 817.0 -425.47 -0.3447 -0.3952 -0.9738 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E19 compound treatment 28.0 -828.31 -0.7144 43.0 -1199.5 -0.9717 -1.1922 -0.9886 3652066 DAlcMix-H_000097 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCC2)c3coc4ccccc4c3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E20 compound treatment 95.0 -761.31 -0.6566 161.0 -1081.5 -0.8761 -1.0838 -0.9899 3652196 DAlcMix-H_000098 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E21 compound treatment 3.0 -853.31 -0.7359 26.0 -1216.5 -0.9855 -1.2172 -0.9897 3652068 DAlcMix-H_000099 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c5coc6ccccc6c5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E22 compound treatment 131.0 -725.31 -0.6256 100.0 -1142.5 -0.9255 -1.0968 -0.9818 3652197 DAlcMix-H_000100 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E23 compound treatment 14.0 -842.31 -0.7265 65.0 -1177.5 -0.9539 -1.1882 -0.991 3652070 DAlcMix-H_000101 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCCCCCC3)C4CCCCC4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 E24 compound treatment 9.0 -847.31 -0.7308 24.0 -1218.5 -0.9871 -1.2147 -0.9891 3652198 DAlcMix-H_000102 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2csc3ccccc23)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F01 mock treatment 1227.0 370.69 0.3197 1695.0 452.53 0.3666 0.4853 0.9977 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F02 mock treatment 969.0 112.69 0.0972 1003.0 -239.47 -0.194 -0.0685 -0.3155 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F03 compound treatment 1017.0 160.69 0.1386 578.0 -664.47 -0.5383 -0.2826 -0.5085 3556532 DAlcMix-H_000103 ONC(=O)CCCCCNC(=O)OCCCCOC1CC2C(=CC1C(=O)[C@@]32CCCO3)I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F04 compound treatment 378.0 -478.31 -0.4125 1004.0 -238.47 -0.1932 -0.4283 -0.9403 3616059 DAlcMix-H_000104 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccccc4)c5ccc(NC(=O)[C@@H](C)OC(=O)NCCCCCC(=O)NO)cc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F05 compound treatment 1574.0 717.69 0.619 858.0 -384.47 -0.3115 0.2174 0.3138 3556534 DAlcMix-H_000105 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)Cn4cc(CN(C)C2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F06 compound treatment 467.0 -389.31 -0.3358 451.0 -791.47 -0.6412 -0.6908 -0.9544 3616063 DAlcMix-H_000106 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccccc4)c5ccc(NC(=O)[C@@H](C)OC(=O)NCCCCCC(=O)NO)cc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F07 compound treatment 748.0 -108.31 -0.0934 1010.0 -232.47 -0.1883 -0.1992 -0.9477 3556536 DAlcMix-H_000107 COC(=O)c1c(CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc2ccccc2)Cn3cc(nn3)c4ccccc4)oc(C(=O)N5CCOCC5)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F08 compound treatment 303.0 -553.31 -0.4772 266.0 -976.47 -0.7911 -0.8968 -0.9707 3616071 DAlcMix-H_000108 COc1cc2CCN(CC(C)OC(=O)NCCCCCC(=O)NO)CCCc3c(noc3-c2cc1OC)c4ccc(OCCO[Si](C(C)C)(C(C)C)C(C)C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F09 mock treatment 1026.0 169.69 0.1463 1345.0 102.53 0.0831 0.1622 0.964 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F10 mock treatment 1400.0 543.69 0.4689 18.0 -1224.5 -0.992 -0.3699 -0.3371 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F11 compound treatment 1260.0 403.69 0.3482 991.0 -251.47 -0.2037 0.1021 0.2532 3556538 DAlcMix-H_000109 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](C)Cn3cc(CN(C)C2=O)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F12 compound treatment 542.0 -314.31 -0.2711 287.0 -955.47 -0.774 -0.739 -0.9011 3616074 DAlcMix-H_000110 ONC(=O)CCCCCNC(=O)OCC(N(C/C=C/c1ccccc1)CC#C)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F13 compound treatment 1256.0 399.69 0.3447 22.0 -1220.5 -0.9887 -0.4554 -0.4349 3556540 DAlcMix-H_000111 ONC(=O)CCCCCNC(=O)OCc1ccc(CN([C@@H](Cc2ccccc2)Cn3cc(nn3)c4ccccn4)C(=O)Nc5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F14 compound treatment 338.0 -518.31 -0.447 341.0 -901.47 -0.7303 -0.8325 -0.9723 3616079 DAlcMix-H_000112 ONC(=O)CCCCCNC(=O)OCCCCOC1CC2C(=CC1C(=O)[C@@]32CO3)Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F15 compound treatment 989.0 132.69 0.1144 626.0 -616.47 -0.4994 -0.2722 -0.5313 3556542 DAlcMix-H_000113 CC(=O)c1cc(c(CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)NCCc2c[nH]c3ccccc23)o1)S(=O)(=O)c4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F16 compound treatment 1040.0 183.69 0.1584 1089.0 -153.47 -0.1243 0.0241 0.1197 3616085 DAlcMix-H_000114 CC[C@@H](OC(=O)NCCCCCC(=O)NO)c1cc(nc(c1)c2ccc(OC)nc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F17 mock treatment 1003.0 146.69 0.1265 1376.0 133.53 0.1082 0.1659 0.997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F18 mock treatment 954.0 97.688 0.0843 897.0 -345.47 -0.2799 -0.1383 -0.4733 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F19 compound treatment 872.0 15.688 0.0135 828.0 -414.47 -0.3358 -0.2279 -0.6781 3556544 DAlcMix-H_000115 CC(=O)c1cc(c(CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)Nc2nc[nH]n2)o1)S(=O)(=O)c3ccc(C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F20 compound treatment 546.0 -310.31 -0.2676 824.0 -418.47 -0.339 -0.429 -0.9931 3616090 DAlcMix-H_000116 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)C(=O)NCc4cn(C[C@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc7ccccc7)C(=O)NCc8cn(C[C@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F21 compound treatment 683.0 -173.31 -0.1495 1484.0 241.53 0.1957 0.0327 0.1327 3556546 DAlcMix-H_000117 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4NC3=O)[C@@H](O2)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F22 compound treatment 739.0 -117.31 -0.1012 644.0 -598.47 -0.4848 -0.4144 -0.8366 3616094 DAlcMix-H_000118 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc3ccccc3)C(=O)NCc4cn(C[C@@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc7ccccc7)C(=O)NCc8cn(C[C@@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F23 compound treatment 380.0 -476.31 -0.4108 613.0 -629.47 -0.5099 -0.6511 -0.9943 3556548 DAlcMix-H_000119 COC(=O)[C@H]1N=C(O[C@H]1c2ccccc2)c3ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 F24 compound treatment 716.0 -140.31 -0.121 492.0 -750.47 -0.608 -0.5155 -0.8315 3616095 DAlcMix-H_000120 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)C(=O)NCc4cn(C[C@@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc7ccccc7)C(=O)NCc8cn(C[C@@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G01 compound treatment 692.0 -164.31 -0.1417 1101.0 -141.47 -0.1146 -0.1812 -0.9945 3652072 DAlcMix-H_000121 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)C4CCCCC4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G02 compound treatment 2.0 -854.31 -0.7368 0.0 -1242.5 -1.0065 -1.2327 -0.9882 3652199 DAlcMix-H_000122 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2csc3ccccc23)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G03 mock treatment 45.0 -811.31 -0.6997 361.0 -881.47 -0.7141 -0.9997 -0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G04 mock treatment 18.0 -838.31 -0.723 19.0 -1223.5 -0.9911 -1.2121 -0.988 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G05 compound treatment 113.0 -743.31 -0.6411 18.0 -1224.5 -0.992 -1.1547 -0.9777 3652073 DAlcMix-H_000123 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)C6CCCCC6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G06 compound treatment 15.0 -841.31 -0.7256 40.0 -1202.5 -0.9741 -1.2019 -0.9895 3652201 DAlcMix-H_000124 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G07 compound treatment 18.0 -838.31 -0.723 2.0 -1240.5 -1.0049 -1.2218 -0.987 3652074 DAlcMix-H_000125 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4ccccc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G08 compound treatment 42.0 -814.31 -0.7023 92.0 -1150.5 -0.932 -1.1556 -0.9903 3652202 DAlcMix-H_000126 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G09 compound treatment 8.0 -848.31 -0.7316 13.0 -1229.5 -0.996 -1.2216 -0.9885 3652075 DAlcMix-H_000127 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccccc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G10 compound treatment 30.0 -826.31 -0.7127 21.0 -1221.5 -0.9895 -1.2036 -0.987 3652203 DAlcMix-H_000128 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G11 compound treatment 40.0 -816.31 -0.704 3.0 -1239.5 -1.0041 -1.2078 -0.9849 3652076 DAlcMix-H_000129 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)OCC=C)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G12 compound treatment 59.0 -797.31 -0.6876 37.0 -1205.5 -0.9766 -1.1768 -0.9853 3652204 DAlcMix-H_000130 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G13 compound treatment 147.0 -709.31 -0.6118 90.0 -1152.5 -0.9336 -1.0928 -0.979 3652078 DAlcMix-H_000131 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCCCCCC3)c4ccc(cc4)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G14 compound treatment 50.0 -806.31 -0.6954 92.0 -1150.5 -0.932 -1.1508 -0.9896 3652205 DAlcMix-H_000132 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G15 compound treatment 63.0 -793.31 -0.6842 103.0 -1139.5 -0.9231 -1.1365 -0.9891 3652080 DAlcMix-H_000133 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4ccc(cc4)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G16 compound treatment 17.0 -839.31 -0.7239 32.0 -1210.5 -0.9806 -1.2053 -0.9888 3652206 DAlcMix-H_000134 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G17 compound treatment 134.0 -722.31 -0.623 17.0 -1225.5 -0.9928 -1.1425 -0.9748 3652081 DAlcMix-H_000135 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc(cc6)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G18 compound treatment 15.0 -841.31 -0.7256 4.0 -1238.5 -1.0033 -1.2225 -0.9873 3652208 DAlcMix-H_000136 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G19 mock treatment 60.0 -796.31 -0.6868 70.0 -1172.5 -0.9498 -1.1573 -0.9873 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G20 mock treatment 27.0 -829.31 -0.7152 91.0 -1151.5 -0.9328 -1.1654 -0.9914 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G21 compound treatment 31.0 -825.31 -0.7118 42.0 -1200.5 -0.9725 -1.191 -0.9882 3652082 DAlcMix-H_000137 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)OCC=C)c3ccc(C#C)cc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G22 compound treatment 34.0 -822.31 -0.7092 7.0 -1235.5 -1.0009 -1.2092 -0.9858 3652209 DAlcMix-H_000138 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G23 compound treatment 11.0 -845.31 -0.729 50.0 -1192.5 -0.966 -1.1986 -0.9904 3652084 DAlcMix-H_000139 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCCCCCC3)c4ccc(Br)cc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 G24 compound treatment 66.0 -790.31 -0.6816 0.0 -1242.5 -1.0065 -1.1937 -0.982 3652210 DAlcMix-H_000140 CC(C)(C)[C@@H]1C[C@H](OCc2ccc(COC(=O)NCCCCCC(=O)NO)cc2)OC(=C1)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H01 compound treatment 139.0 -717.31 -0.6187 423.0 -819.47 -0.6639 -0.9069 -0.9994 3556550 DAlcMix-H_000141 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4N(CCS(=O)(=O)c5ccccc5)C3=O)[C@@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H02 compound treatment 1246.0 389.69 0.3361 1646.0 403.53 0.3269 0.4688 0.9999 3616097 DAlcMix-H_000142 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc3ccccc3)C(=O)NCc4cn(C[C@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc7ccccc7)C(=O)NCc8cn(C[C@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H03 mock treatment 1252.0 395.69 0.3413 2216.0 973.53 0.7887 0.799 0.9298 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H04 mock treatment 1200.0 343.69 0.2964 1498.0 255.53 0.207 0.356 0.9846 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H05 compound treatment 1532.0 675.69 0.5828 1348.0 105.53 0.0855 0.4725 0.8023 3556552 DAlcMix-H_000143 CC(=O)N1Cc2ccccc2[C@@H]3OC(=N[C@]3(CCS(=O)(=O)c4ccccc4)C1=O)c5ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H06 compound treatment 1223.0 366.69 0.3163 2202.0 959.53 0.7773 0.7733 0.9214 3616100 DAlcMix-H_000144 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc7ccccc7)c8cn(C[C@@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H07 compound treatment 903.0 46.688 0.0403 1295.0 52.531 0.0426 0.0586 0.9996 3556554 DAlcMix-H_000145 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4)[C@@H](O2)c5ccccc5CN(Cc6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H08 compound treatment 1104.0 247.69 0.2136 1453.0 210.53 0.1706 0.2717 0.9938 3616104 DAlcMix-H_000146 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc7ccccc7)c8cn(C[C@@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H09 compound treatment 754.0 -102.31 -0.0882 1434.0 191.53 0.1552 0.0473 0.2651 3556556 DAlcMix-H_000147 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4)[C@@H](O2)c5ccccc5NC3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H10 compound treatment 1136.0 279.69 0.2412 1659.0 416.53 0.3374 0.4092 0.9865 3616108 DAlcMix-H_000148 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@H](Cc5ccccc5)NC(=O)c6oc(CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc7ccccc7)c8cn(C[C@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H11 compound treatment 679.0 -177.31 -0.1529 967.0 -275.47 -0.2232 -0.2659 -0.983 3556558 DAlcMix-H_000149 COC(=O)[C@]1(CCS(=O)(=O)c2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H12 compound treatment 777.0 -79.313 -0.0684 1466.0 223.53 0.1811 0.0797 0.4116 3652319 DAlcMix-H_000150 COc1ccc(cc1)N2[C@H](COC(=O)NCCCCCC(=O)NO)[C@H](Cc3ccccc3)[C@@H]4N(CCc5cc(OC)c(OC)cc45)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H13 compound treatment 440.0 -416.31 -0.3591 605.0 -637.47 -0.5164 -0.6191 -0.9842 3556560 DAlcMix-H_000151 COC(=O)[C@]1(Cc2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCOC(=O)NCCCCCC(=O)NO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H14 compound treatment 182.0 -674.31 -0.5816 460.0 -782.47 -0.6339 -0.8595 -0.9991 3652321 DAlcMix-H_000152 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)Nc3ccccc3c4ccccc4)[C@@H]1OC(=O)Nc5ccccc5c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H15 compound treatment 1266.0 409.69 0.3533 1605.0 362.53 0.2937 0.4575 0.9958 3556562 DAlcMix-H_000153 ONC(=O)CCCCCNC(=O)OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4CNC3=O)[C@@H](O2)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H16 compound treatment 399.0 -457.31 -0.3944 766.0 -476.47 -0.386 -0.5518 -0.9999 3652323 DAlcMix-H_000154 CCOP(=O)(CC(=O)O[C@@H]1[C@@H](COC(=O)NCCCCCC(=O)NO)O[C@H](OC)[C@@H](OC(=O)Nc2ccccc2c3ccccc3)[C@H]1OC(=O)Nc4ccccc4c5ccccc5)OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H17 compound treatment 13.0 -843.31 -0.7273 16.0 -1226.5 -0.9936 -1.2169 -0.9882 3556564 DAlcMix-H_000155 C[C@H]1COC(=O)[C@H](CC/C=C/C[C@H](CC(=O)N(CCOC(=O)NCCCCCC(=O)NO)Cc2ccccc2)C(=O)N1)NC(=O)OCC3c4ccccc4-c5ccccc35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H18 compound treatment 262.0 -594.31 -0.5126 635.0 -607.47 -0.4921 -0.7104 -0.9998 3652325 DAlcMix-H_000156 CCOP(=O)(CC(=O)O[C@@H]1[C@@H](COC(=O)NCCCCCC(=O)NO)O[C@H](OC)[C@@H]2OC(=O)[C@@H](Cc3ccc4ccccc4c3)C/C=C\C[C@H](Cc5ccc6ccccc6c5)C(=O)O[C@@H]12)OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H19 mock treatment 1109.0 252.69 0.2179 1455.0 212.53 0.1722 0.2758 0.9932 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H20 mock treatment 696.0 -160.31 -0.1383 759.0 -483.47 -0.3917 -0.3747 -0.9022 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H21 compound treatment 29.0 -827.31 -0.7135 91.0 -1151.5 -0.9328 -1.1641 -0.9912 3556566 DAlcMix-H_000157 C[C@H]1CNC(=O)[C@@H](CC(=O)N(CCOC(=O)NCCCCCC(=O)NO)Cc2ccccc2)C/C=C/CC[C@H](NC(=O)OC(C)(C)C)C(=O)O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H22 compound treatment 139.0 -717.31 -0.6187 397.0 -845.47 -0.6849 -0.9218 -0.9987 3652327 DAlcMix-H_000158 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@H](OC(=O)Nc2ccccc2)[C@H](OC(=O)Nc3ccccc3)[C@H]1OC(=O)Nc4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H23 compound treatment 481.0 -375.31 -0.3237 908.0 -334.47 -0.271 -0.4205 -0.9961 3556568 DAlcMix-H_000159 CCOC(=O)C1=C(C)NC(=O)NC1c2ccc(OCCOC(=O)NCCCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 H24 compound treatment 102.0 -754.31 -0.6506 151.0 -1091.5 -0.8842 -1.0853 -0.9886 3652329 DAlcMix-H_000160 ONC(=O)CCCCCNC(=O)OC[C@H]1OC=C[C@@H](OC(=O)Nc2ccccc2)[C@@H]1OC(=O)Nc3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I01 compound treatment 224.0 -632.31 -0.5453 241.0 -1001.5 -0.8113 -0.9593 -0.9813 3652086 DAlcMix-H_000161 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4ccc(Br)cc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I02 compound treatment 54.0 -802.31 -0.692 58.0 -1184.5 -0.9596 -1.1678 -0.9871 3652212 DAlcMix-H_000162 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)C5CCCCC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I03 compound treatment 751.0 -105.31 -0.0908 1693.0 450.53 0.365 0.1939 0.5154 3652087 DAlcMix-H_000163 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc(Br)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I04 compound treatment 1035.0 178.69 0.1541 1387.0 144.53 0.1171 0.1918 0.9908 3652214 DAlcMix-H_000164 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I05 mock treatment 1180.0 323.69 0.2792 1739.0 496.53 0.4022 0.4818 0.9841 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I06 mock treatment 1138.0 281.69 0.2429 1857.0 614.53 0.4978 0.5238 0.9456 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I07 compound treatment 720.0 -136.31 -0.1176 1226.0 -16.469 -0.0133 -0.0926 -0.7823 3652088 DAlcMix-H_000165 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4csc5ccccc45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I08 compound treatment 546.0 -310.31 -0.2676 813.0 -429.47 -0.3479 -0.4353 -0.9916 3652216 DAlcMix-H_000166 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccc(cc5)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I09 compound treatment 108.0 -748.31 -0.6454 432.0 -810.47 -0.6566 -0.9206 -1.0 3652089 DAlcMix-H_000167 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)OCC=C)c3csc4ccccc34)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I10 compound treatment 195.0 -661.31 -0.5704 363.0 -879.47 -0.7125 -0.9071 -0.9939 3652218 DAlcMix-H_000168 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5csc6ccccc56)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I11 compound treatment 442.0 -414.31 -0.3573 962.0 -280.47 -0.2272 -0.4133 -0.9761 3652091 DAlcMix-H_000169 CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(COC(=O)NCCCCCC(=O)NO)cc3)OC(=C2)C(=O)N4CCOCC4)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I12 compound treatment 196.0 -660.31 -0.5695 574.0 -668.47 -0.5415 -0.7856 -0.9997 3652220 DAlcMix-H_000170 CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(COC(=O)NCCCCCC(=O)NO)cc3)OC(=C2)C(=O)N4CCN(Cc5ccccc5)CC4)c6ccccc16 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I13 compound treatment 18.0 -838.31 -0.723 32.0 -1210.5 -0.9806 -1.2046 -0.9888 3652092 DAlcMix-H_000171 CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(COC(=O)NCCCCCC(=O)NO)cc3)OC(=C2)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4)c7ccccc17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I14 compound treatment 1086.0 229.69 0.1981 968.0 -274.47 -0.2224 -0.0172 -0.0576 3652222 DAlcMix-H_000172 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5coc6ccccc6c5=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I15 compound treatment 166.0 -690.31 -0.5954 654.0 -588.47 -0.4767 -0.7581 -0.9939 3652094 DAlcMix-H_000173 CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(COC(=O)NCCCCCC(=O)NO)cc3)OC(=C2)C(=O)OCC=C)c4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I16 compound treatment 443.0 -413.31 -0.3565 835.0 -407.47 -0.3301 -0.4855 -0.9993 3652224 DAlcMix-H_000174 CC(C)(C)[C@@H]1C[C@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C1)C(=O)N2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I17 compound treatment 56.0 -800.31 -0.6902 44.0 -1198.5 -0.9709 -1.1746 -0.986 3652096 DAlcMix-H_000175 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4coc5ccccc5c4=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I18 compound treatment 52.0 -804.31 -0.6937 176.0 -1066.5 -0.864 -1.1014 -0.9941 3652226 DAlcMix-H_000176 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccc(cc4)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I19 compound treatment 584.0 -272.31 -0.2349 1198.0 -44.469 -0.036 -0.1915 -0.8061 3652097 DAlcMix-H_000177 C[C@H]1C[C@@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C1)C(=O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I20 compound treatment 0.0 -856.31 -0.7385 148.0 -1094.5 -0.8866 -1.1492 -0.9959 3652228 DAlcMix-H_000178 CC(=O)n1cc([C@@H]2C[C@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I21 mock treatment 577.0 -279.31 -0.2409 1283.0 40.531 0.0328 -0.1471 -0.6051 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I22 mock treatment 82.0 -774.31 -0.6678 1282.0 39.531 0.032 -0.4496 -0.6724 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I23 compound treatment 373.0 -483.31 -0.4168 808.0 -434.47 -0.352 -0.5436 -0.9965 3652098 DAlcMix-H_000179 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)C3CCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 I24 compound treatment 3.0 -853.31 -0.7359 9.0 -1233.5 -0.9992 -1.227 -0.9887 3652230 DAlcMix-H_000180 ONC(=O)CCCCCNC(=O)OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4coc5ccccc5c4=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J01 compound treatment 214.0 -642.31 -0.554 484.0 -758.47 -0.6144 -0.8262 -0.9987 3556569 DAlcMix-H_000181 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J02 compound treatment 830.0 -26.313 -0.0227 779.0 -463.47 -0.3755 -0.2815 -0.7485 3652331 DAlcMix-H_000182 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@H](OC(=O)Nc3ccccc3c4ccccc4)[C@H]1OC(=O)Nc5ccccc5c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J03 compound treatment 395.0 -461.31 -0.3979 408.0 -834.47 -0.676 -0.7593 -0.9681 3556571 DAlcMix-H_000183 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccccc4)c5ccc(I)cc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J04 compound treatment 438.0 -418.31 -0.3608 331.0 -911.47 -0.7384 -0.7772 -0.9457 3652333 DAlcMix-H_000184 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@H](OC(=O)Nc3ccccc3c4ccccc4)[C@@H]1OC(=O)Nc5ccccc5c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J05 mock treatment 1125.0 268.69 0.2317 1468.0 225.53 0.1827 0.2931 0.9931 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J06 mock treatment 1048.0 191.69 0.1653 1375.0 132.53 0.1074 0.1928 0.9782 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J07 compound treatment 300.0 -556.31 -0.4798 290.0 -952.47 -0.7716 -0.8849 -0.9739 3556573 DAlcMix-H_000185 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J08 compound treatment 609.0 -247.31 -0.2133 517.0 -725.47 -0.5877 -0.5664 -0.9059 3616254 DAlcMix-H_000186 ONC(=O)CCCCCNC(=O)OCC(NS(=O)(=O)c1ccc(Br)cc1)C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J09 compound treatment 200.0 -656.31 -0.566 249.0 -993.47 -0.8048 -0.9693 -0.9852 3556575 DAlcMix-H_000187 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4ccccc4)c5ccc(I)cc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J10 compound treatment 616.0 -240.31 -0.2073 1258.0 15.531 0.0126 -0.1377 -0.663 3616257 DAlcMix-H_000188 CC(C)(C)OC(=O)N[C@@H](COC(=O)NCCCCCC(=O)NO)C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J11 compound treatment 162.0 -694.31 -0.5988 180.0 -1062.5 -0.8607 -1.032 -0.9843 3556577 DAlcMix-H_000189 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4cccc(c4)N5CCCCC5=O)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J12 compound treatment 360.0 -496.31 -0.428 655.0 -587.47 -0.4759 -0.6392 -0.9986 3616262 DAlcMix-H_000190 ONC(=O)CCCCCNC(=O)OC[C@H](NS(=O)(=O)c1ccc(Br)cc1)C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J13 compound treatment 22.0 -834.31 -0.7196 31.0 -1211.5 -0.9814 -1.2028 -0.9884 3556580 DAlcMix-H_000191 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCOC(=O)NCCCCCC(=O)NO)nn4)C(=O)N(Cc5ccc(I)cc5)c6ccccc63 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J14 compound treatment 776.0 -80.313 -0.0693 1026.0 -216.47 -0.1754 -0.173 -0.9174 3616263 DAlcMix-H_000192 CC(C)(C)OC(=O)N[C@H](COC(=O)NCCCCCC(=O)NO)C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J15 compound treatment 138.0 -718.31 -0.6195 149.0 -1093.5 -0.8858 -1.0644 -0.9847 3556583 DAlcMix-H_000193 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4cccc(I)c4)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J16 compound treatment 351.0 -505.31 -0.4358 551.0 -691.47 -0.5602 -0.7043 -0.9923 3616266 DAlcMix-H_000194 COc1cc(OC)c(CN(CC#CCOC(=O)NCCCCCC(=O)NO)S(=O)(=O)c2ccccc2[N+](=O)[O-])c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J17 compound treatment 141.0 -715.31 -0.6169 127.0 -1115.5 -0.9037 -1.0752 -0.9827 3556585 DAlcMix-H_000195 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(cc43)N5CCC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J18 compound treatment 764.0 -92.313 -0.0796 377.0 -865.47 -0.7011 -0.5521 -0.7824 3616259 DAlcMix-H_000196 CC(C)(C)OC(=O)NC(COC(=O)NCCCCCC(=O)NO)C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J19 compound treatment 822.0 -34.313 -0.0296 576.0 -666.47 -0.5399 -0.4027 -0.7447 3556588 DAlcMix-H_000197 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(cc43)N5CCC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J20 compound treatment 30.0 -826.31 -0.7127 41.0 -1201.5 -0.9733 -1.1922 -0.9883 3616270 DAlcMix-H_000198 ONC(=O)CCCCCNC(=O)OCC#CCOC(=O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J21 mock treatment 942.0 85.688 0.0739 1070.0 -172.47 -0.1397 -0.0465 -0.2944 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J22 mock treatment 758.0 -98.313 -0.0848 1253.0 10.531 0.0085 -0.0539 -0.6328 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J23 compound treatment 0.0 -856.31 -0.7385 8.0 -1234.5 -1.0001 -1.2294 -0.9889 3556589 DAlcMix-H_000199 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(Cc4cccc(I)c4)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 J24 compound treatment 489.0 -367.31 -0.3168 811.0 -431.47 -0.3495 -0.4712 -0.9988 3616228 DAlcMix-H_000200 CN(C)c1cccc(COC(=O)NCCCCCC(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K01 compound treatment 445.0 -411.31 -0.3547 1047.0 -195.47 -0.1584 -0.3628 -0.9339 3652100 DAlcMix-H_000201 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)C5CCCCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K02 compound treatment 117.0 -739.31 -0.6376 421.0 -821.47 -0.6655 -0.9214 -0.9998 3652232 DAlcMix-H_000202 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)C5CCCCC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K03 compound treatment 640.0 -216.31 -0.1866 868.0 -374.47 -0.3034 -0.3464 -0.9727 3652102 DAlcMix-H_000203 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K04 compound treatment 392.0 -464.31 -0.4005 651.0 -591.47 -0.4792 -0.622 -0.996 3652233 DAlcMix-H_000204 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K05 compound treatment 330.0 -526.31 -0.4539 1342.0 99.531 0.0806 -0.264 -0.5725 3652104 DAlcMix-H_000205 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)c3ccc4OCOc4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K06 compound treatment 174.0 -682.31 -0.5885 217.0 -1025.5 -0.8307 -1.0035 -0.9857 3652234 DAlcMix-H_000206 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccc(cc5)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K07 mock treatment 1105.0 248.69 0.2145 1341.0 98.531 0.0798 0.2081 0.9093 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K08 mock treatment 587.0 -269.31 -0.2323 1401.0 158.53 0.1284 -0.0734 -0.2767 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K09 compound treatment 151.0 -705.31 -0.6083 486.0 -756.47 -0.6128 -0.8635 -1.0 3652105 DAlcMix-H_000207 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)c3ccc(cc3)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K10 compound treatment 3.0 -853.31 -0.7359 95.0 -1147.5 -0.9296 -1.1777 -0.9933 3652235 DAlcMix-H_000208 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccc(Br)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K11 compound treatment 96.0 -760.31 -0.6557 176.0 -1066.5 -0.864 -1.0746 -0.9907 3652106 DAlcMix-H_000209 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c5ccc(cc5)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K12 compound treatment 232.0 -624.31 -0.5384 918.0 -324.47 -0.2629 -0.5666 -0.9456 3652237 DAlcMix-H_000210 ONC(=O)CCCCCNC(=O)OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5csc6ccccc56)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K13 compound treatment 275.0 -581.31 -0.5014 857.0 -385.47 -0.3123 -0.5753 -0.974 3652108 DAlcMix-H_000211 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)c3ccc(Br)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K14 compound treatment 292.0 -564.31 -0.4867 562.0 -680.47 -0.5513 -0.7339 -0.9981 3652238 DAlcMix-H_000212 CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(COC(=O)NCCCCCC(=O)NO)cc3)OC(=C2)C(=O)N4CCN(Cc5ccccc5)CC4)c6ccccc16 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K15 mock treatment 755.0 -101.31 -0.0874 1555.0 312.53 0.2532 0.1172 0.4377 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K16 mock treatment 819.0 -37.313 -0.0322 1174.0 -68.469 -0.0555 -0.062 -0.9665 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K17 compound treatment 625.0 -231.31 -0.1995 1055.0 -187.47 -0.1519 -0.2485 -0.9909 3652110 DAlcMix-H_000213 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)OCC=C)c2ccc(Br)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K18 compound treatment 91.0 -765.31 -0.6601 490.0 -752.47 -0.6096 -0.8978 -0.9992 3652239 DAlcMix-H_000214 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)C4CCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K19 compound treatment 410.0 -446.31 -0.3849 1030.0 -212.47 -0.1721 -0.3939 -0.9342 3652112 DAlcMix-H_000215 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)OCC=C)c2csc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K20 compound treatment 3.0 -853.31 -0.7359 8.0 -1234.5 -1.0001 -1.2275 -0.9886 3652241 DAlcMix-H_000216 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K21 compound treatment 203.0 -653.31 -0.5635 313.0 -929.47 -0.753 -0.9309 -0.9898 3652113 DAlcMix-H_000217 CC(=O)n1cc([C@H]2C[C@@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C2)C(=O)N3CCOCC3)c4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K22 compound treatment 0.0 -856.31 -0.7385 0.0 -1242.5 -1.0065 -1.234 -0.9884 3652243 DAlcMix-H_000218 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccc5OCOc5c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K23 mock treatment 477.0 -379.31 -0.3271 552.0 -690.47 -0.5594 -0.6268 -0.9674 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 K24 mock treatment 419.0 -437.31 -0.3772 841.0 -401.47 -0.3252 -0.4967 -0.9973 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L01 compound treatment 601.0 -255.31 -0.2202 1431.0 188.53 0.1527 -0.0477 -0.178 3556620 DAlcMix-H_000219 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@@]3(O[C@@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(I)cc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L02 compound treatment 238.0 -618.31 -0.5333 280.0 -962.47 -0.7797 -0.9284 -0.9828 3616230 DAlcMix-H_000220 ONC(=O)CCCCCNC(=O)OCc1ccccc1CCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L03 compound treatment 631.0 -225.31 -0.1943 990.0 -252.47 -0.2045 -0.282 -0.9997 3556623 DAlcMix-H_000221 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(CC=C)c4ccc(I)cc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L04 compound treatment 270.0 -586.31 -0.5057 162.0 -1080.5 -0.8753 -0.9765 -0.966 3616234 DAlcMix-H_000222 COc1cc2ccccc2cc1COC(=O)NCCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L05 compound treatment 493.0 -363.31 -0.3133 523.0 -719.47 -0.5829 -0.6337 -0.9576 3556624 DAlcMix-H_000223 COc1ccc(cc1)[Si](C)(C)[C@H](CCn2cc(CCOC(=O)NCCCCCC(=O)NO)nn2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L06 compound treatment 838.0 -18.313 -0.0158 469.0 -773.47 -0.6266 -0.4542 -0.7247 3616236 DAlcMix-H_000224 ONC(=O)CCCCCNC(=O)OCc1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L07 mock treatment 1566.0 709.69 0.6121 2125.0 882.53 0.715 0.9383 0.997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L08 mock treatment 1252.0 395.69 0.3413 1929.0 686.53 0.5562 0.6346 0.9725 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L09 compound treatment 316.0 -540.31 -0.466 646.0 -596.47 -0.4832 -0.6712 -0.9998 3556627 DAlcMix-H_000225 COc1ccc(cc1)[Si](C)(C)[C@@H](CCn2cc(CCOC(=O)NCCCCCC(=O)NO)nn2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L10 compound treatment 4.0 -852.31 -0.7351 3.0 -1239.5 -1.0041 -1.2298 -0.9882 3616239 DAlcMix-H_000226 ONC(=O)CCCCCNC(=O)OCc1ccc(Cl)c(c1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L11 compound treatment 310.0 -546.31 -0.4712 575.0 -667.47 -0.5407 -0.7155 -0.9976 3556628 DAlcMix-H_000227 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N(CCOC(=O)NCCCCCC(=O)NO)Cc2ccccc2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L12 compound treatment 983.0 126.69 0.1093 2009.0 766.53 0.621 0.5164 0.8189 3616241 DAlcMix-H_000228 ONC(=O)CCCCCNC(=O)OCCOc1ccc(Br)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L13 compound treatment 351.0 -505.31 -0.4358 1094.0 -148.47 -0.1203 -0.3932 -0.8697 3556631 DAlcMix-H_000229 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N(CCOC(=O)NCCCCCC(=O)NO)Cc2ccccc2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L14 compound treatment 702.0 -154.31 -0.1331 1507.0 264.53 0.2143 0.0574 0.2276 3616244 DAlcMix-H_000230 ONC(=O)CCCCCNC(=O)OCc1cccc(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L15 mock treatment 1090.0 233.69 0.2015 1692.0 449.53 0.3642 0.4 0.9611 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L16 mock treatment 887.0 30.688 0.0265 1904.0 661.53 0.5359 0.3977 0.7411 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L17 compound treatment 462.0 -394.31 -0.3401 673.0 -569.47 -0.4613 -0.5667 -0.9887 3556632 DAlcMix-H_000231 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N2Cc3ccccc3C[C@H]2COC(=O)NCCCCCC(=O)NO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L18 compound treatment 150.0 -706.31 -0.6092 814.0 -428.47 -0.3471 -0.6762 -0.9644 3616247 DAlcMix-H_000232 COc1cc(COC(=O)NCCCCCC(=O)NO)ccc1OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L19 compound treatment 21.0 -835.31 -0.7204 50.0 -1192.5 -0.966 -1.1925 -0.9896 3556635 DAlcMix-H_000233 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N2Cc3ccccc3C[C@H]2COC(=O)NCCCCCC(=O)NO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L20 compound treatment 40.0 -816.31 -0.704 9.0 -1233.5 -0.9992 -1.2044 -0.9853 3616249 DAlcMix-H_000234 ONC(=O)CCCCCNC(=O)OCc1ccccc1c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L21 compound treatment 132.0 -724.31 -0.6247 229.0 -1013.5 -0.821 -1.0223 -0.9909 3556636 DAlcMix-H_000235 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N2CCC[C@H]2COC(=O)NCCCCCC(=O)NO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L22 compound treatment 249.0 -607.31 -0.5238 1589.0 346.53 0.2807 -0.1719 -0.2892 3616252 DAlcMix-H_000236 Cc1c(COC(=O)NCCCCCC(=O)NO)cccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L23 mock treatment 544.0 -312.31 -0.2694 926.0 -316.47 -0.2564 -0.3717 -0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 L24 mock treatment 477.0 -379.31 -0.3271 1237.0 -5.4688 -0.0044 -0.2345 -0.7166 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M01 compound treatment 620.0 -236.31 -0.2038 1071.0 -171.47 -0.1389 -0.2423 -0.9825 3652114 DAlcMix-H_000237 CC(=O)n1cc([C@H]2C[C@@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C2)C(=O)OCC=C)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M02 compound treatment 112.0 -744.31 -0.6419 220.0 -1022.5 -0.8283 -1.0396 -0.9921 3652245 DAlcMix-H_000238 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccc(cc4)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M03 compound treatment 834.0 -22.313 -0.0192 1455.0 212.53 0.1722 0.1081 0.6242 3652115 DAlcMix-H_000239 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)OCC=C)c2coc3ccccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M04 compound treatment 797.0 -59.313 -0.0512 1235.0 -7.4688 -0.0061 -0.0405 -0.7853 3652246 DAlcMix-H_000240 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccc(Br)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M05 compound treatment 1015.0 158.69 0.1369 1797.0 554.53 0.4492 0.4144 0.8825 3652117 DAlcMix-H_000241 CCO[C@@H]1OC(=C[C@H](C)[C@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M06 compound treatment 197.0 -659.31 -0.5686 269.0 -973.47 -0.7886 -0.9597 -0.9871 3652248 DAlcMix-H_000242 CC(=O)n1cc([C@H]2C[C@@H](OCCCCOC(=O)NCCCCCC(=O)NO)OC(=C2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M07 compound treatment 948.0 91.688 0.0791 1354.0 111.53 0.0904 0.1198 0.9978 3652119 DAlcMix-H_000243 CCO[C@@H]1OC(=C[C@H](C)[C@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M08 compound treatment 371.0 -485.31 -0.4186 659.0 -583.47 -0.4727 -0.6302 -0.9982 3652249 DAlcMix-H_000244 ONC(=O)CCCCCNC(=O)OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4coc5ccccc5c4=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M09 mock treatment 1187.0 330.69 0.2852 2281.0 1038.5 0.8413 0.7966 0.8967 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M10 mock treatment 919.0 62.688 0.0541 1971.0 728.53 0.5902 0.4556 0.7687 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M11 compound treatment 567.0 -289.31 -0.2495 1046.0 -196.47 -0.1592 -0.289 -0.9764 3652121 DAlcMix-H_000245 CCO[C@@H]1OC(=C[C@H](C)[C@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M12 compound treatment 325.0 -531.31 -0.4582 1338.0 95.531 0.0774 -0.2693 -0.5795 3652250 DAlcMix-H_000246 CCO[C@@H]1OC(=C[C@H](C)[C@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M13 mock treatment 1282.0 425.69 0.3671 2108.0 865.53 0.7012 0.7554 0.9544 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M14 mock treatment 652.0 -204.31 -0.1762 1124.0 -118.47 -0.096 -0.1925 -0.9592 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M15 compound treatment 582.0 -274.31 -0.2366 1446.0 203.53 0.1649 -0.0507 -0.1758 3652123 DAlcMix-H_000247 CCO[C@@H]1OC(=C[C@H](C2CC2)[C@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M16 compound treatment 307.0 -549.31 -0.4738 1070.0 -172.47 -0.1397 -0.4338 -0.8782 3652252 DAlcMix-H_000248 CCO[C@@H]1OC(=C[C@H](C2CC2)[C@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M17 compound treatment 712.0 -144.31 -0.1245 1329.0 86.531 0.0701 -0.0384 -0.2691 3652125 DAlcMix-H_000249 CCO[C@@H]1OC(=C[C@H](C2CC2)[C@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M18 compound treatment 361.0 -495.31 -0.4272 1016.0 -226.47 -0.1835 -0.4318 -0.9288 3652254 DAlcMix-H_000250 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccccc2)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M19 compound treatment 700.0 -156.31 -0.1348 1605.0 362.53 0.2937 0.1123 0.3476 3652127 DAlcMix-H_000251 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)C2CCCCC2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M20 compound treatment 309.0 -547.31 -0.472 13.0 -1229.5 -0.996 -1.0381 -0.9418 3652256 DAlcMix-H_000252 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc3OCOc3c2)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M21 compound treatment 137.0 -719.31 -0.6204 362.0 -880.47 -0.7133 -0.943 -0.9976 3652129 DAlcMix-H_000253 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)C2CCCCC2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M22 compound treatment 0.0 -856.31 -0.7385 4.0 -1238.5 -1.0033 -1.2317 -0.9886 3652258 DAlcMix-H_000254 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M23 compound treatment 225.0 -631.31 -0.5445 620.0 -622.47 -0.5043 -0.7416 -0.9993 3652131 DAlcMix-H_000255 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccccc2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 M24 compound treatment 298.0 -558.31 -0.4815 328.0 -914.47 -0.7408 -0.8643 -0.9782 3652260 DAlcMix-H_000256 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N01 compound treatment 106.0 -750.31 -0.6471 26.0 -1216.5 -0.9855 -1.1544 -0.9792 3556639 DAlcMix-H_000257 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N2CCC[C@H]2COC(=O)NCCCCCC(=O)NO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N02 compound treatment 1.0 -855.31 -0.7377 0.0 -1242.5 -1.0065 -1.2333 -0.9883 3616219 DAlcMix-H_000258 COc1c(COC(=O)NCCCCCC(=O)NO)ccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N03 compound treatment 240.0 -616.31 -0.5315 174.0 -1068.5 -0.8656 -0.9879 -0.9726 3556640 DAlcMix-H_000259 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCOC(=O)NCCCCCC(=O)NO)C(=O)N(C)c4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N04 compound treatment 934.0 77.688 0.067 411.0 -831.47 -0.6736 -0.4289 -0.6336 3616222 DAlcMix-H_000260 ONC(=O)CCCCCNC(=O)OCc1ccc(Cl)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N05 compound treatment 752.0 -104.31 -0.09 538.0 -704.47 -0.5707 -0.4672 -0.8086 3556643 DAlcMix-H_000261 ONC(=O)CCCCCNC(=O)OCc1ccc(CN2C[C@H](OC(=O)CC/C=C/CCC2=O)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N06 compound treatment 727.0 -129.31 -0.1115 857.0 -385.47 -0.3123 -0.2997 -0.9037 3616225 DAlcMix-H_000262 ONC(=O)CCCCCNC(=O)OCc1ccc2OCOc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N07 compound treatment 479.0 -377.31 -0.3254 426.0 -816.47 -0.6614 -0.6978 -0.9466 3556646 DAlcMix-H_000263 ONC(=O)CCCCCNC(=O)OCc1ccc(CN2[C@@H]3CCCC[C@H]3OC(=O)CC/C=C/CCC2=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N08 compound treatment 3.0 -853.31 -0.7359 1.0 -1241.5 -1.0057 -1.2316 -0.9882 199 DAlcMix-H_000264 C[C@H](/C=C(\C)/C=C/C(=O)NO)C(=O)c1ccc(cc1)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N09 mock treatment 908.0 51.688 0.0446 635.0 -607.47 -0.4921 -0.3165 -0.6404 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N10 mock treatment 804.0 -52.313 -0.0451 985.0 -257.47 -0.2086 -0.1794 -0.8406 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N11 compound treatment 912.0 55.688 0.048 1342.0 99.531 0.0806 0.091 0.9694 3556649 DAlcMix-H_000265 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N12 compound treatment 56.0 -800.31 -0.6902 4.0 -1238.5 -1.0033 -1.1975 -0.9833 468 DAlcMix-H_000266 ONC(=O)CCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N13 mock treatment 542.0 -314.31 -0.2711 637.0 -605.47 -0.4905 -0.5385 -0.9609 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N14 mock treatment 1163.0 306.69 0.2645 1650.0 407.53 0.3301 0.4205 0.994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N15 compound treatment 535.0 -321.31 -0.2771 892.0 -350.47 -0.2839 -0.3967 -0.9999 3556653 DAlcMix-H_000267 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N16 compound treatment 0.0 -856.31 -0.7385 14.0 -1228.5 -0.9952 -1.2259 -0.9892 3068804 DAlcMix-H_000268 C[C@@H]1NC(=O)C2CCCN2C(=O)[C@H](CCCCCC(=O)[C@@H]3CO3)NC(=O)[C@H](C)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N17 compound treatment 946.0 89.688 0.0774 1160.0 -82.469 -0.0668 0.0075 0.0729 3556655 DAlcMix-H_000269 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc3ccccc3)c4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N18 compound treatment 1084.0 227.69 0.1964 1192.0 -50.469 -0.0409 0.1099 0.5481 469 DAlcMix-H_000270 CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N19 compound treatment 494.0 -362.31 -0.3125 607.0 -635.47 -0.5148 -0.585 -0.9714 3556657 DAlcMix-H_000271 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N20 compound treatment 105.0 -751.31 -0.648 58.0 -1184.5 -0.9596 -1.1367 -0.9817 2027357 DAlcMix-H_000272 OCc1ccc(cc1)[C@@H]2C[C@H](CSc3nc(c(o3)c4ccccc4)c5ccccc5)O[C@@H](O2)c6ccc(NC(=O)CCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N21 compound treatment 713.0 -143.31 -0.1236 889.0 -353.47 -0.2863 -0.2899 -0.9294 3556659 DAlcMix-H_000273 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N22 compound treatment 0.0 -856.31 -0.7385 2.0 -1240.5 -1.0049 -1.2328 -0.9885 536 DAlcMix-H_000274 ONC(=O)CCCCCN1C(=O)c2cccc3cccc(C1=O)c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N23 compound treatment 356.0 -500.31 -0.4315 480.0 -762.47 -0.6177 -0.7419 -0.9846 3556661 DAlcMix-H_000275 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 N24 compound treatment 553.0 -303.31 -0.2616 767.0 -475.47 -0.3852 -0.4573 -0.9822 471 DAlcMix-H_000276 CCCC(CCC)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O01 compound treatment 60.0 -796.31 -0.6868 29.0 -1213.5 -0.983 -1.1808 -0.9846 3652133 DAlcMix-H_000277 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccccc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O02 compound treatment 525.0 -331.31 -0.2857 481.0 -761.47 -0.6169 -0.6382 -0.9388 3652262 DAlcMix-H_000278 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O03 compound treatment 695.0 -161.31 -0.1391 692.0 -550.47 -0.4459 -0.4137 -0.8856 3652135 DAlcMix-H_000279 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc3OCOc3c2)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O04 compound treatment 446.0 -410.31 -0.3539 481.0 -761.47 -0.6169 -0.6864 -0.9652 3652264 DAlcMix-H_000280 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O05 compound treatment 166.0 -690.31 -0.5954 225.0 -1017.5 -0.8243 -1.0038 -0.9872 3652137 DAlcMix-H_000281 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O06 compound treatment 393.0 -463.31 -0.3996 403.0 -839.47 -0.6801 -0.7634 -0.9679 3652266 DAlcMix-H_000282 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O07 compound treatment 263.0 -593.31 -0.5117 351.0 -891.47 -0.7222 -0.8725 -0.9858 3652139 DAlcMix-H_000283 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O08 compound treatment 15.0 -841.31 -0.7256 62.0 -1180.5 -0.9563 -1.1893 -0.9907 3652268 DAlcMix-H_000284 CCO[C@H]1OC(=C[C@@H](C)[C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C(=O)N2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O09 compound treatment 648.0 -208.31 -0.1797 874.0 -368.47 -0.2985 -0.3381 -0.9705 3652141 DAlcMix-H_000285 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(cc2)C(F)(F)F)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O10 compound treatment 293.0 -563.31 -0.4858 220.0 -1022.5 -0.8283 -0.9292 -0.9677 3652269 DAlcMix-H_000286 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C(C)(C)C)C(=O)N2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O11 mock treatment 772.0 -84.313 -0.0727 1396.0 153.53 0.1244 0.0365 0.2536 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O12 mock treatment 496.0 -360.31 -0.3108 1497.0 254.53 0.2062 -0.0739 -0.1982 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O13 compound treatment 416.0 -440.31 -0.3798 954.0 -288.47 -0.2337 -0.4338 -0.9728 3652143 DAlcMix-H_000287 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(C#C)cc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O14 compound treatment 439.0 -417.31 -0.3599 610.0 -632.47 -0.5124 -0.6168 -0.9851 3652271 DAlcMix-H_000288 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)C2CCCCC2)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O15 compound treatment 42.0 -814.31 -0.7023 198.0 -1044.5 -0.8461 -1.0949 -0.9957 3652145 DAlcMix-H_000289 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O16 compound treatment 198.0 -658.31 -0.5678 456.0 -786.47 -0.6371 -0.852 -0.9983 3652273 DAlcMix-H_000290 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccccc2)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O17 compound treatment 133.0 -723.31 -0.6238 279.0 -963.47 -0.7805 -0.993 -0.9938 3652147 DAlcMix-H_000291 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)N3CCN(C)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O18 compound treatment 131.0 -725.31 -0.6256 479.0 -763.47 -0.6185 -0.8797 -1.0 3652274 DAlcMix-H_000292 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc3OCOc3c2)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O19 compound treatment 52.0 -804.31 -0.6937 153.0 -1089.5 -0.8826 -1.1146 -0.9929 3652149 DAlcMix-H_000293 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O20 compound treatment 33.0 -823.31 -0.7101 55.0 -1187.5 -0.962 -1.1823 -0.9888 3652275 DAlcMix-H_000294 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O21 compound treatment 104.0 -752.31 -0.6488 319.0 -923.47 -0.7481 -0.9878 -0.9975 3652151 DAlcMix-H_000295 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2ccc(Br)cc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O22 compound treatment 203.0 -653.31 -0.5635 386.0 -856.47 -0.6938 -0.889 -0.9947 3652276 DAlcMix-H_000296 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O23 compound treatment 98.0 -758.31 -0.654 175.0 -1067.5 -0.8648 -1.0739 -0.9905 3652153 DAlcMix-H_000297 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCOC(=O)NCCCCCC(=O)NO)c2csc3ccccc23)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 O24 compound treatment 153.0 -703.31 -0.6066 275.0 -967.47 -0.7838 -0.9831 -0.992 3652277 DAlcMix-H_000298 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCOC(=O)NCCCCCC(=O)NO)c2coc3ccccc3c2=O)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P01 compound treatment 736.0 -120.31 -0.1038 1137.0 -105.47 -0.0854 -0.1338 -0.9953 3556663 DAlcMix-H_000299 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P02 compound treatment 1125.0 268.69 0.2317 1116.0 -126.47 -0.1025 0.0914 0.3608 483 DAlcMix-H_000300 CN(C)c1ccc(cc1)C(=O)NCCCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P03 compound treatment 1129.0 272.69 0.2352 1152.0 -90.469 -0.0733 0.1145 0.4647 3556664 DAlcMix-H_000301 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)C(=O)NCc4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P04 compound treatment 950.0 93.688 0.0808 553.0 -689.47 -0.5585 -0.3378 -0.5986 478 DAlcMix-H_000302 ONC(=O)/C=C/C#Cc1cccc(NS(=O)(=O)c2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P05 compound treatment 1083.0 226.69 0.1955 1549.0 306.53 0.2483 0.3138 0.993 3556666 DAlcMix-H_000303 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@H](Cc3ccccc3)C(=O)NCc4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P06 compound treatment 35.0 -821.31 -0.7083 76.0 -1166.5 -0.945 -1.1691 -0.9899 529 DAlcMix-H_000304 Nc1ccccc1NC(=O)c2ccc(CNC(=O)OCc3cccnc3)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P07 compound treatment 921.0 64.688 0.0558 1428.0 185.53 0.1503 0.1457 0.909 3556668 DAlcMix-H_000305 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](COC(=O)NCCCCCC(=O)NO)NC(=O)N[C@@H](Cc3ccccc3)C(=O)NCc4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P08 compound treatment 30.0 -826.31 -0.7127 101.0 -1141.5 -0.9247 -1.1578 -0.9917 506 DAlcMix-H_000306 CCC(C)C1NC(=O)[C@@H](NC(=O)[C@H](CCCCCC(=O)CC)NC(=O)[C@H]2CCCCN2C1=O)c3cn(OC)c4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P09 compound treatment 626.0 -230.31 -0.1986 824.0 -418.47 -0.339 -0.3802 -0.9676 3556669 DAlcMix-H_000307 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)[C@H](CC=C)Cc2cccc(Br)c2)[C@H](OC(=O)[C@H](CC=C)Cc3ccccc3)[C@H]1OC(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P10 compound treatment 229.0 -627.31 -0.541 319.0 -923.47 -0.7481 -0.9116 -0.9873 3623005 DAlcMix-H_000308 CN(C)Cc1c(oc2ccccc12)C(=O)NCCOc3ccc(cc3)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P11 mock treatment 849.0 -7.3125 -0.0063 1405.0 162.53 0.1317 0.0886 0.6725 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P12 mock treatment 737.0 -119.31 -0.1029 1632.0 389.53 0.3156 0.1504 0.453 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P13 compound treatment 39.0 -817.31 -0.7049 75.0 -1167.5 -0.9458 -1.1672 -0.9895 3556672 DAlcMix-H_000309 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@H]2OC(=O)[C@@H](Cc3cccc(Br)c3)C/C=C/C[C@H](Cc4ccccc4)C(=O)O[C@@H]2[C@H]1OC(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P14 compound treatment 2.0 -854.31 -0.7368 3.0 -1239.5 -1.0041 -1.231 -0.9884 3623002 DAlcMix-H_000310 Cc1[nH]c2ccccc2c1CCNCc3ccc(/C=C/C(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P15 compound treatment 14.0 -842.31 -0.7265 20.0 -1222.5 -0.9903 -1.214 -0.9884 3556674 DAlcMix-H_000311 CO[C@H]1O[C@H](COC(=O)NCCCCCC(=O)NO)[C@@H](OC(=O)Nc2ccccc2)[C@@H]3OC(=O)[C@H](Cc4cccc(Br)c4)C/C=C/C[C@@H](Cc5cccc(Br)c5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P16 compound treatment 343.0 -513.31 -0.4427 488.0 -754.47 -0.6112 -0.7452 -0.9875 3622998 DAlcMix-H_000312 OCCN(CCc1c[nH]c2ccccc12)Cc3ccc(/C=C/C(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P17 compound treatment 525.0 -331.31 -0.2857 431.0 -811.47 -0.6574 -0.6669 -0.9304 3556677 DAlcMix-H_000313 CCOC(=O)[C@H]1C/C=C/C[C@H](C(=O)OCC)C(=O)O[C@H]2[C@H](OC(=O)Nc3ccccc3)[C@@H](COC(=O)NCCCCCC(=O)NO)O[C@H](OC)[C@@H]2OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P18 compound treatment 254.0 -602.31 -0.5195 246.0 -996.47 -0.8073 -0.9381 -0.9773 3622988 DAlcMix-H_000314 ONC(=O)/C=C/c1cccc(c1)S(=O)(=O)Nc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P19 compound treatment 513.0 -343.31 -0.2961 957.0 -285.47 -0.2313 -0.3729 -0.9925 3556680 DAlcMix-H_000315 ONC(=O)CCCCCNC(=O)OCC[C@@H]1OC(=O)C2(CCCC2)N3CC4=CCCC=C[C@H]4[C@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P20 compound treatment 35.0 -821.31 -0.7083 68.0 -1174.5 -0.9515 -1.1737 -0.9894 479 DAlcMix-H_000316 ONC(=O)CCCCCCC(=O)Nc1cccnc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P21 compound treatment 320.0 -536.31 -0.4625 838.0 -404.47 -0.3277 -0.5588 -0.9857 3556682 DAlcMix-H_000317 ONC(=O)CCCCCNC(=O)OCC[C@@H]1OC(=O)C2(CCCC2)N3CC(=C)[C@@H](/C=C/C=C)[C@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P22 compound treatment 1.0 -855.31 -0.7377 9.0 -1233.5 -0.9992 -1.2282 -0.9888 3622981 DAlcMix-H_000318 Nc1ccccc1NC(=O)c2ccc(CNc3nccc(n3)c4cccnc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P23 compound treatment 72.0 -784.31 -0.6764 312.0 -930.47 -0.7538 -1.0113 -0.9985 3616214 DAlcMix-H_000319 CC[C@@H](OC(=O)NCCCCCC(=O)NO)c1cc(C=C)nc(c1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2447 P24 compound treatment 105.0 -751.31 -0.648 158.0 -1084.5 -0.8785 -1.0794 -0.9888 525 DAlcMix-H_000320 CC(=O)Nc1ccc(cc1)C(=O)Nc2ccccc2N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A01 mock treatment 913.0 -362.65 -0.3128 2255.0 324.28 0.2627 -0.0354 -0.0867 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A02 mock treatment 205.0 -1070.7 -0.9234 2185.0 254.28 0.206 -0.5073 -0.5362 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A03 compound treatment 553.0 -722.65 -0.6233 96.0 -1834.7 -1.4863 -1.4917 -0.9255 1164875 BSPBio_000001 Nc1nc2[nH]nnc2c(=O)[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A04 compound treatment 7.0 -1268.7 -1.0942 2287.0 356.28 0.2886 -0.5696 -0.5034 683 BSPBio_000002 Cc1ncc([N+](=O)[O-])n1CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A05 compound treatment 3.0 -1272.7 -1.0976 33.0 -1897.7 -1.5374 -1.8632 -0.9864 923 BSPBio_000003 NC(=O)NC1NC(=O)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A06 compound treatment 713.0 -562.65 -0.4853 2178.0 247.28 0.2003 -0.2015 -0.3838 1449 BSPBio_000004 CN1[C@@H](CCC1=O)c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A07 compound treatment 1193.0 -82.651 -0.0713 2190.0 259.28 0.21 0.0981 0.4424 692 BSPBio_000005 CC(=O)Nc1nnc(s1)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A08 compound treatment 606.0 -669.65 -0.5775 427.0 -1503.7 -1.2182 -1.2698 -0.9419 1402 BSPBio_000006 CC[N+](C)(C)c1cccc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A09 compound treatment 2276.0 1000.3 0.8628 2126.0 195.28 0.1582 0.7219 0.823 1714 BSPBio_000007 CN(C)C(=N)NC(=N)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A10 compound treatment 572.0 -703.65 -0.6069 2133.0 202.28 0.1639 -0.3132 -0.4983 1029858 BSPBio_000008 NC(=N)NC(=N)N1CCOCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A11 compound treatment 1360.0 84.349 0.0727 13.0 -1917.7 -1.5536 -1.0471 -0.6733 3221455 BSPBio_000009 COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)CCC(=O)OCCCCCOC(=O)CC[N+]4(C)CCc5cc(OC)c(OC)cc5C4Cc6ccc(OC)c(OC)c6)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A12 compound treatment 8.0 -1267.7 -1.0933 522.0 -1408.7 -1.1412 -1.58 -0.9998 678 BSPBio_000010 NCC(CC(=O)O)c1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A13 compound treatment 210.0 -1065.7 -0.9191 1980.0 49.279 0.0399 -0.6217 -0.6758 3064163 BSPBio_000011 CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A14 compound treatment 626.0 -649.65 -0.5603 1958.0 27.279 0.0221 -0.3806 -0.6787 839 BSPBio_000012 Nc1nc2n(COCCO)cnc2c(=O)[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A15 compound treatment 1313.0 37.349 0.0322 2857.0 926.28 0.7504 0.5534 0.7368 1000042 BSPBio_000013 NC(=N)NC(=O)c1nc(Cl)c(N)nc1N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A16 compound treatment 1043.0 -232.65 -0.2007 67.0 -1863.7 -1.5098 -1.2095 -0.7941 35 BSPBio_000014 CC1=Nc2ccc(Cl)cc2S(=O)(=O)N1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A17 compound treatment 1120.0 -155.65 -0.1342 2834.0 903.28 0.7318 0.4225 0.5679 807 BSPBio_000015 CCCc1ncc(C[n+]2ccccc2C)c(N)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A18 compound treatment 802.0 -473.65 -0.4085 1706.0 -224.72 -0.182 -0.4176 -0.9337 1090166 BSPBio_000016 CN(C)c1c(C)n(C)n(c2ccccc2)c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A19 compound treatment 1826.0 550.35 0.4747 1009.0 -921.72 -0.7467 -0.1924 -0.2174 931 BSPBio_000017 NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A20 compound treatment 4.0 -1271.7 -1.0967 1491.0 -439.72 -0.3562 -1.0274 -0.891 3616486 BSPBio_000018 C[C@@H]1CC[C@@]2(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)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A21 compound treatment 778.0 -497.65 -0.4292 939.0 -991.72 -0.8034 -0.8716 -0.9569 1241 BSPBio_000019 NC(=N)NS(=O)(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A22 compound treatment 7.0 -1268.7 -1.0942 2927.0 996.28 0.8071 -0.203 -0.1493 1428 BSPBio_000020 CC(C)NCC(O)COc1cccc2[nH]ccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A23 mock treatment 599.0 -676.65 -0.5836 1240.0 -690.72 -0.5596 -0.8083 -0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 A24 mock treatment 299.0 -976.65 -0.8423 983.0 -947.72 -0.7678 -1.1385 -0.9989 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B01 mock treatment 1305.0 29.349 0.0253 1177.0 -753.72 -0.6106 -0.4139 -0.6772 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B02 mock treatment 1372.0 96.349 0.0831 405.0 -1525.7 -1.236 -0.8152 -0.6581 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B03 compound treatment 1866.0 590.35 0.5092 1311.0 -619.72 -0.502 0.005 0.007 735 BSPBio_000021 NNC(=O)c1ccncc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B04 compound treatment 2.0 -1273.7 -1.0985 788.0 -1142.7 -0.9257 -1.4313 -0.9964 1425 BSPBio_000022 CC(N)COc1c(C)cccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B05 compound treatment 2200.0 924.35 0.7972 1146.0 -784.72 -0.6357 0.1142 0.112 1008060 BSPBio_000023 C1CCc2nnnn2CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B06 compound treatment 1141.0 -134.65 -0.1161 479.0 -1451.7 -1.1761 -0.9137 -0.7732 3101 BSPBio_000024 Cc1c(oc2c(cccc2c1=O)C(=O)OCCN3CCCCC3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B07 compound treatment 1183.0 -92.651 -0.0799 1510.0 -420.72 -0.3408 -0.2975 -0.8498 1480 BSPBio_000025 Clc1ccc2oc(=O)[nH]c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B08 compound treatment 637.0 -638.65 -0.5508 618.0 -1312.7 -1.0635 -1.1415 -0.9531 769 BSPBio_000026 CCCCOc1ccc(CC(=O)NO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B09 compound treatment 1351.0 75.349 0.065 410.0 -1520.7 -1.232 -0.8252 -0.6689 1054660 BSPBio_000027 Cc1ncc([N+](=O)[O-])n1CC(O)CCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B10 compound treatment 955.0 -320.65 -0.2765 817.0 -1113.7 -0.9022 -0.8335 -0.8833 1469 BSPBio_000028 CCC1(CCC(=O)NC1=O)c2ccc(N)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B11 compound treatment 1593.0 317.35 0.2737 777.0 -1153.7 -0.9346 -0.4674 -0.4799 869 BSPBio_000029 CCC1(C)CC(=O)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B12 compound treatment 981.0 -294.65 -0.2541 1006.0 -924.72 -0.7491 -0.7094 -0.8968 858 BSPBio_000030 OCC(O)CN1CCN(CC1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B13 compound treatment 986.0 -289.65 -0.2498 892.0 -1038.7 -0.8415 -0.7717 -0.8791 997 BSPBio_000031 NCc1ccc(cc1)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B14 compound treatment 344.0 -931.65 -0.8035 317.0 -1613.7 -1.3073 -1.4926 -0.9727 3173239 BSPBio_000032 CC(N/C(=N/C#N)/Nc1ccncc1)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B15 compound treatment 672.0 -603.65 -0.5206 201.0 -1729.7 -1.4013 -1.359 -0.9091 399 BSPBio_000033 Nc1nc2ccc(OC(F)(F)F)cc2s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B16 compound treatment 164.0 -1111.7 -0.9588 11.0 -1919.7 -1.5552 -1.7776 -0.973 1185085 BSPBio_000034 CCCSc1ccc2[nH]c(NC(=O)OC)nc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B17 compound treatment 714.0 -561.65 -0.4844 67.0 -1863.7 -1.5098 -1.4101 -0.8893 3173466 BSPBio_000035 [O-][N+](=O)c1ccc(/C=N/N2CC(=O)NC2=O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B18 compound treatment 628.0 -647.65 -0.5586 730.0 -1200.7 -0.9727 -1.0828 -0.9653 3616606 BSPBio_000036 Clc1cccc(Cl)c1NC2=NCCN2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B19 compound treatment 240.0 -1035.7 -0.8932 89.0 -1841.7 -1.492 -1.6866 -0.9699 3616534 BSPBio_000037 N/N=C/1\N=NC=C2C=CC=CC12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B20 compound treatment 437.0 -838.65 -0.7233 443.0 -1487.7 -1.2052 -1.3637 -0.9702 1101055 BSPBio_000038 CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B21 compound treatment 570.0 -705.65 -0.6086 139.0 -1791.7 -1.4515 -1.4567 -0.9255 3273 BSPBio_000039 NNCCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B22 compound treatment 124.0 -1151.7 -0.9933 292.0 -1638.7 -1.3276 -1.6411 -0.9898 690 BSPBio_000040 CC(C)NCC(O)COc1ccccc1CC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B23 mock treatment 699.0 -576.65 -0.4973 146.0 -1784.7 -1.4458 -1.374 -0.8987 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 B24 mock treatment 0.0 -1275.7 -1.1002 236.0 -1694.7 -1.3729 -1.7488 -0.994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C01 mock treatment 1631.0 355.35 0.3065 2887.0 956.28 0.7747 0.7645 0.9176 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C02 mock treatment 1761.0 485.35 0.4186 2685.0 754.28 0.6111 0.7281 0.983 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C03 compound treatment 1442.0 166.35 0.1435 3130.0 1199.3 0.9716 0.7884 0.8028 2898 BSPBio_000041 Cc1cc2CCCS(=O)(=O)c2cc1S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C04 compound treatment 935.0 -340.65 -0.2938 2544.0 613.28 0.4968 0.1436 0.2487 715 BSPBio_000042 COc1c2ccoc2c(OC)c3oc(C)cc(=O)c13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C05 compound treatment 2155.0 879.35 0.7584 3056.0 1125.3 0.9116 1.1809 0.9958 3188932 BSPBio_000043 CCCCNc1ccc(cc1)C(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C06 compound treatment 1748.0 472.35 0.4074 2457.0 526.28 0.4263 0.5895 0.9997 3616489 BSPBio_000044 CN(C)C/C=C(\c1ccc(Br)cc1)/c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C07 compound treatment 2320.0 1044.3 0.9007 2935.0 1004.3 0.8136 1.2122 0.9987 1131 BSPBio_000045 NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C08 compound treatment 754.0 -521.65 -0.4499 766.0 -1164.7 -0.9436 -0.9853 -0.9426 1451360 BSPBio_000046 OC(C1CCNCC1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C09 compound treatment 1891.0 615.35 0.5307 2500.0 569.28 0.4612 0.7014 0.9976 878 BSPBio_000047 CC(=O)NS(=O)(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C10 compound treatment 1167.0 -108.65 -0.0937 1770.0 -160.72 -0.1302 -0.1583 -0.987 1865021 BSPBio_000048 Cn1cnc([N+](=O)[O-])c1Sc2ncnc3[nH]cnc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C11 compound treatment 1912.0 636.35 0.5488 2562.0 631.28 0.5114 0.7497 0.9994 1507 BSPBio_000049 CC(N)CCCC(C)(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C12 compound treatment 841.0 -434.65 -0.3749 1345.0 -585.72 -0.4745 -0.6006 -0.9932 3069004 BSPBio_000050 C[C@@]12CC[C@H]3[C@@H](CCC4=CCCC[C@H]34)[C@@H]2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C13 compound treatment 1550.0 274.35 0.2366 2648.0 717.28 0.5811 0.5782 0.9216 1175 BSPBio_000051 Nc1ccc(cc1)S(=O)(=O)Nc2nccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C14 compound treatment 444.0 -831.65 -0.7173 838.0 -1092.7 -0.8852 -1.1331 -0.9946 3060090 BSPBio_000052 NC(=N)N/N=C/c1c(Cl)cccc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C15 compound treatment 1361.0 85.349 0.0736 1985.0 54.279 0.044 0.0831 0.9697 1079 BSPBio_000053 N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C16 compound treatment 0.0 -1275.7 -1.1002 8.0 -1922.7 -1.5576 -1.8794 -0.9855 2038 BSPBio_000054 CCN(CC)C(=S)SSC(=S)N(CC)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C17 compound treatment 1486.0 210.35 0.1814 1665.0 -265.72 -0.2153 -0.0239 -0.085 2651 BSPBio_000055 OC[C@H]1O[C@H](C[C@@H]1O)n2cc(I)c(=O)[nH]c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C18 compound treatment 925.0 -350.65 -0.3024 1340.0 -590.72 -0.4786 -0.5522 -0.9755 2060486 BSPBio_000056 CC(=O)Oc1ccccc1C(=O)Oc2ccccc2C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C19 compound treatment 1177.0 -98.651 -0.0851 1754.0 -176.72 -0.1432 -0.1614 -0.9691 861 BSPBio_000057 C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C20 compound treatment 0.0 -1275.7 -1.1002 70.0 -1860.7 -1.5074 -1.8438 -0.988 1434 BSPBio_000058 CN1CCN2C(C1)c3ccccc3Cc4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C21 compound treatment 1257.0 -18.651 -0.0161 1633.0 -297.72 -0.2412 -0.1819 -0.7526 3616456 BSPBio_000059 Nc1cc(nc(=N)n1O)N2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C22 compound treatment 122.0 -1153.7 -0.995 132.0 -1798.7 -1.4572 -1.7339 -0.9827 440 BSPBio_000060 COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3cccs3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C23 mock treatment 1055.0 -220.65 -0.1903 1364.0 -566.72 -0.4591 -0.4592 -0.924 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 C24 mock treatment 465.0 -810.65 -0.6992 849.0 -1081.7 -0.8763 -1.114 -0.9937 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D01 mock treatment 2030.0 754.35 0.6506 3414.0 1483.3 1.2016 1.3097 0.9585 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D02 mock treatment 1719.0 443.35 0.3824 2890.0 959.28 0.7771 0.8199 0.9466 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D03 compound treatment 2416.0 1140.3 0.9835 3395.0 1464.3 1.1862 1.5342 0.9957 1262 BSPBio_000061 NC[C@H]1CC[C@@H](CC1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D04 compound treatment 1659.0 383.35 0.3306 2649.0 718.28 0.5819 0.6452 0.9641 1282 BSPBio_000062 NS(=O)(=O)c1cc2c(N=CNS2(=O)=O)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D05 compound treatment 2438.0 1162.3 1.0025 3836.0 1905.3 1.5435 1.8003 0.9782 718 BSPBio_000063 Cn1c(=O)n(C)c2ncn(CCO)c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D06 compound treatment 1640.0 364.35 0.3142 2334.0 403.28 0.3267 0.4532 0.9998 3036 BSPBio_000064 OC(CCCN1CCCCC1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D07 compound treatment 2334.0 1058.3 0.9128 2963.0 1032.3 0.8363 1.2368 0.999 3616541 BSPBio_000065 N[C@H]1C[C@@H]1c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D08 compound treatment 1560.0 284.35 0.2452 2496.0 565.28 0.4579 0.4972 0.9572 1000286 BSPBio_000066 C[C@@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D09 compound treatment 1273.0 -2.6508 -0.0023 2313.0 382.28 0.3097 0.2174 0.7019 3256 BSPBio_000067 CCN(CCCc1ccccc1)CCCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D10 compound treatment 178.0 -1097.7 -0.9467 458.0 -1472.7 -1.1931 -1.513 -0.9934 809 BSPBio_000068 CNCCC=C1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D11 compound treatment 149.0 -1126.7 -0.9717 2767.0 836.28 0.6775 -0.208 -0.1756 3069075 BSPBio_000069 OC(=O)COC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D12 compound treatment 877.0 -398.65 -0.3438 2923.0 992.28 0.8039 0.3253 0.3721 112 BSPBio_000070 OC(=O)c1cccnc1Nc2cccc(c2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D13 compound treatment 2123.0 847.35 0.7308 3236.0 1305.3 1.0574 1.2645 0.9837 780 BSPBio_000071 CC(C)NNC(=O)c1ccncc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D14 compound treatment 474.0 -801.65 -0.6914 839.0 -1091.7 -0.8844 -1.1143 -0.9926 1000009 BSPBio_000072 C/C(=C\C=C\C(=C/C(=O)O)\C)/C=C/C1=C(C)CCCC1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D15 compound treatment 1561.0 285.35 0.2461 2654.0 723.28 0.5859 0.5883 0.9258 1256 BSPBio_000073 Cc1cc(NS(=O)(=O)c2ccc(N)cc2)no1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D16 compound treatment 423.0 -852.65 -0.7354 740.0 -1190.7 -0.9646 -1.2021 -0.991 104 BSPBio_000074 C/C(=C\C=C\C(=C\C(=O)O)\C)/C=C/C1=C(C)CCCC1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D17 compound treatment 1064.0 -211.65 -0.1825 1648.0 -282.72 -0.229 -0.291 -0.9937 741 BSPBio_000075 Cc1ccccc1OCC(O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D18 compound treatment 1176.0 -99.651 -0.0859 1657.0 -273.72 -0.2217 -0.2176 -0.9149 746 BSPBio_000076 C(N(Cc1ccccc1)c2ccccc2)C3=NCCN3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D19 compound treatment 982.0 -293.65 -0.2533 1610.0 -320.72 -0.2598 -0.3628 -0.9999 1018627 BSPBio_000077 NC(=N)NC(=N)NCCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D20 compound treatment 781.0 -494.65 -0.4266 1489.0 -441.72 -0.3578 -0.5547 -0.9962 1485 BSPBio_000078 CCC(=C)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D21 compound treatment 500.0 -775.65 -0.669 712.0 -1218.7 -0.9873 -1.1712 -0.982 1086 BSPBio_000079 CC(C)C(=O)Nc1ccc([N+](=O)[O-])c(c1)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D22 compound treatment 662.0 -613.65 -0.5292 1194.0 -736.72 -0.5968 -0.7963 -0.9982 1000106 BSPBio_000080 O=C(C1CCCCC1)N2CC3N(CCc4ccccc34)C(=O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D23 mock treatment 1161.0 -114.65 -0.0989 1772.0 -158.72 -0.1286 -0.1608 -0.9916 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 D24 mock treatment 581.0 -694.65 -0.5991 1065.0 -865.72 -0.7013 -0.9196 -0.9969 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E01 mock treatment 1640.0 364.35 0.3142 2894.0 963.28 0.7804 0.774 0.9201 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E02 mock treatment 1616.0 340.35 0.2935 2083.0 152.28 0.1234 0.2948 0.9258 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E03 compound treatment 2600.0 1324.3 1.1422 2556.0 625.28 0.5065 1.1658 0.9331 944 BSPBio_000081 Nc1ccc(cc1)S(=O)(=O)Nc2ccnn2c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E04 compound treatment 464.0 -811.65 -0.7 978.0 -952.72 -0.7718 -1.0407 -0.9988 899 BSPBio_000082 CN1CCc2cccc-3c2[C@H]1Cc4ccc(O)c(O)c43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E05 compound treatment 1547.0 271.35 0.234 2295.0 364.28 0.2951 0.3742 0.9934 3060 BSPBio_000083 CC(C)(CO)[C@@H](O)C(=O)NCCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E06 compound treatment 869.0 -406.65 -0.3507 1254.0 -676.72 -0.5482 -0.6356 -0.9767 885 BSPBio_000084 Clc1ccc2Oc3ccccc3N=C(N4CCNCC4)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E07 compound treatment 1948.0 672.35 0.5799 2396.0 465.28 0.3769 0.6766 0.9782 1159 BSPBio_000085 Nc1ccc(cc1)S(=O)(=O)Nc2ncccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E08 compound treatment 398.0 -877.65 -0.7569 344.0 -1586.7 -1.2854 -1.4442 -0.9681 3326 BSPBio_000086 CN1CCC(=C2c3ccccc3C=Cc4ccccc24)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E09 compound treatment 1043.0 -232.65 -0.2007 1291.0 -639.72 -0.5182 -0.5083 -0.9147 3188934 BSPBio_000087 C[C@@]12CC[C@H]3[C@@H](CCC4=C3CCC(=O)C4)[C@@H]2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E10 compound treatment 1875.0 599.35 0.5169 1832.0 -98.721 -0.08 0.309 0.5907 3616496 BSPBio_000088 NC(=Nc1nc(CSCCC(=N)NS(=O)(=O)N)cs1)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E11 compound treatment 470.0 -805.65 -0.6948 531.0 -1399.7 -1.1339 -1.2931 -0.9724 1433 BSPBio_000089 CS(=O)(=O)c1ccc(cc1)[C@@H](O)[C@@H](CO)NC(=O)C(Cl)Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E12 compound treatment 704.0 -571.65 -0.493 1209.0 -721.72 -0.5847 -0.7621 -0.9964 3189048 BSPBio_000090 C[C@@]12CC[C@H]3[C@@H](CCC4=Cc5oncc5C[C@]34C)[C@@H]2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E13 compound treatment 1557.0 281.35 0.2427 2174.0 243.28 0.1971 0.3109 0.9947 3616459 BSPBio_000091 CN/C(=N/CCSCc1nc[nH]c1C)/NC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E14 compound treatment 1220.0 -55.651 -0.048 1541.0 -389.72 -0.3157 -0.2572 -0.8054 3169 BSPBio_000092 CCN(CC)C(=O)N[C@@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E15 compound treatment 1873.0 597.35 0.5152 2144.0 213.28 0.1728 0.4865 0.8952 1432 BSPBio_000093 CN(C)CCOC(C)(c1ccccc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E16 compound treatment 14.0 -1261.7 -1.0881 0.0 -1930.7 -1.5641 -1.8754 -0.9843 3616497 BSPBio_000094 C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@H]5C[C@H](CC[C@]5(C)[C@H]4CC[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)OC%101CC[C@H](C)CN%10 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E17 compound treatment 1546.0 270.35 0.2332 2084.0 153.28 0.1242 0.2527 0.9565 1000260 BSPBio_000095 CC[C@H](CO)NCCN[C@H](CC)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E18 compound treatment 503.0 -772.65 -0.6664 1097.0 -833.72 -0.6754 -0.9488 -1.0 1386 BSPBio_000096 CN1CC(c2ccccc2)c3cccc(N)c3C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E19 compound treatment 1478.0 202.35 0.1745 1577.0 -353.72 -0.2866 -0.0792 -0.2361 1108 BSPBio_000097 Cc1cc(=O)n(c2ccccc2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E20 compound treatment 646.0 -629.65 -0.543 1036.0 -894.72 -0.7248 -0.8965 -0.9899 907387 BSPBio_000098 C[C@@]1(N[C@@H]2Cc3ccccc31)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E21 compound treatment 423.0 -852.65 -0.7354 1221.0 -709.72 -0.575 -0.9265 -0.9926 1079457 BSPBio_000099 Cc1c(O)c(=O)n(c2ccccc2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E22 compound treatment 273.0 -1002.7 -0.8647 674.0 -1256.7 -1.0181 -1.3314 -0.9967 3069006 BSPBio_000100 CC(=O)CC(c1ccc(cc1)[N+](=O)[O-])c2c(O)c3ccccc3oc2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E23 mock treatment 1031.0 -244.65 -0.211 840.0 -1090.7 -0.8836 -0.774 -0.852 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 E24 mock treatment 904.0 -371.65 -0.3205 908.0 -1022.7 -0.8285 -0.8125 -0.9146 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F01 mock treatment 1480.0 204.35 0.1762 45.0 -1885.7 -1.5276 -0.9556 -0.6214 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F02 mock treatment 1339.0 63.349 0.0546 2785.0 854.28 0.6921 0.528 0.7606 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F03 compound treatment 2097.0 821.35 0.7084 2945.0 1014.3 0.8217 1.0819 0.9973 1081 BSPBio_000101 Cc1c(N)c(=O)n(c2ccccc2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F04 compound treatment 1178.0 -97.651 -0.0842 502.0 -1428.7 -1.1574 -0.878 -0.7566 3616617 BSPBio_000102 C[C@@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F05 compound treatment 2277.0 1001.3 0.8636 2869.0 938.28 0.7601 1.1482 0.998 1000096 BSPBio_000103 C1CN2CC(N=C2S1)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F06 compound treatment 1887.0 611.35 0.5273 1508.0 -422.72 -0.3425 0.1307 0.2079 938 BSPBio_000104 Cc1ccc(cc1)/C(=C\CN2CCCC2)/c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F07 compound treatment 2051.0 775.35 0.6687 2173.0 242.28 0.1963 0.6116 0.8776 719 BSPBio_000105 CN(CC#C)Cc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F08 compound treatment 363.0 -912.65 -0.7871 309.0 -1621.7 -1.3138 -1.4856 -0.97 3060494 BSPBio_000106 CN(C)CC/C=C/1\c2ccccc2COc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F09 compound treatment 2048.0 772.35 0.6661 2665.0 734.28 0.5948 0.8916 0.9984 1062 BSPBio_000107 COc1ccccc1OCC(O)COC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F10 compound treatment 323.0 -952.65 -0.8216 293.0 -1637.7 -1.3267 -1.5191 -0.9735 1240 BSPBio_000108 CCCCOc1ccc(cc1)C(=O)CCN2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F11 compound treatment 2192.0 916.35 0.7903 2858.0 927.28 0.7512 1.09 0.9997 3189063 BSPBio_000109 C[C@H]1[C@H](NC(=O)/C(=N\OC(C)(C)C(=O)O)/c2csc(N)n2)C(=O)N1S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F12 compound treatment 2590.0 1314.3 1.1336 2061.0 130.28 0.1055 0.8762 0.7696 3173092 BSPBio_000110 CN(C)CCOC(c1ccccc1)c2ccccc2.Cn1c(=O)n(C)c2nc(Cl)[nH]c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F13 compound treatment 1956.0 680.35 0.5868 2505.0 574.28 0.4652 0.7439 0.9934 1337 BSPBio_000111 Cc1onc(c1C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4ccccc4Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F14 compound treatment 1352.0 76.349 0.0658 925.0 -1005.7 -0.8147 -0.5296 -0.6478 1112 BSPBio_000112 CC(C)N(CCC(C(=O)N)(c1ccccc1)c2ccccn2)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F15 compound treatment 1778.0 502.35 0.4333 1684.0 -246.72 -0.1999 0.165 0.3459 724 BSPBio_000113 CCn1cc(C(=O)O)c(=O)c2ccc(C)nc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F16 compound treatment 151.0 -1124.7 -0.97 176.0 -1754.7 -1.4215 -1.691 -0.9826 1272 BSPBio_000114 Clc1ccccc1C(c2ccccc2)(c3ccccc3)n4ccnc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F17 compound treatment 2299.0 1023.3 0.8826 2764.0 833.28 0.6751 1.1014 0.9912 3061416 BSPBio_000115 C[N+]1(CCCCC[N+]2(C)CCCC2)CCCC1.O[C@H]([C@@H](O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F18 compound treatment 376.0 -899.65 -0.7759 745.0 -1185.7 -0.9606 -1.2279 -0.9944 2359 BSPBio_000116 CCOC(=O)C1=C[C@]2(CC)CCCN3CCc4c([C@@H]32)n1c5ccccc45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F19 compound treatment 1607.0 331.35 0.2858 72.0 -1858.7 -1.5058 -0.8627 -0.5629 1300191 BSPBio_000117 C(Nc1ncnc2nc[nH]c12)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F20 compound treatment 3.0 -1272.7 -1.0976 38.0 -1892.7 -1.5333 -1.8603 -0.9866 1393 BSPBio_000118 CN(C)CCCN1c2ccccc2CCc3ccc(Cl)cc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F21 compound treatment 1819.0 543.35 0.4686 361.0 -1569.7 -1.2717 -0.5678 -0.419 198 BSPBio_000119 CCCCNC(=O)NS(=O)(=O)c1ccc(C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F22 compound treatment 0.0 -1275.7 -1.1002 0.0 -1930.7 -1.5641 -1.8839 -0.9852 1215 BSPBio_000120 CC(NCCC(c1ccccc1)c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F23 mock treatment 1632.0 356.35 0.3073 831.0 -1099.7 -0.8909 -0.4126 -0.4379 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 F24 mock treatment 654.0 -621.65 -0.5361 1487.0 -443.72 -0.3595 -0.6333 -0.9811 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G01 mock treatment 1487.0 211.35 0.1823 2110.0 179.28 0.1452 0.2316 0.9937 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G02 mock treatment 1053.0 -222.65 -0.192 2031.0 100.28 0.0812 -0.0783 -0.3757 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G03 compound treatment 736.0 -539.65 -0.4654 1144.0 -786.72 -0.6373 -0.7798 -0.9881 1160 BSPBio_000121 OC[C@@H](NC(=O)C(Cl)Cl)[C@H](O)c1ccc(cc1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G04 compound treatment 1237.0 -38.651 -0.0333 1511.0 -419.72 -0.34 -0.264 -0.7727 929 BSPBio_000122 Oc1ccc2C[C@H]3N(CC=C)CC[C@]4([C@H]5Oc1c24)[C@@]3(O)CCC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G05 compound treatment 1325.0 49.349 0.0426 2094.0 163.28 0.1323 0.1236 0.8897 2702 BSPBio_000123 COc1cc(C)nn1c2nc(C)cc(OC)n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G06 compound treatment 1288.0 12.349 0.0107 1584.0 -346.72 -0.2809 -0.1911 -0.6798 918 BSPBio_000124 CC1Nc2cc(Cl)c(cc2C(=O)N1c3ccccc3C)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G07 compound treatment 1783.0 507.35 0.4376 1970.0 39.279 0.0318 0.3319 0.7565 697 BSPBio_000125 Cn1c(=O)n(C)c2ncn(CC(O)CO)c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G08 compound treatment 967.0 -308.65 -0.2662 1250.0 -680.72 -0.5515 -0.5782 -0.9442 757 BSPBio_000126 OC(=O)c1cn(C2CC2)c3cc(N4CCNCC4)c(F)cc3c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G09 compound treatment 146.0 -1129.7 -0.9743 113.0 -1817.7 -1.4726 -1.7302 -0.9799 1061 BSPBio_000127 Nc1nc(N)c2nc(c(N)nc2n1)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G10 compound treatment 901.0 -374.65 -0.3231 1497.0 -433.72 -0.3514 -0.4769 -0.9991 1092 BSPBio_000128 CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G11 compound treatment 1252.0 -23.651 -0.0204 1769.0 -161.72 -0.131 -0.1071 -0.8075 1186 BSPBio_000129 Nc1ccc(cc1)S(=O)(=O)c2ccc(N)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G12 compound treatment 448.0 -827.65 -0.7138 488.0 -1442.7 -1.1688 -1.3312 -0.972 1261 BSPBio_000130 OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G13 compound treatment 1372.0 96.349 0.0831 2349.0 418.28 0.3389 0.2984 0.8552 3616468 BSPBio_000131 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G14 compound treatment 1158.0 -117.65 -0.1015 1765.0 -165.72 -0.1343 -0.1667 -0.9905 3189051 BSPBio_000132 Oc1ccc2C[C@H]3N(CC4CC4)CC[C@]5([C@H]6Oc1c25)[C@@]3(O)CCC6=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G15 compound treatment 72.0 -1203.7 -1.0381 62.0 -1868.7 -1.5139 -1.8045 -0.9831 1259 BSPBio_000133 CCc1nc(N)nc(N)c1c2ccc(Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G16 compound treatment 1097.0 -178.65 -0.1541 1135.0 -795.72 -0.6446 -0.5648 -0.8521 1207 BSPBio_000134 CN(C)CCC(c1ccc(Cl)cc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G17 compound treatment 1218.0 -57.651 -0.0497 1494.0 -436.72 -0.3538 -0.2853 -0.7986 1270 BSPBio_000135 C[N+](C)(C)CCCCCC[N+](C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G18 compound treatment 839.0 -436.65 -0.3766 849.0 -1081.7 -0.8763 -0.8859 -0.9288 1027 BSPBio_000136 O[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC6CCC6)c54 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G19 compound treatment 1011.0 -264.65 -0.2283 1134.0 -796.72 -0.6454 -0.6178 -0.9024 1518 BSPBio_000137 OC(=O)c1cc(ccc1O)c2ccc(F)cc2F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G20 compound treatment 542.0 -733.65 -0.6327 999.0 -931.72 -0.7548 -0.9811 -0.9962 2241 BSPBio_000138 COc1ccc(cc1C(=O)NCc2cccnc2)C(=O)NCc3cccnc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G21 compound treatment 393.0 -882.65 -0.7612 595.0 -1335.7 -1.0821 -1.3034 -0.9852 1313 BSPBio_000139 Oc1ccc(Cl)cc1C(=O)Nc2ccc(cc2Cl)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G22 compound treatment 77.0 -1198.7 -1.0338 324.0 -1606.7 -1.3016 -1.6514 -0.9935 1002008 BSPBio_000140 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G23 mock treatment 754.0 -521.65 -0.4499 1061.0 -869.72 -0.7046 -0.8163 -0.9765 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 G24 mock treatment 168.0 -1107.7 -0.9553 587.0 -1343.7 -1.0886 -1.4452 -0.9979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H01 mock treatment 2417.0 1141.3 0.9844 3692.0 1761.3 1.4268 1.705 0.9836 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H02 mock treatment 1493.0 217.35 0.1875 2590.0 659.28 0.5341 0.5102 0.9014 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H03 compound treatment 2126.0 850.35 0.7334 3254.0 1323.3 1.072 1.2766 0.9829 1535 BSPBio_000141 COc1ccc(OC)c(c1)C(O)CNC(=O)CN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H04 compound treatment 1717.0 441.35 0.3806 2900.0 969.28 0.7852 0.8244 0.9447 3069234 BSPBio_000142 CC[C@]1(CCCN2CCc3c4[C@@H]21)C[C@](O)(C(=O)OC)n4c5ccccc35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H05 compound treatment 2993.0 1717.3 1.4811 3289.0 1358.3 1.1004 1.8254 0.9893 370 BSPBio_000143 O=C1N(C2CCC(=O)NC2=O)C(=O)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H06 compound treatment 1344.0 68.349 0.0589 2743.0 812.28 0.658 0.507 0.7674 2797 BSPBio_000144 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)O)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H07 compound treatment 2929.0 1653.3 1.4259 2871.0 940.28 0.7617 1.5469 0.9569 1266 BSPBio_000145 CCn1cc(C(=O)O)c(=O)c2cc3OCOc3cc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H08 compound treatment 1322.0 46.349 0.04 1945.0 14.279 0.0116 0.0364 0.8758 3176928 BSPBio_000146 C[C@@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]2CC[C@]1(O)C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H09 compound treatment 2166.0 890.35 0.7679 2773.0 842.28 0.6823 1.0255 0.9983 1298 BSPBio_000147 CS(=O)(=O)Nc1ccc(cc1Oc2ccccc2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H10 compound treatment 537.0 -738.65 -0.6371 872.0 -1058.7 -0.8577 -1.0569 -0.9893 3189180 BSPBio_000148 C[C@@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]2CC[C@]1(O)C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H11 compound treatment 2372.0 1096.3 0.9456 3297.0 1366.3 1.1068 1.4513 0.9969 3616559 BSPBio_000149 C[N+]1=Cc2cc3OCOc3cc2CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H12 compound treatment 1590.0 314.35 0.2711 1886.0 -44.721 -0.0362 0.1661 0.6072 1172 BSPBio_000150 CC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c2ccc(Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H13 compound treatment 2594.0 1318.3 1.137 3450.0 1519.3 1.2308 1.6743 0.9992 1331 BSPBio_000151 CC(=O)CCCCn1c(=O)n(C)c2ncn(C)c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H14 compound treatment 1352.0 76.349 0.0658 1901.0 -29.721 -0.0241 0.0295 0.4213 404 BSPBio_000152 CCCCNc1cc(cc(c1Oc2ccccc2)S(=O)(=O)N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H15 compound treatment 2257.0 981.35 0.8464 2415.0 484.28 0.3923 0.8759 0.9389 3616563 BSPBio_000153 C[C@H](N)[C@H](O)c1cccc(O)c1.O[C@H]([C@@H](O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H16 compound treatment 977.0 -298.65 -0.2576 1857.0 -73.721 -0.0597 -0.2244 -0.8485 1100 BSPBio_000154 CC(CCc1ccccc1)NCC(O)c2ccc(O)c(c2)C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H17 compound treatment 2296.0 1020.3 0.88 2399.0 468.28 0.3794 0.8905 0.9293 1523 BSPBio_000155 CC(C)(C)NCC(O)c1ccc(O)c(CO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H18 compound treatment 1138.0 -137.65 -0.1187 1865.0 -65.721 -0.0532 -0.1216 -0.9345 3172 BSPBio_000156 C(/C=C/c1ccccc1)N2CCN(CC2)C(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H19 compound treatment 1904.0 628.35 0.5419 2575.0 644.28 0.5219 0.7523 0.9998 1436 BSPBio_000157 CCCNC(C)C(=O)Nc1ccccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H20 compound treatment 205.0 -1070.7 -0.9234 375.0 -1555.7 -1.2603 -1.5441 -0.9883 1001967 BSPBio_000158 C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]4(C)C=CC(=O)C=C14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H21 compound treatment 30.0 -1245.7 -1.0743 16.0 -1914.7 -1.5511 -1.8565 -0.9839 383 BSPBio_000159 CC[C@@]1(O)C(=O)OCc2c1cc3-c4nc5ccccc5cc4Cn3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H22 compound treatment 646.0 -629.65 -0.543 1266.0 -664.72 -0.5385 -0.7648 -1.0 1000268 BSPBio_000160 COc1ccc2nccc([C@H](O)[C@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H23 mock treatment 1333.0 57.349 0.0495 1585.0 -345.72 -0.2801 -0.1631 -0.5734 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 H24 mock treatment 746.0 -529.65 -0.4568 1265.0 -665.72 -0.5393 -0.7044 -0.9966 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I01 mock treatment 2479.0 1203.3 1.0378 3164.0 1233.3 0.9991 1.4403 0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I02 mock treatment 2036.0 760.35 0.6558 2798.0 867.28 0.7026 0.9605 0.9994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I03 compound treatment 2087.0 811.35 0.6998 3838.0 1907.3 1.5451 1.5874 0.9358 779 BSPBio_000161 CCN(CC)CCOC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I04 compound treatment 1262.0 -13.651 -0.0118 1823.0 -107.72 -0.0873 -0.07 -0.7953 3616505 BSPBio_000162 CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)C4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]7CCCN7C1=O)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I05 compound treatment 61.0 -1214.7 -1.0476 375.0 -1555.7 -1.2603 -1.6319 -0.9958 2847 BSPBio_000163 CC(C)c1cc(OC(=O)C)c(C)cc1OCCN(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I06 compound treatment 2310.0 1034.3 0.8921 2723.0 792.28 0.6418 1.0846 0.987 3069040 BSPBio_000164 CNCC(O)c1ccc(O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I07 compound treatment 3022.0 1746.3 1.5062 3391.0 1460.3 1.183 1.9015 0.9929 3068964 BSPBio_000165 NCCc1cc[nH]n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I08 compound treatment 1752.0 476.35 0.4108 2590.0 659.28 0.5341 0.6682 0.9916 2858 BSPBio_000166 C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@]12C)[C@@]4(C)CCC(=O)C[C@H]4CC3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I09 compound treatment 2576.0 1300.3 1.1215 2720.0 789.28 0.6394 1.2451 0.9645 1268 BSPBio_000167 CN1C(=C(O)c2ccccc2S1(=O)=O)C(=O)Nc3cc(C)on3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I10 compound treatment 1016.0 -259.65 -0.2239 2633.0 702.28 0.5689 0.2439 0.399 1610 BSPBio_000168 COc1ccc(cc1O)[C@@H]2CC(=O)c3c(O)cc(O)cc3O2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I11 compound treatment 2584.0 1308.3 1.1284 2029.0 98.279 0.0796 0.8542 0.7551 907391 BSPBio_000169 COc1ccc2cc(ccc2c1)C(C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I12 compound treatment 391.0 -884.65 -0.763 632.0 -1298.7 -1.0521 -1.2835 -0.9875 1465 BSPBio_000170 OCCN1CCN(CCCN2c3ccccc3Sc4ccc(Cl)cc24)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I13 compound treatment 2533.0 1257.3 1.0844 2809.0 878.28 0.7115 1.2699 0.9791 1083 BSPBio_000171 C(C1=NCCN1)c2cccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I14 compound treatment 169.0 -1106.7 -0.9544 33.0 -1897.7 -1.5374 -1.762 -0.9737 1387 BSPBio_000172 OC(C1CCCCN1)c2cc(nc3c(cccc23)C(F)(F)F)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I15 compound treatment 1429.0 153.35 0.1323 717.0 -1213.7 -0.9833 -0.6017 -0.6065 1821 BSPBio_000173 Clc1ccccc1CN2CCc3sccc3C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I16 compound treatment 745.0 -530.65 -0.4577 830.0 -1100.7 -0.8917 -0.9542 -0.952 3487389 BSPBio_000174 Clc1ccc(C(Cn2ccnc2)OCc3c(Cl)cccc3Cl)c(Cl)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I17 compound treatment 1134.0 -141.65 -0.1222 561.0 -1369.7 -1.1096 -0.871 -0.7802 819 BSPBio_000175 CCN(CC)CCOC(=O)C1(CCCCC1)C2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I18 compound treatment 2092.0 816.35 0.7041 1877.0 -53.721 -0.0435 0.4671 0.6621 3189054 BSPBio_000176 CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@]54CCC(=O)O5)[C@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I19 compound treatment 2341.0 1065.3 0.9188 1839.0 -91.721 -0.0743 0.5972 0.6478 3188937 BSPBio_000177 CCC(C)(CN(C)C)OC(=O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I20 compound treatment 1383.0 107.35 0.0926 1877.0 -53.721 -0.0435 0.0347 0.3391 786 BSPBio_000178 CN1CCN(CC(=O)N2c3ccccc3C(=O)Nc4cccnc24)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I21 compound treatment 1347.0 71.349 0.0615 2085.0 154.28 0.125 0.1319 0.9467 362 BSPBio_000179 CCN(CC)CC(=O)Nc1c(C)cccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I22 compound treatment 166.0 -1109.7 -0.957 266.0 -1664.7 -1.3486 -1.6303 -0.9859 1000246 BSPBio_000180 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)COC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I23 mock treatment 1420.0 144.35 0.1245 1867.0 -63.721 -0.0516 0.0515 0.3823 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 I24 mock treatment 745.0 -530.65 -0.4577 1256.0 -674.72 -0.5466 -0.7101 -0.9961 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J01 mock treatment 1786.0 510.35 0.4402 3280.0 1349.3 1.0931 1.0842 0.9201 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J02 mock treatment 1778.0 502.35 0.4333 2712.0 781.28 0.6329 0.7539 0.9829 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J03 compound treatment 1953.0 677.35 0.5842 3137.0 1206.3 0.9772 1.1041 0.9697 3616567 BSPBio_000181 CN/C(=C/[N+](=O)[O-])/NCCSCc1ccc(CN(C)C)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J04 compound treatment 261.0 -1014.7 -0.8751 567.0 -1363.7 -1.1048 -1.4 -0.9933 3616626 BSPBio_000182 CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3(F)C(=O)C[C@@]21C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J05 compound treatment 1572.0 296.35 0.2556 2757.0 826.28 0.6694 0.6541 0.9128 3069077 BSPBio_000183 OC(=O)Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J06 compound treatment 1371.0 95.349 0.0822 2435.0 504.28 0.4085 0.347 0.8327 1033 BSPBio_000184 CC(Cc1ccc(O)cc1)NCC(O)c2cc(O)cc(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J07 compound treatment 2238.0 962.35 0.83 2563.0 632.28 0.5122 0.9491 0.9731 41 BSPBio_000185 OC(=O)c1ccccc1Nc2cccc(c2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J08 compound treatment 1170.0 -105.65 -0.0911 771.0 -1159.7 -0.9395 -0.7288 -0.7721 1019722 BSPBio_000186 CN1CCCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J09 compound treatment 1847.0 571.35 0.4928 2808.0 877.28 0.7107 0.851 0.984 752 BSPBio_000187 CC1CCc2cc(F)cc3c(=O)c(cn1c23)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J10 compound treatment 1787.0 511.35 0.441 2178.0 247.28 0.2003 0.4535 0.9362 1164 BSPBio_000188 CCN(CC)C(=O)N1CCN(C)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J11 compound treatment 2562.0 1286.3 1.1094 3061.0 1130.3 0.9157 1.4319 0.9955 1258696 BSPBio_000189 Cc1c(Cl)cccc1Nc2ccccc2C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J12 compound treatment 1403.0 127.35 0.1098 2271.0 340.28 0.2757 0.2726 0.9186 1000071 BSPBio_000190 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J13 compound treatment 2780.0 1504.3 1.2974 3061.0 1130.3 0.9157 1.5649 0.9854 1123 BSPBio_000191 Cc1ccc(Cl)c(Nc2ccccc2C(=O)O)c1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J14 compound treatment 0.0 -1275.7 -1.1002 0.0 -1930.7 -1.5641 -1.8839 -0.9852 1158 BSPBio_000192 C(C(C1CCCCC1)C2CCCCC2)C3CCCCN3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J15 compound treatment 2207.0 931.35 0.8033 2628.0 697.28 0.5649 0.9674 0.9852 3189175 BSPBio_000193 COC1=CC(=O)O[C@H](C1)/C=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J16 compound treatment 739.0 -536.65 -0.4628 835.0 -1095.7 -0.8877 -0.9549 -0.9539 3480597 BSPBio_000194 CCN(CC)CC#CCOC(=O)C(O)(C1CCCCC1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J17 compound treatment 2151.0 875.35 0.755 2527.0 596.28 0.4831 0.8754 0.9767 1201 BSPBio_000195 COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J18 compound treatment 2065.0 789.35 0.6808 1888.0 -42.721 -0.0346 0.4569 0.6703 1180 BSPBio_000196 Fc1ccc(cc1)C(=O)CCCN2CCC3(CC2)N(CNC3=O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J19 compound treatment 2562.0 1286.3 1.1094 2355.0 424.28 0.3437 1.0275 0.8847 734 BSPBio_000197 CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J20 compound treatment 1559.0 283.35 0.2444 1938.0 7.2787 0.0059 0.177 0.724 830 BSPBio_000198 COc1ccc(CN(CCN(C)C)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J21 compound treatment 794.0 -481.65 -0.4154 1006.0 -924.72 -0.7491 -0.8234 -0.9613 1281686 BSPBio_000199 COC(=O)Nc1nc2cc(Sc3ccccc3)ccc2[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J22 compound treatment 760.0 -515.65 -0.4447 1479.0 -451.72 -0.3659 -0.5732 -0.9953 753 BSPBio_000200 O=C1C(CCS(=O)c2ccccc2)C(=O)N(N1c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J23 mock treatment 1368.0 92.349 0.0796 2281.0 350.28 0.2838 0.257 0.8719 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 J24 mock treatment 1098.0 -177.65 -0.1532 1764.0 -166.72 -0.1351 -0.2038 -0.998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K01 mock treatment 3195.0 1919.3 1.6554 2654.0 723.28 0.5859 1.5848 0.9025 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K02 mock treatment 1693.0 417.35 0.3599 2707.0 776.28 0.6289 0.6992 0.9649 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K03 compound treatment 2179.0 903.35 0.7791 3069.0 1138.3 0.9221 1.203 0.9965 1010605 BSPBio_000201 COP(=O)(OC)C(O)C(Cl)(Cl)Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K04 compound treatment 1096.0 -179.65 -0.1549 2513.0 582.28 0.4717 0.224 0.4511 72 BSPBio_000202 Cc1cnc(cn1)C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC3CCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K05 compound treatment 2290.0 1014.3 0.8748 1817.0 -113.72 -0.0921 0.5535 0.6292 1019 BSPBio_000203 NC(=O)N1c2ccccc2C=Cc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K06 compound treatment 1149.0 -126.65 -0.1092 1879.0 -51.721 -0.0419 -0.1069 -0.9134 4362 BSPBio_000204 CN1CCN(CC1)C2=Nc3ccccc3Oc4ccc(Cl)cc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K07 compound treatment 271.0 -1004.7 -0.8665 371.0 -1559.7 -1.2636 -1.5062 -0.9831 1401 BSPBio_000205 CN(C)CCCN1c2ccccc2Sc3ccc(cc13)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K08 compound treatment 1584.0 308.35 0.2659 2350.0 419.28 0.3397 0.4282 0.9927 3487390 BSPBio_000206 OCCOCCN1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K09 compound treatment 2332.0 1056.3 0.9111 2736.0 805.28 0.6524 1.1055 0.9866 939 BSPBio_000207 Cc1cccc(Nc2ccccc2C(=O)O)c1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K10 compound treatment 1121.0 -154.65 -0.1334 1972.0 41.279 0.0334 -0.0707 -0.5139 355 BSPBio_000208 COc1ccc(cc1)[C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K11 compound treatment 2442.0 1166.3 1.0059 2905.0 974.28 0.7893 1.2694 0.9928 3186 BSPBio_000209 CC(=O)c1ccc(cc1)S(=O)(=O)NC(=O)NC2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K12 compound treatment 49.0 -1226.7 -1.0579 19.0 -1911.7 -1.5487 -1.8432 -0.9827 1000064 BSPBio_000210 CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)NC(CCC(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K13 compound treatment 1958.0 682.35 0.5885 3084.0 1153.3 0.9343 1.0768 0.9752 920 BSPBio_000211 CCN1CCCC1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K14 compound treatment 41.0 -1234.7 -1.0648 2.0 -1928.7 -1.5625 -1.8578 -0.9825 709 BSPBio_000212 COc1ccc(CCN2CCC(CC2)Nc3nc4ccccc4n3Cc5ccc(F)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K15 compound treatment 1776.0 500.35 0.4315 1803.0 -127.72 -0.1035 0.232 0.5227 3127 BSPBio_000213 CCCCOc1cc(ccc1N)C(=O)OCCN(CC)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K16 compound treatment 1575.0 299.35 0.2582 1886.0 -44.721 -0.0362 0.1569 0.602 3189055 BSPBio_000214 CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@H](C)Cl)C2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K17 compound treatment 901.0 -374.65 -0.3231 236.0 -1694.7 -1.3729 -1.1993 -0.8503 1318 BSPBio_000215 CN(C(=O)CN(CCO)CC(=O)N(C)C(C)(C)Cc1ccccc1)C(C)(C)Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K18 compound treatment 775.0 -500.65 -0.4318 942.0 -988.72 -0.801 -0.8717 -0.958 1590 BSPBio_000216 CC(C)(C)c1ccc(cc1)C(O)CCCN2CCC(CC2)C(O)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K19 compound treatment 1954.0 678.35 0.585 2441.0 510.28 0.4134 0.706 0.9855 884 BSPBio_000217 CN(C)CCC(c1ccccc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K20 compound treatment 1172.0 -103.65 -0.0894 1511.0 -419.72 -0.34 -0.3036 -0.8637 3060388 BSPBio_000218 CO/N=C(\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)COC(=O)C)/c3csc(N)n3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K21 compound treatment 1649.0 373.35 0.322 1687.0 -243.72 -0.1974 0.0881 0.2332 965 BSPBio_000219 C(C1=NCCN1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K22 compound treatment 719.0 -556.65 -0.4801 1010.0 -920.72 -0.7459 -0.8669 -0.9773 1418 BSPBio_000220 CN(C)[C@H]1[C@@H]2C[C@H]3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)C(=O)c4c(O)cccc4[C@@]3(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K23 mock treatment 1307.0 31.349 0.027 1848.0 -82.721 -0.067 -0.0283 -0.3912 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 K24 mock treatment 995.0 -280.65 -0.242 1307.0 -623.72 -0.5053 -0.5284 -0.9432 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L01 mock treatment 2381.0 1105.3 0.9533 2887.0 956.28 0.7747 1.2219 0.9947 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L02 mock treatment 1839.0 563.35 0.4859 3172.0 1241.3 1.0056 1.0546 0.9443 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L03 compound treatment 2457.0 1181.3 1.0189 3600.0 1669.3 1.3523 1.6767 0.9903 347 BSPBio_000221 CN1C(=C(O)c2ccccc2S1(=O)=O)C(=O)Nc3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L04 compound treatment 1645.0 369.35 0.3185 2907.0 976.28 0.7909 0.7845 0.9201 3068677 BSPBio_000222 OC1=NC(=O)CN1/N=C/c2ccc(o2)c3ccc(cc3)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L05 compound treatment 2430.0 1154.3 0.9956 3543.0 1612.3 1.3061 1.6276 0.991 3616578 BSPBio_000223 CN1CCCN=C1/C=C/c2cccs2.O[C@H]([C@@H](O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L06 compound treatment 1900.0 624.35 0.5385 3089.0 1158.3 0.9383 1.0443 0.9652 850 BSPBio_000224 Clc1cccc(c1)N2CCN(CCCn3nc4ccccn4c3=O)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L07 compound treatment 536.0 -739.65 -0.6379 2262.0 331.28 0.2684 -0.2613 -0.3776 1144 BSPBio_000225 O=C1NCC2(CCN(CCc3ccccc3)CC2)O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L08 compound treatment 1606.0 330.35 0.2849 1824.0 -106.72 -0.0865 0.1403 0.4713 936 BSPBio_000226 OCC(O)COC(=O)c1ccccc1Nc2ccnc3cc(Cl)ccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L09 compound treatment 2556.0 1280.3 1.1042 3413.0 1482.3 1.2008 1.6299 0.9991 796 BSPBio_000227 Cc1ccc(C)c(OCCCC(C)(C)C(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L10 compound treatment 1141.0 -134.65 -0.1161 1209.0 -721.72 -0.5847 -0.4955 -0.8313 1060 BSPBio_000228 CN1CCC(=C2c3ccccc3Sc4ccccc24)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L11 compound treatment 2241.0 965.35 0.8326 3276.0 1345.3 1.0898 1.3593 0.9912 1346 BSPBio_000229 CCN(CC)CCNC(=O)COc1ccc(OC)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L12 compound treatment 1824.0 548.35 0.4729 2647.0 716.28 0.5803 0.7447 0.9948 1069 BSPBio_000230 CCCN1C[C@H](CSC)C[C@H]2[C@H]1Cc3c[nH]c4cccc2c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L13 compound treatment 2635.0 1359.3 1.1724 2931.0 1000.3 0.8103 1.402 0.9837 1339 BSPBio_000231 CCN(CC)CCNC(=O)c1cc(ccc1OC)S(=O)(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L14 compound treatment 933.0 -342.65 -0.2955 2016.0 85.279 0.0691 -0.1601 -0.5276 1113 BSPBio_000232 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)OCC(=O)O)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L15 compound treatment 780.0 -495.65 -0.4275 787.0 -1143.7 -0.9265 -0.9574 -0.9383 1350 BSPBio_000233 COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L16 compound treatment 605.0 -670.65 -0.5784 1716.0 -214.72 -0.1739 -0.532 -0.8808 3068682 BSPBio_000234 CN(C)CCCOc1nn(Cc2ccccc2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L17 compound treatment 2055.0 779.35 0.6722 2449.0 518.28 0.4199 0.7722 0.9743 699 BSPBio_000235 OC(=O)CCC(=O)c1ccc(cc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L18 compound treatment 1507.0 231.35 0.1995 1899.0 -31.721 -0.0257 0.1229 0.611 1348 BSPBio_000236 Clc1ccc(OCC(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L19 compound treatment 1594.0 318.35 0.2746 1971.0 40.279 0.0326 0.2172 0.7856 1209 BSPBio_000237 CC(C(=O)O)c1cccc(c1)C(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L20 compound treatment 837.0 -438.65 -0.3783 1171.0 -759.72 -0.6155 -0.7027 -0.9727 3055129 BSPBio_000238 CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@@]21C)c5ccc(cc5)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L21 compound treatment 1818.0 542.35 0.4678 1749.0 -181.72 -0.1472 0.2267 0.4622 1127 BSPBio_000239 CC1Cc2ccccc2N1NC(=O)c3ccc(Cl)c(c3)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L22 compound treatment 957.0 -318.65 -0.2748 1443.0 -487.72 -0.3951 -0.4737 -0.9843 1045066 BSPBio_000240 O=C(Nc1ccccc1)OCC(CN2CCCCC2)OC(=O)Nc3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L23 mock treatment 1206.0 -69.651 -0.0601 1875.0 -55.721 -0.0451 -0.0744 -0.9901 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 L24 mock treatment 796.0 -479.65 -0.4137 1249.0 -681.72 -0.5523 -0.683 -0.9899 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M01 mock treatment 2430.0 1154.3 0.9956 2902.0 971.28 0.7868 1.2604 0.9932 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M02 mock treatment 1685.0 409.35 0.353 2880.0 949.28 0.769 0.7934 0.9376 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M03 compound treatment 2602.0 1326.3 1.1439 3706.0 1775.3 1.4382 1.8258 0.9936 3188938 BSPBio_000241 CN1CCCN=C1/C=C/c2sccc2C.OC(C(O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M04 compound treatment 1146.0 -129.65 -0.1118 1630.0 -300.72 -0.2436 -0.2513 -0.9376 1000056 BSPBio_000242 COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M05 compound treatment 2368.0 1092.3 0.9421 3037.0 1106.3 0.8962 1.2999 0.9997 3559747 BSPBio_000243 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M06 compound treatment 2002.0 726.35 0.6264 2630.0 699.28 0.5665 0.8435 0.9987 1301 BSPBio_000244 OCCN(CCO)c1nc(N2CCCCC2)c3nc(nc(N4CCCCC4)c3n1)N(CCO)CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M07 compound treatment 1037.0 -238.65 -0.2058 1630.0 -300.72 -0.2436 -0.3178 -0.9965 110 BSPBio_000245 COC(=O)C1=C(C)NC(=C(C1c2ccccc2[N+](=O)[O-])C(=O)OC)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M08 compound treatment 28.0 -1247.7 -1.076 2.0 -1928.7 -1.5625 -1.8657 -0.9834 1360 BSPBio_000246 Clc1ccc(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)Nc2ccc(Cl)cc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M09 compound treatment 345.0 -930.65 -0.8026 401.0 -1529.7 -1.2392 -1.4438 -0.9779 436 BSPBio_000247 CN(C)CCCN1c2ccccc2Sc3ccc(Cl)cc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M10 compound treatment 526.0 -749.65 -0.6465 717.0 -1213.7 -0.9833 -1.1524 -0.9793 80 BSPBio_000248 CN(C)C(=O)C(CCN1CCC(O)(CC1)c2ccc(Cl)cc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M11 compound treatment 2142.0 866.35 0.7472 2491.0 560.28 0.4539 0.8493 0.9715 1002 BSPBio_000249 CN(C)CCOC(c1ccccc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M12 compound treatment 1254.0 -21.651 -0.0187 2408.0 477.28 0.3867 0.2602 0.6722 3198950 BSPBio_000250 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M13 compound treatment 1737.0 461.35 0.3979 2300.0 369.28 0.2992 0.4929 0.9901 728 BSPBio_000251 Cc1cc(nnc1NCCN2CCOCC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M14 compound treatment 302.0 -973.65 -0.8397 532.0 -1398.7 -1.1331 -1.395 -0.9891 368 BSPBio_000252 CC/C(=C(\c1ccccc1)/c2ccc(OCCN(C)C)cc2)/c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M15 compound treatment 1166.0 -109.65 -0.0946 404.0 -1526.7 -1.2368 -0.9414 -0.759 814 BSPBio_000253 Clc1ccc(COC(Cn2ccnc2)c3ccc(Cl)cc3Cl)c(Cl)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M16 compound treatment 1638.0 362.35 0.3125 2177.0 246.28 0.1995 0.3621 0.9765 783 BSPBio_000254 CO[C@@]12C[C@@H](COC(=O)c3cncc(Br)c3)CN(C)[C@@H]2Cc4cn(C)c5cccc1c45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M17 compound treatment 2020.0 744.35 0.642 1947.0 16.279 0.0132 0.4633 0.7215 3471598 BSPBio_000255 CC(COc1ccccc1)NC(C)C(O)c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M18 compound treatment 1596.0 320.35 0.2763 1748.0 -182.72 -0.148 0.0907 0.2894 2784 BSPBio_000256 C[C@@]12CC[C@H]3[C@@H](C=CC4=CC(=O)CC[C@]34C)[C@@H]2CC[C@@]1(O)CCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M19 compound treatment 1635.0 359.35 0.3099 2018.0 87.279 0.0707 0.2691 0.8467 1223 BSPBio_000257 CCCC(=O)Nc1ccc(OCC(O)CNC(C)C)c(c1)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M20 compound treatment 623.0 -652.65 -0.5629 1290.0 -640.72 -0.5191 -0.765 -0.9992 3189056 BSPBio_000258 CN(C)S(=O)(=O)c1ccc2Sc3ccccc3N(CCCN4CCN(C)CC4)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M21 compound treatment 1007.0 -268.65 -0.2317 1443.0 -487.72 -0.3951 -0.4432 -0.9677 971 BSPBio_000259 CN(C(=S)Oc1ccc2ccccc2c1)c3cccc(C)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M22 compound treatment 1192.0 -83.651 -0.0721 1720.0 -210.72 -0.1707 -0.1717 -0.9266 3616513 BSPBio_000260 CN1C[C@@H](CC2[C@H]1Cc3c[nH]c4cccc2c34)C(=O)N[C@]5(C)O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@H](Cc8ccccc8)N6C5=O.OC(C(O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M23 mock treatment 975.0 -300.65 -0.2593 1139.0 -791.72 -0.6414 -0.6369 -0.9206 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 M24 mock treatment 1249.0 -26.651 -0.023 1613.0 -317.72 -0.2574 -0.1983 -0.7672 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N01 mock treatment 2320.0 1044.3 0.9007 2840.0 909.28 0.7366 1.1578 0.995 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N02 mock treatment 1782.0 506.35 0.4367 3282.0 1351.3 1.0947 1.0829 0.9188 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N03 compound treatment 2312.0 1036.3 0.8938 2904.0 973.28 0.7885 1.1895 0.998 747 BSPBio_000261 CCn1cc(C(=O)O)c(=O)c2cc(F)c(cc12)N3CCNCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N04 compound treatment 1928.0 652.35 0.5626 2909.0 978.28 0.7925 0.9582 0.9859 1608 BSPBio_000262 NCCCC[C@H](N[C@@H](CCc1ccccc1)C(=O)O)C(=O)N2CCC[C@H]2C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N05 compound treatment 27.0 -1248.7 -1.0769 30.0 -1900.7 -1.5398 -1.8503 -0.9847 3189176 BSPBio_000263 CCCCCC[C@@H]1[C@@H](OC(=O)CC(C)C)[C@H](C)OC(=O)C(NC(=O)c2cccc(NC=O)c2O)[C@@H](C)OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N06 compound treatment 1875.0 599.35 0.5169 2819.0 888.28 0.7196 0.8744 0.9868 3068878 BSPBio_000264 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N07 compound treatment 1938.0 662.35 0.5712 2609.0 678.28 0.5495 0.7925 0.9998 816 BSPBio_000265 Cc1cc(cc(C)c1CC2=NCCN2)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N08 compound treatment 1630.0 354.35 0.3056 2974.0 1043.3 0.8452 0.8137 0.9054 907526 BSPBio_000266 CN1CCN(CC(=O)N2c3c(C)scc3C(=O)Nc4ccccc24)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N09 compound treatment 1626.0 350.35 0.3022 3256.0 1325.3 1.0736 0.9728 0.8722 1181 BSPBio_000267 Cc1cc(c(O)c(C)c1CC2=NCCN2)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N10 compound treatment 392.0 -883.65 -0.7621 533.0 -1397.7 -1.1323 -1.3396 -0.9814 773 BSPBio_000268 Clc1ccc(COC(Cn2ccnc2)c3ccc(Cl)cc3Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N11 compound treatment 2211.0 935.35 0.8067 2932.0 1001.3 0.8111 1.144 1.0 1162 BSPBio_000269 Cc1c(NC(=O)c2cccnc2)c(=O)n(c3ccccc3)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N12 compound treatment 1990.0 714.35 0.6161 2312.0 381.28 0.3089 0.6541 0.949 1357 BSPBio_000270 CCCCN1CCCCC1C(=O)Nc2c(C)cccc2C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N13 compound treatment 2186.0 910.35 0.7851 2387.0 456.28 0.3696 0.8166 0.9409 812 BSPBio_000271 COC1=CC(=O)C[C@@H](C)[C@@]21Oc3c(C2=O)c(OC)cc(OC)c3Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N14 compound treatment 82.0 -1193.7 -1.0295 100.0 -1830.7 -1.4831 -1.7767 -0.9841 927 BSPBio_000272 CN1CCC[C@@H]1CCO[C@](C)(c2ccccc2)c3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N15 compound treatment 1668.0 392.35 0.3384 1773.0 -157.72 -0.1278 0.1489 0.4117 386963 BSPBio_000273 Clc1ccc(Cn2c(CN3CCCC3)nc4ccccc24)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N16 compound treatment 1800.0 524.35 0.4522 1994.0 63.279 0.0513 0.356 0.7823 876 BSPBio_000274 CN(C)[C@H]1[C@@H]2[C@@H](O)[C@H]3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)C(=O)c4c(O)cccc4[C@@]3(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N17 compound treatment 1187.0 -88.651 -0.0765 2178.0 247.28 0.2003 0.0876 0.4085 1075 BSPBio_000275 CCN(Cc1ccncc1)C(=O)C(CO)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N18 compound treatment 1689.0 413.35 0.3565 1696.0 -234.72 -0.1902 0.1176 0.2911 2117626 BSPBio_000276 Fc1ccc(cc1)C(CCCN2CCC(CC2)n3c(=O)[nH]c4ccccc34)c5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N19 compound treatment 1733.0 457.35 0.3944 1899.0 -31.721 -0.0257 0.2607 0.6596 1016 BSPBio_000277 CN1CCOC(c2ccccc2)c3ccccc3C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N20 compound treatment 259.0 -1016.7 -0.8768 240.0 -1690.7 -1.3697 -1.5885 -0.9768 467359 BSPBio_000278 CCN(CC)Cc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N21 compound treatment 1513.0 237.35 0.2047 2002.0 71.279 0.0577 0.1856 0.8725 3046406 BSPBio_000279 Cc1ccc(cc1)N(CC2=NCCN2)c3cccc(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N22 compound treatment 1388.0 112.35 0.0969 1853.0 -77.721 -0.063 0.024 0.2076 714 BSPBio_000280 CCN(CCCCOC(=O)c1ccc(OC)c(OC)c1)C(C)Cc2ccc(OC)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N23 mock treatment 1277.0 1.3492 0.0012 1455.0 -475.72 -0.3854 -0.2717 -0.705 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 N24 mock treatment 83.0 -1192.7 -1.0286 977.0 -953.72 -0.7726 -1.2737 -0.9901 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O01 mock treatment 1916.0 640.35 0.5523 2463.0 532.28 0.4312 0.6954 0.9925 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O02 mock treatment 1732.0 456.35 0.3936 3105.0 1174.3 0.9513 0.951 0.9237 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O03 compound treatment 1936.0 660.35 0.5695 2629.0 698.28 0.5657 0.8027 1.0 1125 BSPBio_000281 CCOC(=O)NNc1nncc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O04 compound treatment 1790.0 514.35 0.4436 2556.0 625.28 0.5065 0.6719 0.9978 935 BSPBio_000282 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O05 compound treatment 1077.0 -198.65 -0.1713 1451.0 -479.72 -0.3886 -0.3959 -0.9323 1174 BSPBio_000283 CN(C)CCCN1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O06 compound treatment 2073.0 797.35 0.6877 2925.0 994.28 0.8055 1.0558 0.9969 3616516 BSPBio_000284 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O07 compound treatment 1980.0 704.35 0.6075 2606.0 675.28 0.5471 0.8164 0.9986 1212 BSPBio_000285 CC/1=C(CC(=O)O)c2cc(F)ccc2\C1=C/c3ccc(cc3)S(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O08 compound treatment 1257.0 -18.651 -0.0161 1686.0 -244.72 -0.1983 -0.1516 -0.762 3616519 BSPBio_000286 CCC(=O)O[C@H]1[C@H](C)O[C@H](C[C@@]1(C)O)O[C@@H]2[C@@H](C)O[C@@H](O[C@H]3[C@@H](CC=O)C[C@@H](C)[C@H](O)/C=C/C=C/C[C@@H](C)OC(=O)C[C@@H](OC(=O)CC)[C@@H]3OC)[C@H](O)[C@H]2N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O09 compound treatment 686.0 -589.65 -0.5085 973.0 -957.72 -0.7759 -0.9082 -0.979 1365 BSPBio_000287 CN(C)CCC=C1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O10 compound treatment 1152.0 -123.65 -0.1066 1414.0 -516.72 -0.4186 -0.3714 -0.8598 3616520 BSPBio_000288 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)(OC(=O)CC(C)C)[C@@H](O)[C@H](C)O3)[C@@H]([C@H]2O)N(C)C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O11 compound treatment 2125.0 849.35 0.7325 1754.0 -176.72 -0.1432 0.4167 0.5583 872 BSPBio_000289 CCN(CC)CCOC(=O)C(c1ccccc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O12 compound treatment 1135.0 -140.65 -0.1213 919.0 -1011.7 -0.8196 -0.6653 -0.803 346 BSPBio_000290 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O13 compound treatment 1485.0 209.35 0.1806 1037.0 -893.72 -0.724 -0.3843 -0.515 969 BSPBio_000291 CCCCOc1cc(C(=O)NCCN(CC)CC)c2ccccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O14 compound treatment 1665.0 389.35 0.3358 1635.0 -295.72 -0.2396 0.068 0.165 3616524 BSPBio_000292 CC[C@H](C)[C@H]1O[C@]2(CC[C@@H]1C)C[C@@H]3C[C@@H](C/C=C(\C)/[C@@H](O[C@H]4C[C@H](OC)[C@@H](O[C@H]5C[C@H](OC)[C@@H](O)[C@H](C)O5)[C@H](C)O4)[C@@H](C)/C=C/C=C/6\CO[C@@H]7[C@H](O)C(=C[C@@H](C(=O)O3)[C@@]76O)C)O2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O15 compound treatment 836.0 -439.65 -0.3792 703.0 -1227.7 -0.9946 -0.9714 -0.9126 2080073 BSPBio_000293 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O16 compound treatment 1705.0 429.35 0.3703 1577.0 -353.72 -0.2866 0.0592 0.1265 1257 BSPBio_000294 CC[N+](CC)(CC)CCOc1cccc(OCC[N+](CC)(CC)CC)c1OCC[N+](CC)(CC)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O17 compound treatment 13.0 -1262.7 -1.089 67.0 -1863.7 -1.5098 -1.8376 -0.9871 731 BSPBio_000295 CSc1ccc2Sc3ccccc3N(CCC4CCCCN4C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O18 compound treatment 1556.0 280.35 0.2418 1545.0 -385.72 -0.3125 -0.05 -0.1265 1000317 BSPBio_000296 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]3O[C@H]4O[C@H](CN)[C@@H](O)[C@H](O)[C@H]4N)O[C@@H]2CO)[C@H](N)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O19 compound treatment 1319.0 43.349 0.0374 1243.0 -687.72 -0.5571 -0.3675 -0.6582 1001312 BSPBio_000297 C[N+]1(C)CCC(=C(c2ccccc2)c3ccccc3)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O20 compound treatment 1189.0 -86.651 -0.0747 1670.0 -260.72 -0.2112 -0.2022 -0.9025 3069047 BSPBio_000298 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)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O21 compound treatment 1034.0 -241.65 -0.2084 1476.0 -454.72 -0.3684 -0.4079 -0.9636 1053 BSPBio_000299 COc1cc(cc(OC)c1OC)C(=O)NCc2ccc(OCCN(C)C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O22 compound treatment 987.0 -288.65 -0.2489 1557.0 -373.72 -0.3028 -0.3901 -0.9953 BSPBio_000300 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O23 mock treatment 905.0 -370.65 -0.3197 838.0 -1092.7 -0.8852 -0.852 -0.9052 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 O24 mock treatment 844.0 -431.65 -0.3723 1410.0 -520.72 -0.4218 -0.5615 -0.9981 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P01 mock treatment 1829.0 553.35 0.4772 2817.0 886.28 0.718 0.8452 0.9803 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P02 mock treatment 1128.0 -147.65 -0.1273 2119.0 188.28 0.1525 0.0178 0.0896 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P03 compound treatment 881.0 -394.65 -0.3404 1339.0 -591.72 -0.4794 -0.5796 -0.9859 805 BSPBio_000301 CCc1cccc2c3CCOC(CC)(CC(=O)O)c3[nH]c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P04 compound treatment 1023.0 -252.65 -0.2179 1445.0 -485.72 -0.3935 -0.4323 -0.9611 3177204 BSPBio_000302 CC(C(O)c1ccc(O)cc1)N2CCC(Cc3ccccc3)CC2.OC(C(O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P05 compound treatment 1570.0 294.35 0.2539 2777.0 846.28 0.6856 0.6643 0.9086 3069144 BSPBio_000303 C[N+]1([O-])[C@H]2C[C@@H](C[C@@H]1[C@H]3O[C@H]32)OC(=O)[C@H](CO)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P06 compound treatment 191.0 -1084.7 -0.9355 378.0 -1552.7 -1.2579 -1.5509 -0.9894 43 BSPBio_000304 Fc1ccc(cc1)C(N2CCN(C/C=C/c3ccccc3)CC2)c4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P07 compound treatment 1807.0 531.35 0.4583 2374.0 443.28 0.3591 0.578 0.9927 3616593 BSPBio_000305 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)[C@H](CO)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P08 compound treatment 63.0 -1212.7 -1.0459 187.0 -1743.7 -1.4126 -1.7384 -0.9891 437 BSPBio_000306 CN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P09 compound treatment 1335.0 59.349 0.0512 2279.0 348.28 0.2821 0.2357 0.822 3487401 BSPBio_000307 NC(=O)OCC(O)COc1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P10 compound treatment 1562.0 286.35 0.247 1713.0 -217.72 -0.1764 0.0499 0.1645 1036 BSPBio_000308 CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P11 compound treatment 1684.0 408.35 0.3522 2001.0 70.279 0.0569 0.2893 0.8109 3189177 BSPBio_000309 CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N=C)c3ccccc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P12 compound treatment 1086.0 -189.65 -0.1636 1456.0 -474.72 -0.3846 -0.3876 -0.9274 3616642 BSPBio_000310 CN(C)[C@@H]1C2CC3Cc4c(ccc(O)c4C(=O)C3=C(O)[C@@]2(O)C(=O)C(=C1O)C(=O)N)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P13 compound treatment 606.0 -669.65 -0.5775 605.0 -1325.7 -1.074 -1.1678 -0.9577 2997 BSPBio_000311 COc1cc(cc(OC)c1OC)C(=O)OCCCN2CCCN(CCCOC(=O)c3cc(OC)c(OC)c(OC)c3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P14 compound treatment 1222.0 -53.651 -0.0463 1579.0 -351.72 -0.2849 -0.2342 -0.8113 74 BSPBio_000312 COc1ccc(Cl)cc1C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC3CCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P15 compound treatment 2033.0 757.35 0.6532 1406.0 -524.72 -0.4251 0.1613 0.207 1323 BSPBio_000313 CC1COc2c(N3CCN(C)CC3)c(F)cc4c(=O)c(cn1c24)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P16 compound treatment 1145.0 -130.65 -0.1127 1899.0 -31.721 -0.0257 -0.0978 -0.8466 3055 BSPBio_000314 NC(=N)NCCN1CCCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P17 compound treatment 1344.0 68.349 0.0589 1663.0 -267.72 -0.2169 -0.1117 -0.4969 999 BSPBio_000315 CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCNC(C)C3)c(F)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P18 compound treatment 1098.0 -177.65 -0.1532 471.0 -1459.7 -1.1825 -0.9445 -0.7921 763 BSPBio_000316 CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc3ccc(OC)cc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P19 compound treatment 1065.0 -210.65 -0.1817 1584.0 -346.72 -0.2809 -0.3271 -0.9778 1443 BSPBio_000317 CN(C)CCOC(c1ccccc1)c2ccccc2C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P20 compound treatment 0.0 -1275.7 -1.1002 0.0 -1930.7 -1.5641 -1.8839 -0.9852 907228 BSPBio_000318 CCCCCCC[N+](CC)(CC)CCCCc1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P21 compound treatment 1256.0 -19.651 -0.0169 1291.0 -639.72 -0.5182 -0.3784 -0.7298 1291 BSPBio_000319 CCCN(CCC)C(=O)C(CCC(=O)O)NC(=O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P22 compound treatment 83.0 -1192.7 -1.0286 221.0 -1709.7 -1.3851 -1.7067 -0.9893 1130 BSPBio_000320 OCCN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P23 mock treatment 942.0 -333.65 -0.2878 1315.0 -615.72 -0.4988 -0.5562 -0.9658 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2453 P24 mock treatment 800.0 -475.65 -0.4102 1334.0 -596.72 -0.4834 -0.6319 -0.9967 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A01 mock treatment 2510.0 435.27 0.3754 6.0 -1680.6 -1.3615 -0.6973 -0.4937 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A02 mock treatment 10.0 -2064.7 -1.7807 1429.0 -257.63 -0.2087 -1.4068 -0.7846 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A03 compound treatment 2185.0 110.27 0.0951 41.0 -1645.6 -1.3331 -0.8754 -0.655 3189183 BSPBio_000321 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A04 compound treatment 36.0 -2038.7 -1.7583 1470.0 -216.63 -0.1755 -1.3674 -0.7738 2717 BSPBio_000322 CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A05 compound treatment 2254.0 179.27 0.1546 32.0 -1654.6 -1.3404 -0.8385 -0.6214 3480229 BSPBio_000323 COc1cc2nc(nc(N)c2cc1OC)N(C)CCCNC(=O)C3CCCO3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A06 compound treatment 81.0 -1993.7 -1.7195 50.0 -1636.6 -1.3259 -2.1534 -0.9917 1403 BSPBio_000324 COC(=O)C1=CCCN(C)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A07 compound treatment 2533.0 458.27 0.3952 2207.0 520.38 0.4216 0.5776 0.9995 1132 BSPBio_000325 CCCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A08 compound treatment 76.0 -1998.7 -1.7238 40.0 -1646.6 -1.334 -2.1622 -0.992 1000219 BSPBio_000326 N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A09 compound treatment 2417.0 342.27 0.2952 2115.0 428.38 0.347 0.4541 0.9968 1001994 BSPBio_000327 C[C@@H](N)[C@@H](O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A10 compound treatment 240.0 -1834.7 -1.5824 52.0 -1634.6 -1.3242 -2.0553 -0.9961 1000243 BSPBio_000328 CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(O)c(C)c(C)c2O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A11 compound treatment 868.0 -1206.7 -1.0408 856.0 -830.63 -0.6729 -1.2117 -0.9777 1000341 BSPBio_000329 OC[C@H](O)[C@H]1OC(=O)C(=C1O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A12 compound treatment 273.0 -1801.7 -1.5539 50.0 -1636.6 -1.3259 -2.0363 -0.9969 387 BSPBio_000330 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A13 compound treatment 1472.0 -602.73 -0.5198 1351.0 -335.63 -0.2719 -0.5598 -0.9543 800 BSPBio_000331 C[C@](N)(Cc1ccc(O)c(O)c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A14 compound treatment 136.0 -1938.7 -1.6721 24.0 -1662.6 -1.3469 -2.1348 -0.9942 3068973 BSPBio_000332 C(CN1CCOCC1)Nc2cc3CCCc4ccccc4-c3nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A15 compound treatment 2073.0 -1.7333 -0.0015 1331.0 -355.63 -0.2881 -0.2048 -0.7108 3063 BSPBio_000333 CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2[C@H]3SCC(=C(N3C2=O)C(=O)O)CSc4nnnn4C)c5ccc(O)cc5)C(=O)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A16 compound treatment 191.0 -1883.7 -1.6246 23.0 -1663.6 -1.3477 -2.1018 -0.9957 1000308 BSPBio_000334 N[C@]1(C[C@@H]2C[C@H]3C[C@@H](C2)C1)C3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A17 compound treatment 2137.0 62.267 0.0537 1520.0 -166.63 -0.135 -0.0575 -0.3956 3173242 BSPBio_000335 Nc1nc2cc(Cl)ccc2o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A18 compound treatment 29.0 -2045.7 -1.7644 8.0 -1678.6 -1.3599 -2.2092 -0.9917 3068976 BSPBio_000336 Clc1ccc(CCC(Cn2ccnc2)Sc3c(Cl)cccc3Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A19 compound treatment 1849.0 -225.73 -0.1947 1416.0 -270.63 -0.2192 -0.2927 -0.9982 1516 BSPBio_000337 Nc1c2CCCCc2nc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A20 compound treatment 42.0 -2032.7 -1.7531 2.0 -1684.6 -1.3647 -2.2047 -0.9923 26 BSPBio_000338 CCCCc1oc2ccccc2c1C(=O)c3cc(I)c(OCCN(CC)CC)c(I)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A21 compound treatment 1086.0 -988.73 -0.8527 1209.0 -477.63 -0.3869 -0.8766 -0.9361 3487402 BSPBio_000339 CC(C)NCC(O)COc1ccc(COCCOC(C)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A22 compound treatment 147.0 -1927.7 -1.6626 12.0 -1674.6 -1.3566 -2.1349 -0.9949 3616687 BSPBio_000340 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=C\C=C\C=C\C=C\C=C\C=C\C=C2)[C@@H](O)[C@@H](N)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A23 mock treatment 1409.0 -665.73 -0.5742 597.0 -1089.6 -0.8827 -1.0302 -0.9783 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 A24 mock treatment 225.0 -1849.7 -1.5953 16.0 -1670.6 -1.3534 -2.0851 -0.9967 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B01 mock treatment 3313.0 1238.3 1.068 1193.0 -493.63 -0.3999 0.4724 0.4142 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B02 mock treatment 2410.0 335.27 0.2892 147.0 -1539.6 -1.2473 -0.6775 -0.5291 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B03 compound treatment 2380.0 305.27 0.2633 531.0 -1155.6 -0.9362 -0.4758 -0.4893 429 BSPBio_000341 NCCc1c[nH]c2ccc(O)cc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B04 compound treatment 2258.0 183.27 0.1581 475.0 -1211.6 -0.9816 -0.5823 -0.5857 3189566 BSPBio_000342 COc1cc2CC[N+](C)(C)[C@@H]3Cc4ccc(O)c(Oc5cc6[C@H](Cc7cccc(Oc(c1O)c32)c7)N(C)CCc6cc5OC)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B05 compound treatment 2766.0 691.27 0.5962 988.0 -698.63 -0.566 0.0214 0.026 1000242 BSPBio_000343 CN(C)CCn1nnnc1SCC2=C(N3[C@H](SC2)[C@H](NC(=O)Cc4csc(N)n4)C3=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B06 compound treatment 1836.0 -238.73 -0.2059 102.0 -1584.6 -1.2837 -1.0533 -0.8102 907285 BSPBio_000344 CC(C)[C@@]1(NC(=O)[C@@H]2C[C@H]3[C@@H](Cc4c[nH]c5cccc3c45)N(C)C2)O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@H](Cc8ccccc8)N6C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B07 compound treatment 3453.0 1378.3 1.1887 314.0 -1372.6 -1.112 0.0542 0.0333 3189438 BSPBio_000345 Cc1n[nH]c(=O)[nH]c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B08 compound treatment 1877.0 -197.73 -0.1705 580.0 -1106.6 -0.8965 -0.7545 -0.8268 961 BSPBio_000346 COc1ccc2[C@H](OC(=O)c2c1OC)[C@@H]3N(C)CCc4cc5OCOc5c(OC)c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B09 compound treatment 2262.0 187.27 0.1615 27.0 -1659.6 -1.3445 -0.8365 -0.6177 1077918 BSPBio_000347 Fc1ccc(cc1)C(=O)CCCN2CCC(CC2)n3c(=O)[nH]c4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B10 compound treatment 1645.0 -429.73 -0.3706 153.0 -1533.6 -1.2424 -1.1406 -0.8797 3616747 BSPBio_000348 CCOC(=O)Oc1c(OC)cc(cc1OC)C(=O)O[C@@H]2C[C@@H]3CN4CCc5c([nH]c6cc(OC)ccc56)[C@H]4C[C@@H]3[C@@H]([C@H]2OC)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B11 compound treatment 2881.0 806.27 0.6954 1129.0 -557.63 -0.4517 0.1723 0.2078 3173761 BSPBio_000349 N[C@@H](C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)Cl)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B12 compound treatment 2399.0 324.27 0.2797 210.0 -1476.6 -1.1962 -0.6481 -0.5276 1000124 BSPBio_000350 CN1C2CCC1CC(C2)OC(=O)C(CO)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B13 compound treatment 2764.0 689.27 0.5945 11.0 -1675.6 -1.3574 -0.5395 -0.3641 3189439 BSPBio_000351 CC(C)CCCCC(=O)N[C@H](CCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CCN)C(=O)N[C@@H]1CCNC(=O)[C@@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC(=O)[C@@H](CNC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CCN)NC1=O)C(C)C)[C@@H](C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B14 compound treatment 2296.0 221.27 0.1908 775.0 -911.63 -0.7385 -0.3873 -0.5077 976 BSPBio_000352 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B15 compound treatment 56.0 -2018.7 -1.7411 0.0 -1686.6 -1.3664 -2.1973 -0.9928 3587 BSPBio_000353 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)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B16 compound treatment 2095.0 20.267 0.0175 39.0 -1647.6 -1.3348 -0.9315 -0.6978 3189567 BSPBio_000354 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)[C@H]6OC)[C@H](C[C@H]2O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B17 compound treatment 1261.0 -813.73 -0.7018 1.0 -1685.6 -1.3655 -1.4618 -0.9521 3616733 BSPBio_000355 CN(C)CC/C=C/1\c2ccccc2CSc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B18 compound treatment 510.0 -1564.7 -1.3495 1.0 -1685.6 -1.3655 -1.9198 -1.0 3141 BSPBio_000356 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B19 compound treatment 2294.0 219.27 0.1891 446.0 -1240.6 -1.005 -0.577 -0.5642 3616734 BSPBio_000357 CC(C)(O/N=C(\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)C[n+]3ccccc3)/c4csc(N)n4)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B20 compound treatment 1221.0 -853.73 -0.7363 9.0 -1677.6 -1.3591 -1.4817 -0.9586 BSPBio_000358 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B21 compound treatment 611.0 -1463.7 -1.2624 2.0 -1684.6 -1.3647 -1.8577 -0.9992 3060173 BSPBio_000359 NC(=N)NCc1cccc(I)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B22 compound treatment 9.0 -2065.7 -1.7816 0.0 -1686.6 -1.3664 -2.2259 -0.9914 2081037 BSPBio_000360 CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]4NCCc5cc(OC)c(OC)cc45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B23 mock treatment 1584.0 -490.73 -0.4232 7.0 -1679.6 -1.3607 -1.2614 -0.8852 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 B24 mock treatment 623.0 -1451.7 -1.2521 469.0 -1217.6 -0.9864 -1.5828 -0.993 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C01 mock treatment 3408.0 1333.3 1.1499 2806.0 1119.4 0.9068 1.4543 0.9931 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C02 mock treatment 2749.0 674.27 0.5815 2186.0 499.38 0.4046 0.6973 0.9843 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C03 compound treatment 3260.0 1185.3 1.0222 2750.0 1063.4 0.8615 1.332 0.9964 907527 BSPBio_000361 C(C#CCN1CCCC1)N2CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C04 compound treatment 2292.0 217.27 0.1874 2160.0 473.38 0.3835 0.4037 0.9458 3189308 BSPBio_000362 C[C@@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC[C@@]43C)[C@@H]2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C05 compound treatment 1890.0 -184.73 -0.1593 2720.0 1033.4 0.8372 0.4793 0.5624 1486 BSPBio_000363 CC(C)NCC(O)COc1ccc(NC(=O)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C06 compound treatment 11.0 -2063.7 -1.7799 7.0 -1679.6 -1.3607 -2.2207 -0.9912 336 BSPBio_000364 COc1ccc(C[C@H]2NC[C@H](O)[C@H]2OC(=O)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C07 compound treatment 2600.0 525.27 0.453 2671.0 984.38 0.7975 0.8842 0.9641 1142 BSPBio_000365 Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)[nH]c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C08 compound treatment 2202.0 127.27 0.1098 2574.0 887.38 0.7189 0.5859 0.8057 1023517 BSPBio_000366 NC(=O)Nc1ccc(cc1)[As](=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C09 compound treatment 2973.0 898.27 0.7747 2701.0 1014.4 0.8218 1.1289 0.9996 1192 BSPBio_000367 Cc1noc(NS(=O)(=O)c2ccc(N)cc2)c1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C10 compound treatment 2320.0 245.27 0.2115 2168.0 481.38 0.39 0.4253 0.9587 360 BSPBio_000368 Oc1ccc(cc1)c2cc(=O)c3c(O)cc(O)cc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C11 compound treatment 2311.0 236.27 0.2038 2639.0 952.38 0.7715 0.6896 0.8642 3068881 BSPBio_000369 CCCOc1ccccc1c2nc(=O)c3[nH]nnc3[nH]2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C12 compound treatment 2338.0 263.27 0.2271 2858.0 1171.4 0.9489 0.8316 0.8522 2060483 BSPBio_000370 CC(=O)N[C@@H](CC(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C13 compound treatment 2598.0 523.27 0.4513 2143.0 456.38 0.3697 0.5805 0.9951 1471 BSPBio_000371 CN1C(c2ccc(Cl)cc2)S(=O)(=O)CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C14 compound treatment 1923.0 -151.73 -0.1309 1785.0 98.375 0.0797 -0.0362 -0.2361 3189309 BSPBio_000372 CCOC(=O)OC(C)OC(=O)[C@@H]1N2[C@H](SC1(C)C)[C@H](NC(=O)[C@H](N)c3ccccc3)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C15 compound treatment 2311.0 236.27 0.2038 1771.0 84.375 0.0684 0.1924 0.8953 2431 BSPBio_000373 CCN(CC)CCNC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C16 compound treatment 2240.0 165.27 0.1425 1836.0 149.38 0.121 0.1864 0.9967 1960 BSPBio_000374 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C17 compound treatment 2480.0 405.27 0.3495 2306.0 619.38 0.5018 0.602 0.9844 3189186 BSPBio_000375 CNc1ncnc2n(cnc12)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C18 compound treatment 1886.0 -188.73 -0.1628 1676.0 -10.625 -0.0086 -0.1212 -0.7435 951 BSPBio_000376 OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C19 compound treatment 1689.0 -385.73 -0.3327 1210.0 -476.63 -0.3861 -0.5083 -0.9972 3368 BSPBio_000377 NC(=N)NC(=O)Cc1c(Cl)cccc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C20 compound treatment 1241.0 -833.73 -0.7191 1575.0 -111.63 -0.0904 -0.5724 -0.7898 982 BSPBio_000378 CC(=O)Oc1ccc(cc1)C(c2ccc(OC(=O)C)cc2)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C21 compound treatment 684.0 -1390.7 -1.1995 589.0 -1097.6 -0.8892 -1.4769 -0.9891 1001939 BSPBio_000379 OCCN1CCN(CC/C=C\2/c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C22 compound treatment 1238.0 -836.73 -0.7216 1386.0 -300.63 -0.2435 -0.6825 -0.8961 3557442 BSPBio_000380 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C23 mock treatment 605.0 -1469.7 -1.2676 1598.0 -88.625 -0.0718 -0.9471 -0.746 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 C24 mock treatment 1284.0 -790.73 -0.682 1105.0 -581.63 -0.4712 -0.8154 -0.9837 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D01 mock treatment 3243.0 1168.3 1.0076 2597.0 910.38 0.7375 1.234 0.9882 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D02 mock treatment 2542.0 467.27 0.403 2443.0 756.38 0.6127 0.7182 0.9793 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D03 compound treatment 414.0 -1660.7 -1.4323 285.0 -1401.6 -1.1355 -1.8157 -0.9934 2120971 BSPBio_000381 CN1CCCC(CC2c3ccccc3Sc4ccccc24)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D04 compound treatment 2662.0 587.27 0.5065 2274.0 587.38 0.4758 0.6946 0.9995 1218 BSPBio_000382 CCCCNc1ccc(cc1)C(=O)OCCN(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D05 compound treatment 2671.0 596.27 0.5143 2786.0 1099.4 0.8906 0.9934 0.9659 3172716 BSPBio_000383 NC(=O)N/N=C/c1ccc(o1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D06 compound treatment 251.0 -1823.7 -1.5729 105.0 -1581.6 -1.2813 -2.0182 -0.9948 1000293 BSPBio_000384 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(OC(=O)c5ccco5)C(=O)CCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D07 compound treatment 3665.0 1590.3 1.3715 2850.0 1163.4 0.9425 1.6362 0.9832 1782 BSPBio_000385 COc1ccc2[nH]c(nc2c1)S(=O)Cc3ncc(C)c(OC)c3C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D08 compound treatment 3136.0 1061.3 0.9153 2645.0 958.38 0.7764 1.1962 0.9966 3198963 BSPBio_000386 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D09 compound treatment 3932.0 1857.3 1.6018 3000.0 1313.4 1.064 1.885 0.9802 912 BSPBio_000387 CCCc1cc(=O)[nH]c(=S)[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D10 compound treatment 2651.0 576.27 0.497 2863.0 1176.4 0.953 1.0253 0.9539 964 BSPBio_000388 CN(C)N=Nc1[nH]cnc1C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D11 compound treatment 2763.0 688.27 0.5936 2313.0 626.38 0.5074 0.7786 0.997 3616735 BSPBio_000389 CC(C)N1CCN(CC1)c2ccc(OC[C@H]3CO[C@@](Cn4cncn4)(O3)c5ccc(Cl)cc5Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D12 compound treatment 2580.0 505.27 0.4358 2444.0 757.38 0.6136 0.742 0.9859 3616748 BSPBio_000390 CC(C)[N+]1(C)[C@@H]2CC[C@@H]1CC(C2)OC(=O)C(CO)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D13 compound treatment 3251.0 1176.3 1.0145 2934.0 1247.4 1.0105 1.4319 1.0 3487464 BSPBio_000391 CC(C(=O)O)c1ccc(s1)C(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D14 compound treatment 2297.0 222.27 0.1917 2019.0 332.38 0.2693 0.3259 0.9861 1092107 BSPBio_000392 CN(C)CCCN1c2ccccc2Sc3ccc(cc13)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D15 compound treatment 3132.0 1057.3 0.9118 2209.0 522.38 0.4232 0.944 0.9391 BSPBio_000393 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D16 compound treatment 2266.0 191.27 0.165 1950.0 263.38 0.2134 0.2675 0.9919 1000115 BSPBio_000394 COC(=O)[C@@H]1[C@@H](O)CC[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D17 compound treatment 2202.0 127.27 0.1098 2528.0 841.38 0.6816 0.5596 0.8105 1263 BSPBio_000395 C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D18 compound treatment 2398.0 323.27 0.2788 1975.0 288.38 0.2336 0.3623 0.9961 450 BSPBio_000396 COC(=O)[C@@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D19 compound treatment 273.0 -1801.7 -1.5539 283.0 -1403.6 -1.1371 -1.9028 -0.9882 1489 BSPBio_000397 CCCNCC(O)COc1ccccc1C(=O)CCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D20 compound treatment 103.0 -1971.7 -1.7005 86.0 -1600.6 -1.2967 -2.1194 -0.991 1084508 BSPBio_000398 COc1ccc2cc3-c4cc(OC)c(OC)cc4CC[n+]3cc2c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D21 compound treatment 2281.0 206.27 0.1779 1918.0 231.38 0.1874 0.2583 0.9997 1113307 BSPBio_000399 CCN(CC)C(=O)c1ccc(O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D22 compound treatment 1691.0 -383.73 -0.331 1559.0 -127.63 -0.1034 -0.3071 -0.8858 3616749 BSPBio_000400 COc1cc2CC[C@H](N)c3cc(=O)c(O)ccc3-c2c(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D23 mock treatment 1764.0 -310.73 -0.268 1698.0 11.375 0.0092 -0.183 -0.6824 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 D24 mock treatment 1400.0 -674.73 -0.5819 1200.0 -486.63 -0.3942 -0.6902 -0.982 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E01 mock treatment 2548.0 473.27 0.4082 1900.0 213.38 0.1729 0.4109 0.9269 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E02 mock treatment 2048.0 -26.733 -0.0231 1217.0 -469.63 -0.3804 -0.2853 -0.7486 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E03 compound treatment 2329.0 254.27 0.2193 2279.0 592.38 0.4799 0.4944 0.937 1188 BSPBio_000401 NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccco2)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E04 compound treatment 22.0 -2052.7 -1.7704 0.0 -1686.6 -1.3664 -2.218 -0.9918 3616694 BSPBio_000402 CCCCCCCCN[C@H](C)[C@@H](O)c1ccc(SC(C)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E05 compound treatment 2365.0 290.27 0.2503 2034.0 347.38 0.2814 0.376 0.9983 1510 BSPBio_000403 CN(C)CCN(Cc1cccs1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E06 compound treatment 2561.0 486.27 0.4194 1780.0 93.375 0.0756 0.35 0.8214 3069011 BSPBio_000404 NCCC(=O)NCCc1c[nH]cn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E07 compound treatment 895.0 -1179.7 -1.0175 950.0 -736.63 -0.5968 -1.1414 -0.9677 844 BSPBio_000405 CNCCCN1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E08 compound treatment 2759.0 684.27 0.5902 1536.0 -150.63 -0.122 0.331 0.5493 1409 BSPBio_000406 CCCC(C)(COC(=O)N)COC(=O)NC(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E09 compound treatment 1815.0 -259.73 -0.224 1087.0 -599.63 -0.4858 -0.5019 -0.9382 2203 BSPBio_000407 CN(CCCOc1ccc(Cl)cc1Cl)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E10 compound treatment 2492.0 417.27 0.3599 1470.0 -216.63 -0.1755 0.1304 0.3256 3189311 BSPBio_000408 CC(=O)OCC1=C(N2[C@H](SC1)[C@H](N)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E11 compound treatment 1874.0 -200.73 -0.1731 1520.0 -166.63 -0.135 -0.2179 -0.9924 1390 BSPBio_000409 CC(C)(C)NCC(O)c1cc(Cl)c(N)c(Cl)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E12 compound treatment 2139.0 64.267 0.0554 1615.0 -71.625 -0.058 -0.0018 -0.0229 2117409 BSPBio_000410 COc1cc(ccc1N=Nc2ccc3c(cc(c(N)c3c2O)S(=O)(=O)O)S(=O)(=O)O)c4ccc(N=Nc5ccc6c(cc(c(N)c6c5O)S(=O)(=O)O)S(=O)(=O)O)c(OC)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E13 compound treatment 639.0 -1435.7 -1.2383 626.0 -1060.6 -0.8592 -1.4831 -0.9841 1000329 BSPBio_000411 CNCCC[C@]1(CC[C@H]2c3ccccc31)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E14 compound treatment 1641.0 -433.73 -0.3741 1496.0 -190.63 -0.1544 -0.3737 -0.9234 907205 BSPBio_000412 COc1cc(OC)c(C(=O)CCCN2CCCC2)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E15 compound treatment 46.0 -2028.7 -1.7497 10.0 -1676.6 -1.3583 -2.1977 -0.9922 3189187 BSPBio_000413 Nc1nc(S)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E16 compound treatment 2051.0 -23.733 -0.0205 1435.0 -251.63 -0.2038 -0.1586 -0.7742 3173763 BSPBio_000414 O[C@@H]1C[C@](O)(C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E17 compound treatment 151.0 -1923.7 -1.6591 289.0 -1397.6 -1.1322 -1.9738 -0.9826 801 BSPBio_000415 CN(C)CC/C=C/1\c2ccccc2Sc3ccc(Cl)cc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E18 compound treatment 0.0 -2074.7 -1.7894 2.0 -1684.6 -1.3647 -2.2303 -0.9911 3180147 BSPBio_000416 CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]4NCCc5cc(O)c(OC)cc45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E19 compound treatment 1638.0 -436.73 -0.3767 2016.0 329.38 0.2668 -0.0777 -0.1682 1000292 BSPBio_000417 C[C@H](NCCc1ccc(O)cc1)[C@H](O)c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E20 compound treatment 1960.0 -114.73 -0.099 1082.0 -604.63 -0.4898 -0.4163 -0.8331 2838 BSPBio_000418 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E21 compound treatment 1145.0 -929.73 -0.8019 1027.0 -659.63 -0.5344 -0.9449 -0.9805 417 BSPBio_000419 CN1CCN(CC1)C2=Nc3cc(Cl)ccc3Nc4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E22 compound treatment 1001.0 -1073.7 -0.9261 865.0 -821.63 -0.6656 -1.1255 -0.9869 3616697 BSPBio_000420 CO[C@@H]1CN(CCCOc2ccc(F)cc2)CC[C@@H]1NC(=O)c3cc(Cl)c(N)cc3OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E23 mock treatment 1247.0 -827.73 -0.7139 1145.0 -541.63 -0.4388 -0.8151 -0.9727 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 E24 mock treatment 949.0 -1125.7 -0.9709 723.0 -963.63 -0.7806 -1.2385 -0.9942 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F01 mock treatment 1692.0 -382.73 -0.3301 1211.0 -475.63 -0.3853 -0.5059 -0.997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F02 mock treatment 10.0 -2064.7 -1.7807 23.0 -1663.6 -1.3477 -2.2122 -0.9906 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F03 compound treatment 2813.0 738.27 0.6367 2592.0 905.38 0.7335 0.9689 0.9975 1002022 BSPBio_000421 NC(CCC(=O)O)C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F04 compound treatment 2061.0 -13.733 -0.0118 852.0 -834.63 -0.6761 -0.4865 -0.7194 3180327 BSPBio_000422 COc1ccc2[C@H](OC(=O)c2c1OC)[C@@H]3N(C)CCc4cc5OCOc5cc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F05 compound treatment 1672.0 -402.73 -0.3473 159.0 -1527.6 -1.2375 -1.1207 -0.8719 3616738 BSPBio_000423 OC(CCN1CCCCC1)(C2C[C@H]3C[C@@H]2C=C3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F06 compound treatment 346.0 -1728.7 -1.491 1028.0 -658.63 -0.5336 -1.4316 -0.904 1054667 BSPBio_000424 CN1C(CC(O)c2ccccc2)CCCC1CC(O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F07 compound treatment 2407.0 332.27 0.2866 2019.0 332.38 0.2693 0.393 0.9995 3487465 BSPBio_000425 OC(=O)COCCN1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F08 compound treatment 6.0 -2068.7 -1.7842 25.0 -1661.6 -1.3461 -2.2135 -0.9903 959 BSPBio_000426 COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F09 compound treatment 2234.0 159.27 0.1374 1968.0 281.38 0.2279 0.2583 0.9706 3189442 BSPBio_000427 CCc1cccc(CC)c1NC(=O)CN(CC(=O)O)CC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F10 compound treatment 2003.0 -71.733 -0.0619 106.0 -1580.6 -1.2805 -0.9492 -0.7404 3000363 BSPBio_000428 COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F11 compound treatment 2353.0 278.27 0.24 2477.0 790.38 0.6403 0.6225 0.9103 1252 BSPBio_000429 CC(C)NCC(O)c1cc(O)cc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F12 compound treatment 328.0 -1746.7 -1.5065 2207.0 520.38 0.4216 -0.7672 -0.4904 3061052 BSPBio_000430 CN1[C@H](C[C@H](O)c2ccccc2)CCC[C@@H]1CC(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F13 compound treatment 2554.0 479.27 0.4133 2514.0 827.38 0.6703 0.7662 0.973 3616739 BSPBio_000431 CN[C@H]1[C@@H](O)[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](OC3OC(=CCC3N)CN)[C@@H]2O)OC[C@@]1(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F14 compound treatment 7.0 -2067.7 -1.7833 8.0 -1678.6 -1.3599 -2.2226 -0.991 909 BSPBio_000432 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F15 compound treatment 2030.0 -44.733 -0.0386 1402.0 -284.63 -0.2306 -0.1903 -0.8141 353 BSPBio_000433 Oc1cc(O)c2c(=O)c(O)c(oc2c1)c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F16 compound treatment 244.0 -1830.7 -1.5789 180.0 -1506.6 -1.2205 -1.9795 -0.9919 3189572 BSPBio_000434 CN1Cc2c3OCOc3ccc2[C@H]4[C@@H](O)Cc5cc6OCOc6cc5[C@H]41 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F17 compound treatment 359.0 -1715.7 -1.4797 709.0 -977.63 -0.792 -1.6064 -0.9571 2269 BSPBio_000435 Oc1ccc(/C=C/c2cc(O)cc(O)c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F18 compound treatment 2381.0 306.27 0.2641 313.0 -1373.6 -1.1128 -0.6001 -0.5247 1202 BSPBio_000436 COc1ccc2CN(C)CC[C@]34C=C[C@H](O)C[C@@H]4Oc1c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F19 compound treatment 1618.0 -456.73 -0.3939 1496.0 -190.63 -0.1544 -0.3877 -0.9164 2922 BSPBio_000437 OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c3ccc(Br)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F20 compound treatment 2020.0 -54.733 -0.0472 2455.0 768.38 0.6225 0.4068 0.6516 1220 BSPBio_000438 CN1CCc2cc3OCOc3cc2[C@H]1[C@@H]4OC(=O)c5c6OCOc6ccc45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F21 compound treatment 26.0 -2048.7 -1.7669 1931.0 244.38 0.198 -1.1094 -0.624 1000807 BSPBio_000439 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F22 compound treatment 1213.0 -861.73 -0.7432 443.0 -1243.6 -1.0075 -1.2379 -0.9888 3173993 BSPBio_000440 O[C@H]1CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F23 mock treatment 1341.0 -733.73 -0.6328 1415.0 -271.63 -0.22 -0.6031 -0.9001 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 F24 mock treatment 1182.0 -892.73 -0.7699 1123.0 -563.63 -0.4566 -0.8673 -0.9689 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G01 mock treatment 1957.0 -117.73 -0.1015 1667.0 -19.625 -0.0159 -0.083 -0.808 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G02 mock treatment 1636.0 -438.73 -0.3784 1416.0 -270.63 -0.2192 -0.4226 -0.9663 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G03 compound treatment 1855.0 -219.73 -0.1895 1698.0 11.375 0.0092 -0.1275 -0.6719 1332 BSPBio_000441 NS(=O)(=O)c1cc(ccc1Cl)C2(O)NC(=O)c3ccccc32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G04 compound treatment 325.0 -1749.7 -1.5091 111.0 -1575.6 -1.2764 -1.9697 -0.9965 1055132 BSPBio_000442 COc1cc2cc[n+]3c(C)c4cc(OC)c(OC)cc4cc3c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G05 compound treatment 1335.0 -739.73 -0.638 593.0 -1093.6 -0.886 -1.0776 -0.987 3480458 BSPBio_000443 CC(CCc1ccc(O)cc1)NCCc2ccc(O)c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G06 compound treatment 512.0 -1562.7 -1.3478 415.0 -1271.6 -1.0302 -1.6815 -0.9912 3054850 BSPBio_000444 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G07 compound treatment 2392.0 317.27 0.2736 1566.0 -120.63 -0.0977 0.1244 0.4281 1048 BSPBio_000445 CCn1cc(C(=O)O)c(=O)c2cc(F)c(nc12)N3CCNCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G08 compound treatment 1637.0 -437.73 -0.3775 1200.0 -486.63 -0.3942 -0.5457 -0.9998 BSPBio_000446 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G09 compound treatment 2036.0 -38.733 -0.0334 1609.0 -77.625 -0.0629 -0.0681 -0.9562 3616658 BSPBio_000447 C[C@H]1CCC[C@@H](C)N1NC(=O)c2ccc(Cl)c(c2)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G10 compound treatment 1512.0 -562.73 -0.4853 1327.0 -359.63 -0.2913 -0.5492 -0.9702 1037 BSPBio_000448 CC1=C(N2[C@H](SC1)[C@H](NC(=O)[C@H](N)c3ccc(O)cc3)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G11 compound treatment 49.0 -2025.7 -1.7471 30.0 -1656.6 -1.3421 -2.1844 -0.9915 1105 BSPBio_000449 CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G12 compound treatment 595.0 -1479.7 -1.2762 379.0 -1307.6 -1.0593 -1.6515 -0.9957 3069049 BSPBio_000450 CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C/C=C/C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G13 compound treatment 2051.0 -23.733 -0.0205 1850.0 163.38 0.1324 0.0791 0.5907 3068883 BSPBio_000451 Nc1ncnc2n(cnc12)[C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G14 compound treatment 1662.0 -412.73 -0.356 1065.0 -621.63 -0.5036 -0.6078 -0.9856 3189314 BSPBio_000452 C[C@@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@@]43C)[C@@]2(O)CC[C@@H]1C5=CC(=O)OC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G15 compound treatment 2146.0 71.267 0.0615 1431.0 -255.63 -0.2071 -0.103 -0.4767 3189189 BSPBio_000453 CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccc(O)cc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G16 compound treatment 2030.0 -44.733 -0.0386 1239.0 -447.63 -0.3626 -0.2837 -0.7779 3189315 BSPBio_000454 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]5C[C@@H](O)[C@]7(C)[C@H](CC[C@]67O)C8=CC(=O)OC8)C4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G17 compound treatment 1879.0 -195.73 -0.1688 1667.0 -19.625 -0.0159 -0.1306 -0.7703 1000342 BSPBio_000455 CC1=C(N2[C@H](SC1)[C@H](NC(=O)[C@H](N)c3ccccc3)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G18 compound treatment 21.0 -2053.7 -1.7713 11.0 -1675.6 -1.3574 -2.2123 -0.9914 1000279 BSPBio_000456 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G19 compound treatment 1128.0 -946.73 -0.8165 915.0 -771.63 -0.6251 -1.0194 -0.9913 1000343 BSPBio_000457 COc1ccc2C[C@H]3[C@H]4CCCC[C@@]4(CCN3C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G20 compound treatment 1347.0 -727.73 -0.6276 854.0 -832.63 -0.6745 -0.9208 -0.9994 3069053 BSPBio_000458 CCOC(=O)n1ccn(C)c1=S 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G21 compound treatment 460.0 -1614.7 -1.3926 252.0 -1434.6 -1.1622 -1.8066 -0.996 764 BSPBio_000459 Fc1ccc(cc1)C(=O)CCCN2CCC(=CC2)n3c(=O)[nH]c4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G22 compound treatment 115.0 -1959.7 -1.6902 224.0 -1462.6 -1.1849 -2.033 -0.9849 1001924 BSPBio_000460 C[C@@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@@]43C)[C@@H]2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G23 mock treatment 1103.0 -971.73 -0.8381 1175.0 -511.63 -0.4145 -0.8857 -0.9473 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 G24 mock treatment 956.0 -1118.7 -0.9649 755.0 -931.63 -0.7547 -1.2159 -0.9926 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H01 mock treatment 3071.0 996.27 0.8592 2617.0 930.38 0.7537 1.1405 0.9979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H02 mock treatment 3296.0 1221.3 1.0533 2552.0 865.38 0.7011 1.2405 0.9804 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H03 compound treatment 2009.0 -65.733 -0.0567 1133.0 -553.63 -0.4485 -0.3572 -0.7902 1095093 BSPBio_000461 CNCCC(Oc1ccc(cc1)C(F)(F)F)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H04 compound treatment 2666.0 591.27 0.5099 2266.0 579.38 0.4694 0.6925 0.9991 1000946 BSPBio_000462 COc1ccc(CC2N(C)CCc3cc(OC)c(OC)cc23)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H05 compound treatment 3391.0 1316.3 1.1352 2748.0 1061.4 0.8598 1.4107 0.9906 2141046 BSPBio_000463 CC(=O)N(CC(O)CO)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H06 compound treatment 1640.0 -434.73 -0.3749 1264.0 -422.63 -0.3424 -0.5072 -0.999 3054974 BSPBio_000464 COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]21 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H07 compound treatment 1352.0 -722.73 -0.6233 783.0 -903.63 -0.732 -0.9584 -0.9968 3068692 BSPBio_000465 CNCCC=C1c2ccccc2C=Cc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H08 compound treatment 3431.0 1356.3 1.1697 2865.0 1178.4 0.9546 1.5021 0.9949 4895 BSPBio_000466 C[n+]1cccc(c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H09 compound treatment 4039.0 1964.3 1.6941 3204.0 1517.4 1.2292 2.0671 0.9876 889 BSPBio_000467 NC(=O)c1cnccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H10 compound treatment 3096.0 1021.3 0.8808 2718.0 1031.4 0.8355 1.2136 0.9997 915 BSPBio_000468 OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H11 compound treatment 3173.0 1098.3 0.9472 2849.0 1162.4 0.9417 1.3356 1.0 2900 BSPBio_000469 CN1C(=O)OC(C)(C)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H12 compound treatment 3745.0 1670.3 1.4405 2697.0 1010.4 0.8185 1.5974 0.9641 3616751 BSPBio_000470 CN1CC[C@]23[C@@H]4Nc5ccccc5[C@]3(CCN4C)[C@@H]1Nc6ccccc62 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H13 compound treatment 2696.0 621.27 0.5358 1341.0 -345.63 -0.28 0.1809 0.2992 1607 BSPBio_000471 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H14 compound treatment 2808.0 733.27 0.6324 2165.0 478.38 0.3875 0.7212 0.9724 3616752 BSPBio_000472 COc1ccc(cc1OC)C(=O)OC2C[C@H]3CC[C@H](C2)N3C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H15 compound treatment 2943.0 868.27 0.7488 2326.0 639.38 0.518 0.8958 0.9838 3616740 BSPBio_000473 C[C@H]1O[C@@H](OC/2CC(O)C(C(O)CC(=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(=O)O)[C@@H](O)[C@@H](N)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H16 compound treatment 3087.0 1012.3 0.873 2326.0 639.38 0.518 0.9836 0.9689 2060325 BSPBio_000474 COc1ccc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(c34)-c2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H17 compound treatment 405.0 -1669.7 -1.4401 362.0 -1324.6 -1.0731 -1.7771 -0.9895 3060147 BSPBio_000475 CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H18 compound treatment 2283.0 208.27 0.1796 2228.0 541.38 0.4386 0.4371 0.9223 1076 BSPBio_000476 Cc1cccc(C)c1NC2=NCCCS2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H19 compound treatment 2535.0 460.27 0.397 2035.0 348.38 0.2822 0.4803 0.986 3068724 BSPBio_000477 C[C@@H](O)[C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)SCCNC=N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H20 compound treatment 1611.0 -463.73 -0.4 1582.0 -104.63 -0.0848 -0.3427 -0.8383 3179848 BSPBio_000478 C/C=C\1/CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@H]32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H21 compound treatment 2056.0 -18.733 -0.0162 1783.0 96.375 0.0781 0.0438 0.5491 1448 BSPBio_000479 OC(=O)c1cc(N=Nc2ccc(cc2)S(=O)(=O)Nc3ccccn3)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H22 compound treatment 1683.0 -391.73 -0.3379 1641.0 -45.625 -0.037 -0.265 -0.7798 1001889 BSPBio_000480 COc1cc-2c(C[C@@H]3N(C)CCc4cc(O)c(OC)c2c34)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H23 mock treatment 1951.0 -123.73 -0.1067 2289.0 602.38 0.488 0.2696 0.5397 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 H24 mock treatment 300.0 -1774.7 -1.5306 1208.0 -478.63 -0.3877 -1.3565 -0.8591 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I01 mock treatment 3071.0 996.27 0.8592 2762.0 1075.4 0.8712 1.2236 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I02 mock treatment 3065.0 990.27 0.8541 2726.0 1039.4 0.842 1.1993 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I03 compound treatment 2918.0 843.27 0.7273 2710.0 1023.4 0.8291 1.1005 0.9979 3189191 BSPBio_000481 CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I04 compound treatment 2887.0 812.27 0.7005 1932.0 245.38 0.1988 0.6359 0.8733 386 BSPBio_000482 C[C@@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]2CC[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I05 compound treatment 351.0 -1723.7 -1.4866 360.0 -1326.6 -1.0747 -1.8112 -0.9873 3068885 BSPBio_000483 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I06 compound treatment 3141.0 1066.3 0.9196 2853.0 1166.4 0.9449 1.3184 0.9999 2078 BSPBio_000484 CCCCc1ccc(nc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I07 compound treatment 433.0 -1641.7 -1.4159 222.0 -1464.6 -1.1865 -1.8402 -0.9961 1352 BSPBio_000485 COc1cc2CC[C@H](NC(=O)C)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I08 compound treatment 3593.0 1518.3 1.3094 2571.0 884.38 0.7164 1.4325 0.9597 907497 BSPBio_000486 COc1ccc(cc1)c2ccc(N)[n+](CCCC(=O)O)n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I09 compound treatment 471.0 -1603.7 -1.3832 223.0 -1463.6 -1.1857 -1.8165 -0.9971 3177235 BSPBio_000487 CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@H]3[C@H]1Cc4cn(C)c5cccc3c45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I10 compound treatment 3438.0 1363.3 1.1758 2651.0 964.38 0.7813 1.3838 0.9803 3616701 BSPBio_000488 C[C@@H]1C(=O)O[C@H]2CC34[C@H]5C[C@@H](C(C)(C)C)[C@@]46[C@@H](O)C(=O)O[C@H]6O[C@@]3(C(=O)O5)[C@@]12O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I11 compound treatment 4127.0 2052.3 1.77 3276.0 1589.4 1.2876 2.162 0.9878 3189192 BSPBio_000489 CCN[C@H]1CN(CCCOC)S(=O)(=O)c2sc(cc12)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I12 compound treatment 1032.0 -1042.7 -0.8993 444.0 -1242.6 -1.0067 -1.3477 -0.9984 716 BSPBio_000490 CN(C)CCC=C1c2ccccc2C=Cc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I13 compound treatment 3676.0 1601.3 1.381 2802.0 1115.4 0.9036 1.6155 0.9789 1000229 BSPBio_000491 Nc1c(Br)cc(Br)cc1CN[C@H]2CC[C@H](O)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I14 compound treatment 3596.0 1521.3 1.312 2926.0 1239.4 1.004 1.6377 0.9913 1300555 BSPBio_000492 CC(C)(C)NCC(O)COc1cccc2NC(=O)CCc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I15 compound treatment 921.0 -1153.7 -0.995 432.0 -1254.6 -1.0164 -1.4223 -0.9999 705 BSPBio_000493 CC(Cc1cccc(c1)C(F)(F)F)NCCOC(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I16 compound treatment 1170.0 -904.73 -0.7803 413.0 -1273.6 -1.0318 -1.2813 -0.9905 2080102 BSPBio_000494 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I17 compound treatment 343.0 -1731.7 -1.4935 142.0 -1544.6 -1.2513 -1.9409 -0.9961 1000048 BSPBio_000495 CC(C)COCC(CN(Cc1ccccc1)c2ccccc2)N3CCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I18 compound treatment 2710.0 635.27 0.5479 2335.0 648.38 0.5253 0.7588 0.9998 1190 BSPBio_000496 Nc1c2C(O)CCCc2nc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I19 compound treatment 2492.0 417.27 0.3599 1865.0 178.38 0.1445 0.3567 0.9197 1504 BSPBio_000497 O=C1CC2(CCCC2)CC(=O)N1CCCCN3CCN(CC3)c4ncccn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I20 compound treatment 261.0 -1813.7 -1.5643 2272.0 585.38 0.4742 -0.7708 -0.4715 992 BSPBio_000498 CC[C@H]1[C@@H](Cc2cncn2C)COC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I21 compound treatment 1778.0 -296.73 -0.2559 2869.0 1182.4 0.9579 0.4963 0.5006 2873 BSPBio_000499 CCc1oc2ccccc2c1C(=O)c3cc(Br)c(O)c(Br)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I22 compound treatment 611.0 -1463.7 -1.2624 887.0 -799.63 -0.6478 -1.3507 -0.9519 1265 BSPBio_000500 Cc1onc(c1C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4c(Cl)cccc4Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I23 mock treatment 2206.0 131.27 0.1132 1785.0 98.375 0.0797 0.1364 0.9852 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 I24 mock treatment 1418.0 -656.73 -0.5664 2328.0 641.38 0.5196 -0.0331 -0.0431 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J01 mock treatment 2233.0 158.27 0.1365 2964.0 1277.4 1.0348 0.8282 0.7935 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J02 mock treatment 2039.0 -35.733 -0.0308 2305.0 618.38 0.501 0.3324 0.6624 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J03 compound treatment 2847.0 772.27 0.666 3345.0 1658.4 1.3435 1.4209 0.9476 821975 BSPBio_000501 C[C@H](CCC(=O)NCC(=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]3C[C@H](O)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J04 compound treatment 896.0 -1178.7 -1.0166 833.0 -853.63 -0.6915 -1.2078 -0.9824 3616753 BSPBio_000502 COc1ccc2C[C@@H]3N(CCc4cc(OC)c(O)cc34)Cc2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J05 compound treatment 100.0 -1974.7 -1.7031 145.0 -1541.6 -1.2489 -2.0874 -0.9884 BSPBio_000503 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J06 compound treatment 2260.0 185.27 0.1598 2192.0 505.38 0.4094 0.4025 0.9158 3616754 BSPBio_000504 CC[C@@H]1[C@@H](O)N2[C@@H]3CC45[C@H](O)C3C1C[C@H]2[C@@H]5N(C)c6ccccc64 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J07 compound treatment 2965.0 890.27 0.7678 2582.0 895.38 0.7254 1.0558 0.9996 3177255 BSPBio_000505 CS(=N)(=O)CC[C@H](N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J08 compound treatment 2429.0 354.27 0.3055 2209.0 522.38 0.4232 0.5153 0.9872 1539 BSPBio_000506 C[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J09 compound treatment 2926.0 851.27 0.7342 2453.0 766.38 0.6209 0.9582 0.9965 737 BSPBio_000507 c1nc(cs1)c2nc3ccccc3[nH]2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J10 compound treatment 2.0 -2072.7 -1.7876 59.0 -1627.6 -1.3186 -2.1964 -0.9888 3069522 BSPBio_000508 COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J11 compound treatment 3423.0 1348.3 1.1628 2961.0 1274.4 1.0324 1.5522 0.9982 3189445 BSPBio_000509 CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C2=O)c4c(O)c(/C=N/N5CCN(C)CC5)c(NC(=O)/C(=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(=O)C)[C@@H]1C)/C)c(O)c4c(O)c3C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J12 compound treatment 3236.0 1161.3 1.0015 3440.0 1753.4 1.4204 1.7126 0.9854 3100 BSPBio_000510 COc1c2OCOc2cc3CCN(C)Cc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J13 compound treatment 2152.0 77.267 0.0666 4043.0 2356.4 1.9089 1.3969 0.7313 803 BSPBio_000511 CCc1cc(ccn1)C(=S)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J14 compound treatment 2547.0 472.27 0.4073 2430.0 743.38 0.6022 0.7138 0.9819 1000122 BSPBio_000512 O[C@@H]([C@@H]1C[C@@H]2CCN1C[C@@H]2C=C)c3ccnc4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J15 compound treatment 3378.0 1303.3 1.124 3178.0 1491.4 1.2082 1.6491 0.9993 900 BSPBio_000513 CN1C(=C(O)c2sccc2S1(=O)=O)C(=O)Nc3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J16 compound treatment 2777.0 702.27 0.6057 2682.0 995.38 0.8064 0.9985 0.9901 1039 BSPBio_000514 CC[C@]1(CCCN2CCc3c4[C@@H]21)CC(=O)n4c5ccccc35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J17 compound treatment 2883.0 808.27 0.6971 2944.0 1257.4 1.0186 1.2132 0.9829 3068731 BSPBio_000515 CC(=O)Oc1cc(ccc1C(=O)O)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J18 compound treatment 2625.0 550.27 0.4746 3149.0 1462.4 1.1847 1.1733 0.9193 2082296 BSPBio_000516 O[C@H]([C@H]1C[C@@H]2CCN1C[C@@H]2C=C)c3ccnc4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J19 compound treatment 2674.0 599.27 0.5168 3093.0 1406.4 1.1393 1.1711 0.9361 4379 BSPBio_000517 CN1CCCCC1CCN2c3ccccc3Sc4ccc(cc24)S(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J20 compound treatment 2498.0 423.27 0.3651 2477.0 790.38 0.6403 0.7109 0.9645 994 BSPBio_000518 N[C@@H](CCONC(=N)N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J21 compound treatment 3101.0 1026.3 0.8851 2876.0 1189.4 0.9635 1.3072 0.9991 1470254 BSPBio_000519 Cc1c(C)c2OC(C)(CCc2c(C)c1O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J22 compound treatment 2107.0 32.267 0.0278 2074.0 387.38 0.3138 0.2416 0.7668 1530 BSPBio_000520 COc1ccc2c3CCN=C(C)c3[nH]c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J23 mock treatment 2072.0 -2.7333 -0.0024 2350.0 663.38 0.5374 0.3783 0.704 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 J24 mock treatment 2007.0 -67.733 -0.0584 2421.0 734.38 0.5949 0.3794 0.6346 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K01 mock treatment 3366.0 1291.3 1.1137 2528.0 841.38 0.6816 1.2695 0.9722 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K02 mock treatment 3106.0 1031.3 0.8894 1985.0 298.38 0.2417 0.7998 0.8678 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K03 compound treatment 2317.0 242.27 0.2089 2020.0 333.38 0.2701 0.3387 0.992 771 BSPBio_000521 CN1CCC(=C2c3ccsc3C(=O)Cc4ccccc24)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K04 compound treatment 2853.0 778.27 0.6712 2403.0 716.38 0.5803 0.885 0.9974 1055159 BSPBio_000522 NC(CC(=O)c1cccc(O)c1N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K05 compound treatment 2789.0 714.27 0.616 2273.0 586.38 0.475 0.7715 0.9918 907283 BSPBio_000523 NC(=N)N1CCc2ccccc2C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K06 compound treatment 3321.0 1246.3 1.0749 1934.0 247.38 0.2004 0.9017 0.8247 3189433 BSPBio_000524 OC[C@@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@@H](O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K07 compound treatment 147.0 -1927.7 -1.6626 47.0 -1639.6 -1.3283 -2.1149 -0.9938 1000064 BSPBio_000525 CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)NC(CCC(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K08 compound treatment 3395.0 1320.3 1.1387 2421.0 734.38 0.5949 1.2258 0.9542 3616708 BSPBio_000526 COC1=C[C@H]2[C@H](C3=C2c4c(OC)c(OC)c(OC)cc4CC[C@@H]3NC(=O)C)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K09 compound treatment 3017.0 942.27 0.8127 2125.0 438.38 0.3551 0.8258 0.9311 991 BSPBio_000527 CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K10 compound treatment 3229.0 1154.3 0.9955 2222.0 535.38 0.4337 1.0106 0.9307 1134 BSPBio_000528 CN1C[C@H](CO)C=C2[C@H]1Cc3c[nH]c4cccc2c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K11 compound treatment 1972.0 -102.73 -0.0886 878.0 -808.63 -0.6551 -0.5259 -0.7955 1496 BSPBio_000529 CSc1ccc2Sc3ccccc3CC(N4CCN(C)CC4)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K12 compound treatment 1185.0 -889.73 -0.7674 898.0 -788.63 -0.6389 -0.9944 -0.9959 3174101 BSPBio_000530 CN1CCc2c(C1)c3ccccc3n2Cc4ccccc4.OS(=O)(=O)c1cccc2c(cccc12)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K13 compound treatment 3003.0 928.27 0.8006 2396.0 709.38 0.5747 0.9725 0.9868 3068886 BSPBio_000531 CC(C)/N=c/1\cc2n(c3ccc(Cl)cc3)c4ccccc4nc2cc1Nc5ccc(Cl)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K14 compound treatment 2562.0 487.27 0.4202 1247.0 -439.63 -0.3561 0.0453 0.0823 3616712 BSPBio_000532 CN(C)[C@H]1[C@@H]2[C@@H](O)C3C(=C)c4c(Cl)ccc(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N.OC(=O)c1cc(ccc1O)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K15 compound treatment 3156.0 1081.3 0.9325 1694.0 7.375 0.006 0.6636 0.7116 975 BSPBio_000533 CCN(CC)CCOC(=O)C(CC1CCCO1)Cc2cccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K16 compound treatment 1668.0 -406.73 -0.3508 864.0 -822.63 -0.6664 -0.7193 -0.9551 1035 BSPBio_000534 Cc1cccc(CN2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K17 compound treatment 3482.0 1407.3 1.2137 2649.0 962.38 0.7796 1.4095 0.9771 1000105 BSPBio_000535 CC(C)(Oc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K18 compound treatment 2872.0 797.27 0.6876 2296.0 609.38 0.4937 0.8353 0.9868 988 BSPBio_000536 COc1ccc2[nH]cc(CCNC(=O)C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K19 compound treatment 2898.0 823.27 0.71 2430.0 743.38 0.6022 0.9279 0.9966 341 BSPBio_000537 N[C@@H](Cn1ccc(=O)c(O)c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K20 compound treatment 8.0 -2066.7 -1.7825 10.0 -1676.6 -1.3583 -2.2208 -0.991 449 BSPBio_000538 CC1=CC(=O)c2ccccc2C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K21 compound treatment 1749.0 -325.73 -0.2809 1734.0 47.375 0.0384 -0.1715 -0.6049 2777 BSPBio_000539 COc1cc(N)c(Cl)cc1C(=O)NC2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K22 compound treatment 1862.0 -212.73 -0.1835 1653.0 -33.625 -0.0272 -0.149 -0.8033 3069122 BSPBio_000540 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O.COC(N)(CO)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K23 mock treatment 1576.0 -498.73 -0.4301 1941.0 254.38 0.2061 -0.1584 -0.3322 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 K24 mock treatment 1433.0 -641.73 -0.5535 1843.0 156.38 0.1267 -0.3018 -0.5315 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L01 mock treatment 3227.0 1152.3 0.9938 2960.0 1273.4 1.0316 1.4321 0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L02 mock treatment 2990.0 915.27 0.7894 2421.0 734.38 0.5949 0.9789 0.9903 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L03 compound treatment 2589.0 514.27 0.4435 1819.0 132.38 0.1072 0.3895 0.8535 907463 BSPBio_000541 Cc1nc2ccccn2c(=O)c1CCN3CCC(CC3)C(=O)c4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L04 compound treatment 3398.0 1323.3 1.1413 2851.0 1164.4 0.9433 1.474 0.9955 1578 BSPBio_000542 CC1=NCCc2c1[nH]c3cc(O)ccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L05 compound treatment 3804.0 1729.3 1.4914 2719.0 1032.4 0.8363 1.646 0.9626 1024517 BSPBio_000543 COc1cc2CCNC(C)c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L06 compound treatment 2509.0 434.27 0.3745 1918.0 231.38 0.1874 0.3974 0.9488 1043296 BSPBio_000544 Cc1nccc2c3ccc(O)cc3[nH]c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L07 compound treatment 3658.0 1583.3 1.3655 2399.0 712.38 0.5771 1.3736 0.9266 1193 BSPBio_000545 CCOc1ccc(NC(=O)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L08 compound treatment 1502.0 -572.73 -0.494 1695.0 8.375 0.0068 -0.3445 -0.6973 297849 BSPBio_000546 COc1ccc2c(c1)[nH]c3c(C)nccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L09 compound treatment 3564.0 1489.3 1.2844 3316.0 1629.4 1.32 1.8416 0.9999 3474094 BSPBio_000547 OC1=C(C2CCC(CC2)c3ccc(Cl)cc3)C(=O)c4ccccc4C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L10 compound treatment 6.0 -2068.7 -1.7842 2.0 -1684.6 -1.3647 -2.2266 -0.9912 2057 BSPBio_000548 Cc1c2[nH]c3ccccc3c2c(C)c4cnccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L11 compound treatment 3680.0 1605.3 1.3845 2888.0 1201.4 0.9733 1.6672 0.9851 3058468 BSPBio_000549 COc1ccc(OC)c(c1)C(O)C(C)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L12 compound treatment 8.0 -2066.7 -1.7825 2.0 -1684.6 -1.3647 -2.2254 -0.9913 3069524 BSPBio_000550 O=C1C=CC(=O)c2c1ccc3c2ccc4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L13 compound treatment 3865.0 1790.3 1.544 3058.0 1371.4 1.111 1.8774 0.987 1001857 BSPBio_000551 CC(C)NC[C@@H](O)COc1ccc(CC(=O)N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L14 compound treatment 3267.0 1192.3 1.0283 2266.0 579.38 0.4694 1.059 0.9369 3616759 BSPBio_000552 CN(CCCCCCCCCCN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C)C(=O)Oc2cccc(c2)[N+](C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L15 compound treatment 3300.0 1225.3 1.0567 2645.0 958.38 0.7764 1.2962 0.9885 904 BSPBio_000553 NC(=O)CN1CCCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L16 compound treatment 3270.0 1195.3 1.0309 2835.0 1148.4 0.9303 1.3868 0.9987 1494 BSPBio_000554 C1CN(CCN1)c2ccc3ccccc3n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L17 compound treatment 3155.0 1080.3 0.9317 2600.0 913.38 0.7399 1.182 0.9935 948 BSPBio_000555 O=C1C(C(=O)c2ccccc12)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L18 compound treatment 2993.0 918.27 0.792 1559.0 -127.63 -0.1034 0.4869 0.6096 3616761 BSPBio_000556 C1CCN2C[C@@H]3C[C@@H](CN4CCCC[C@H]34)[C@@H]2C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L19 compound treatment 2765.0 690.27 0.5953 2754.0 1067.4 0.8647 1.0324 0.9834 3189446 BSPBio_000557 COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc3CCC(NC(=O)C)c4cc(=O)c(SC)ccc4-c3c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L20 compound treatment 384.0 -1690.7 -1.4582 554.0 -1132.6 -0.9176 -1.6799 -0.9751 3043 BSPBio_000558 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(OC(=O)C)C(=O)COC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L21 compound treatment 2229.0 154.27 0.133 2030.0 343.38 0.2782 0.2908 0.943 3068774 BSPBio_000559 Nc1cc(C(=C(Cl)Cl)Cl)c(cc1S(=O)(=O)N)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L22 compound treatment 2301.0 226.27 0.1951 1808.0 121.38 0.0983 0.2075 0.9497 1035065 BSPBio_000560 Cc1nccc2c3ccccc3[nH]c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L23 mock treatment 2300.0 225.27 0.1943 1871.0 184.38 0.1494 0.243 0.9916 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 L24 mock treatment 1603.0 -471.73 -0.4069 1267.0 -419.63 -0.3399 -0.5281 -0.996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M01 mock treatment 3010.0 935.27 0.8066 3174.0 1487.4 1.2049 1.4224 0.981 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M02 mock treatment 3026.0 951.27 0.8204 2528.0 841.38 0.6816 1.0621 0.9958 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M03 compound treatment 881.0 -1193.7 -1.0295 298.0 -1388.6 -1.1249 -1.5235 -0.999 907366 BSPBio_000561 Cc1cccc(C)c1NC(=O)CN2CCN(CCCC(c3ccc(F)cc3)c4ccc(F)cc4)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M04 compound treatment 2334.0 259.27 0.2236 2215.0 528.38 0.428 0.4608 0.9541 BSPBio_000562 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M05 compound treatment 2462.0 387.27 0.334 2434.0 747.38 0.6055 0.6643 0.9607 3480396 BSPBio_000563 CC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M06 compound treatment 2867.0 792.27 0.6833 2614.0 927.38 0.7513 1.0144 0.9989 3616717 BSPBio_000564 Nc1nc(cs1)/C(=N/OCC(=O)O)/C(=O)N[C@H]2[C@H]3SCC(=C(N3C2=O)C(=O)O)C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M07 compound treatment 1239.0 -835.73 -0.7208 683.0 -1003.6 -0.8131 -1.0846 -0.9982 86 BSPBio_000565 COC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccccc3)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M08 compound treatment 3138.0 1063.3 0.917 2127.0 440.38 0.3568 0.9007 0.9154 3616719 BSPBio_000566 CN(C(=O)C)c1c(I)c(NC(=O)C)c(I)c(C(=O)N[C@H]2C(O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M09 compound treatment 3349.0 1274.3 1.099 2694.0 1007.4 0.8161 1.3542 0.9893 1210 BSPBio_000567 CC(C)(C)c1cc(SC(C)(C)Sc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc(c1O)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M10 compound treatment 3021.0 946.27 0.8161 2555.0 868.38 0.7035 1.0745 0.9973 3616721 BSPBio_000568 C[C@@H](O[C@H]1[C@H](O)[C@@H](CO)O[C@H](O)[C@@H]1NC(=O)C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M11 compound treatment 27.0 -2047.7 -1.7661 31.0 -1655.6 -1.3412 -2.1972 -0.9908 1135 BSPBio_000569 OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M12 compound treatment 1942.0 -132.73 -0.1145 2440.0 753.38 0.6103 0.3506 0.5646 2181 BSPBio_000570 Oc1cc(O)c2c(=O)c(O)c(oc2c1)c3cc(O)c(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M13 compound treatment 14.0 -2060.7 -1.7773 15.0 -1671.6 -1.3542 -2.2143 -0.991 907273 BSPBio_000571 Fc1ccc(cc1)C(OCCN2CCN(CCCc3ccccc3)CC2)c4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M14 compound treatment 2671.0 596.27 0.5143 3114.0 1427.4 1.1563 1.1813 0.9334 1733214 BSPBio_000572 Oc1ccc(cc1)C2CC(=O)c3c(O)cc(O)cc3O2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M15 compound treatment 4009.0 1934.3 1.6682 2207.0 520.38 0.4216 1.4777 0.8588 990 BSPBio_000573 CCN(CC)CCOCCOC(=O)C1(CCCC1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M16 compound treatment 3187.0 1112.3 0.9593 2497.0 810.38 0.6565 1.1425 0.9829 895 BSPBio_000574 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M17 compound treatment 14.0 -2060.7 -1.7773 53.0 -1633.6 -1.3234 -2.1925 -0.9895 1351 BSPBio_000575 Cc1cc(N)c2ccccc2[n+]1CCCCCCCCCC[n+]3c(C)cc(N)c4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M18 compound treatment 2516.0 441.27 0.3806 2086.0 399.38 0.3235 0.4979 0.9967 822 BSPBio_000576 CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M19 compound treatment 1422.0 -652.73 -0.563 874.0 -812.63 -0.6583 -0.8636 -0.997 3060108 BSPBio_000577 CC(=O)N1CCN(CC1)c2ccc(OC[C@H]3CO[C@@](Cn4ccnc4)(O3)c5ccc(Cl)cc5Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M20 compound treatment 1652.0 -422.73 -0.3646 1517.0 -169.63 -0.1374 -0.355 -0.9111 1067495 BSPBio_000578 [O-][N+](=O)c1cnc(s1)N2CCNC2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M21 compound treatment 2026.0 -48.733 -0.042 1721.0 34.375 0.0278 -0.01 -0.1989 3616670 BSPBio_000579 C[C@@H]1[C@H](O)CC[C@@]2(C)C1CC[C@@]3(C)[C@H]2[C@H](O)C[C@H]4/C(=C(\CCC=C(C)C)/C(=O)O)/[C@H](C[C@@]43C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M22 compound treatment 2597.0 522.27 0.4504 1637.0 -49.625 -0.0402 0.2901 0.6414 3069161 BSPBio_000580 NCc1ccccc1CC(=O)N[C@H]2[C@H]3SCC(=C(N3C2=O)C(=O)O)CSc4nnnn4CC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M23 mock treatment 2174.0 99.267 0.0856 1849.0 162.38 0.1315 0.1536 0.9784 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 M24 mock treatment 1313.0 -761.73 -0.657 1544.0 -142.63 -0.1155 -0.5462 -0.8189 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N01 mock treatment 2474.0 399.27 0.3444 2756.0 1069.4 0.8663 0.8561 0.9183 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N02 mock treatment 2426.0 351.27 0.303 1515.0 -171.63 -0.139 0.1159 0.3477 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N03 compound treatment 61.0 -2013.7 -1.7368 65.0 -1621.6 -1.3137 -2.157 -0.9905 1309 BSPBio_000581 Cc1cc(C2CCCCC2)n(O)c(=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N04 compound treatment 2432.0 357.27 0.3081 2623.0 936.38 0.7586 0.7543 0.9212 1048750 BSPBio_000582 COc1ccc2[nH]c3C(=NCCc3c2c1)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N05 compound treatment 3332.0 1257.3 1.0843 2431.0 744.38 0.603 1.1932 0.9616 722 BSPBio_000583 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N06 compound treatment 2794.0 719.27 0.6203 2118.0 431.38 0.3495 0.6858 0.9631 3069526 BSPBio_000584 C[N+]1(C)CCC[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N07 compound treatment 3243.0 1168.3 1.0076 2588.0 901.38 0.7302 1.2288 0.9875 1213 BSPBio_000585 CNCCc1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N08 compound treatment 3698.0 1623.3 1.4 2759.0 1072.4 0.8687 1.6042 0.9737 2709 BSPBio_000586 Cc1ncc(CO)c(CO)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N09 compound treatment 3221.0 1146.3 0.9886 2273.0 586.38 0.475 1.0349 0.9436 3177389 BSPBio_000587 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](N)C[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N10 compound treatment 2465.0 390.27 0.3366 2009.0 322.38 0.2612 0.4227 0.9921 3560436 BSPBio_000588 O=c1cccc2[C@H]3CNC[C@H](C3)Cn21 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N11 compound treatment 3338.0 1263.3 1.0895 2423.0 736.38 0.5965 1.1922 0.9598 1000096 BSPBio_000589 C1CN2CC(N=C2S1)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N12 compound treatment 3371.0 1296.3 1.118 3307.0 1620.4 1.3127 1.7187 0.9968 1039072 BSPBio_000590 CN1C2CCCC1CC(=O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N13 compound treatment 4170.0 2095.3 1.8071 2450.0 763.38 0.6184 1.7151 0.898 3068775 BSPBio_000591 CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N14 compound treatment 3394.0 1319.3 1.1378 2099.0 412.38 0.3341 1.0408 0.8777 3189579 BSPBio_000592 CC(=O)SCC(Cc1ccccc1)C(=O)NCC(=O)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N15 compound treatment 3977.0 1902.3 1.6406 2425.0 738.38 0.5982 1.5831 0.9065 3616743 BSPBio_000593 CCOC(=O)/N=c\1/c[n+]([n-]o1)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N16 compound treatment 2917.0 842.27 0.7264 2343.0 656.38 0.5317 0.8897 0.9882 1117 BSPBio_000594 Nc1nc(=O)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)cnc2[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N17 compound treatment 2763.0 688.27 0.5936 2956.0 1269.4 1.0283 1.1469 0.9659 1000114 BSPBio_000595 CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N18 compound treatment 2575.0 500.27 0.4315 2910.0 1223.4 0.9911 1.0059 0.9306 3189580 BSPBio_000596 C[C@@H]1NCCc2cc(O)c(O)cc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N19 compound treatment 2317.0 242.27 0.2089 2114.0 427.38 0.3462 0.3926 0.9708 1365793 BSPBio_000597 COc1ccc(CN2CCNCC2)c(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N20 compound treatment 2496.0 421.27 0.3633 1613.0 -73.625 -0.0596 0.2147 0.5832 1014994 BSPBio_000598 CN(C)Cc1c[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N21 compound treatment 0.0 -2074.7 -1.7894 0.0 -1686.6 -1.3664 -2.2314 -0.9911 3103826 BSPBio_000599 C/C/1=C\CC[C@@]2(C)O[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N22 compound treatment 806.0 -1268.7 -1.0942 540.0 -1146.6 -0.9289 -1.4306 -0.9967 3189581 BSPBio_000600 CCCCc1cc2ccccc2c(OCCN(C)C)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N23 mock treatment 2283.0 208.27 0.1796 1779.0 92.375 0.0748 0.1799 0.9247 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 N24 mock treatment 1503.0 -571.73 -0.4931 1603.0 -83.625 -0.0677 -0.3966 -0.7968 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O01 mock treatment 2658.0 583.27 0.503 2633.0 946.38 0.7667 0.8978 0.9791 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O02 mock treatment 2161.0 86.267 0.0744 2400.0 713.38 0.5779 0.4613 0.7916 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O03 compound treatment 2680.0 605.27 0.522 2240.0 553.38 0.4483 0.6861 0.9971 743 BSPBio_000601 CC(C)(C)NCC(O)c1cc(O)cc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O04 compound treatment 2089.0 14.267 0.0123 2012.0 325.38 0.2636 0.1951 0.7393 1000325 BSPBio_000602 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O05 compound treatment 2423.0 348.27 0.3004 1974.0 287.38 0.2328 0.377 0.9921 3616672 BSPBio_000603 O[C@H]([C@@H](O)C(=O)O)C(=O)O.Fc1ccc(cc1)C(=O)C2CCN(CCn3c(=O)[nH]c4ccccc4c3=O)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O06 compound treatment 2453.0 378.27 0.3262 2057.0 370.38 0.3 0.4429 0.9991 3616726 BSPBio_000604 CC(C)(CO)C(O)C(=O)NCCC(=O)O[Ca]OC(=O)CCNC(=O)C(O)C(C)(C)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O07 compound treatment 2180.0 105.27 0.0908 2345.0 658.38 0.5334 0.4413 0.8157 907335 BSPBio_000605 C[N+]1(C)CCOC(O)(C1)c2ccc(cc2)c3ccc(cc3)C4(O)C[N+](C)(C)CCO4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O08 compound treatment 2690.0 615.27 0.5306 2609.0 922.38 0.7472 0.9036 0.9859 3189436 BSPBio_000606 CO[C@]1(NC(=O)C2SC(=C(C(=O)N)C(=O)O)S2)[C@H]3SCC(=C(N3C1=O)C(=O)O)CSc4nnnn4C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O09 compound treatment 2970.0 895.27 0.7721 2669.0 982.38 0.7958 1.1087 0.9999 698 BSPBio_000607 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O10 compound treatment 2281.0 206.27 0.1779 1968.0 281.38 0.2279 0.287 0.9925 1534 BSPBio_000608 O=C(/C=C/C=C/c1ccc2OCOc2c1)N3CCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O11 compound treatment 2697.0 622.27 0.5367 2433.0 746.38 0.6046 0.807 0.9982 3616675 BSPBio_000609 NCC[C@H](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]2O)[C@H](O)[C@H]1O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O12 compound treatment 3126.0 1051.3 0.9067 2313.0 626.38 0.5074 0.9999 0.9624 1537011 BSPBio_000610 CN(C)CCC(c1ccc(Br)cc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O13 compound treatment 16.0 -2058.7 -1.7756 7.0 -1679.6 -1.3607 -2.2177 -0.9914 3616678 BSPBio_000611 COc1cc(cc(OC)c1O)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](O[C@@H]4O[C@@H]5CO[C@@H](C)O[C@H]5[C@H](O)[C@H]4O)c6cc7OCOc7cc26 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O14 compound treatment 0.0 -2074.7 -1.7894 322.0 -1364.6 -1.1055 -2.047 -0.9732 2551 BSPBio_000612 COc1cc(NC(C)CCCN)c2ncccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O15 compound treatment 500.0 -1574.7 -1.3581 336.0 -1350.6 -1.0942 -1.734 -0.9943 3068926 BSPBio_000613 CCN(CC)CCOc1ccc(cc1)/C(=C(/Cl)\c2ccccc2)/c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O16 compound treatment 1667.0 -407.73 -0.3517 1286.0 -400.63 -0.3246 -0.4781 -0.9992 1072 BSPBio_000614 CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O17 compound treatment 2435.0 360.27 0.3107 2564.0 877.38 0.7108 0.7223 0.9311 3616680 BSPBio_000615 CN1CCCN=C1/C=C/c2cccc(O)c2.OC(=O)c1c(O)cc2ccccc2c1Cc3c(C(=O)O)c(O)cc4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O18 compound treatment 530.0 -1544.7 -1.3323 558.0 -1128.6 -0.9143 -1.5886 -0.9831 3480329 BSPBio_000616 CCOC(=O)C1=C(C)NC(=C(C1c2cccc(Cl)c2Cl)C(=O)OC)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O19 compound treatment 1080.0 -994.73 -0.8579 944.0 -742.63 -0.6016 -1.032 -0.9849 1041 BSPBio_000617 CN1CCN(CCCN2c3ccccc3Sc4ccc(Cl)cc24)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O20 compound treatment 1785.0 -289.73 -0.2499 1613.0 -73.625 -0.0596 -0.2189 -0.852 1362 BSPBio_000618 COc1c2occc2cc3ccc(=O)oc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O21 compound treatment 2019.0 -55.733 -0.0481 1614.0 -72.625 -0.0588 -0.0756 -0.995 3075213 BSPBio_000619 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O22 compound treatment 1.0 -2073.7 -1.7885 0.0 -1686.6 -1.3664 -2.2308 -0.9912 3616730 BSPBio_000620 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O23 mock treatment 1941.0 -133.73 -0.1153 1180.0 -506.63 -0.4104 -0.3718 -0.872 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 O24 mock treatment 1426.0 -648.73 -0.5595 458.0 -1228.6 -0.9953 -1.0994 -0.9629 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P01 mock treatment 2191.0 116.27 0.1003 1950.0 263.38 0.2134 0.2218 0.9407 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P02 mock treatment 1774.0 -300.73 -0.2594 1628.0 -58.625 -0.0475 -0.217 -0.8229 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P03 compound treatment 1602.0 -472.73 -0.4077 1633.0 -53.625 -0.0434 -0.319 -0.778 922 BSPBio_000621 CCCCC(CC)CN1CN(CC(CC)CCCC)CC(C)(N)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P04 compound treatment 2209.0 134.27 0.1158 5294.0 3607.4 2.9224 2.1483 0.7345 3382 BSPBio_000622 Cc1c(CCO)sc[n+]1Cc2cnc(C)nc2N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P05 compound treatment 2660.0 585.27 0.5048 2031.0 344.38 0.279 0.5542 0.9609 2284 BSPBio_000623 C[C@H](Cc1ccccc1)N(C)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P06 compound treatment 2225.0 150.27 0.1296 1857.0 170.38 0.138 0.1892 0.9995 3487152 BSPBio_000624 CNCC(O)c1ccc(OC(=O)C(C)(C)C)c(OC(=O)C(C)(C)C)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P07 compound treatment 192.0 -1882.7 -1.6238 69.0 -1617.6 -1.3105 -2.0748 -0.9943 1020 BSPBio_000625 NC(=N)c1ccc(OCCCCCOc2ccc(cc2)C(=N)N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P08 compound treatment 1666.0 -408.73 -0.3525 2056.0 369.38 0.2992 -0.0377 -0.0815 2041 BSPBio_000626 OC(=O)CNC(=O)C(CS)Cc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P09 compound treatment 2240.0 165.27 0.1425 1686.0 -0.625 -5.0E-4 0.1004 0.7046 196 BSPBio_000627 Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2CCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P10 compound treatment 1907.0 -167.73 -0.1447 1666.0 -20.625 -0.0167 -0.1141 -0.7836 3211 BSPBio_000628 Cc1cc2nc3c(=O)[nH]c(=O)nc3n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P11 compound treatment 1317.0 -757.73 -0.6535 553.0 -1133.6 -0.9184 -1.1115 -0.9861 1931603 BSPBio_000629 Oc1ccc(cc1)C(=O)N/N=C/c2ccc(o2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P12 compound treatment 2303.0 228.27 0.1969 745.0 -941.63 -0.7628 -0.4002 -0.508 3189582 BSPBio_000630 CC[C@H]1CN2CCC1C[C@H]2[C@H](O)c3ccnc4ccc(OC)cc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P13 compound treatment 22.0 -2052.7 -1.7704 16.0 -1670.6 -1.3534 -2.2089 -0.9912 804 BSPBio_000631 COc1c(C)c2COC(=O)c2c(O)c1C/C=C(\C)/CCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P14 compound treatment 2470.0 395.27 0.3409 2132.0 445.38 0.3608 0.4962 0.9996 824 BSPBio_000632 CC[C@]1(CCCN2CCc3c4[C@@H]21)C[C@@](O)(C(=O)OC)n4c5ccccc35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P15 compound treatment 2403.0 328.27 0.2831 1425.0 -261.63 -0.2119 0.0503 0.1423 1001314 BSPBio_000633 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@@H]4N[C@@H](COCCOC)O[C@H]([C@H]4C)[C@]1(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P16 compound treatment 1680.0 -394.73 -0.3404 1457.0 -229.63 -0.186 -0.3723 -0.9596 3069528 BSPBio_000634 C/C=C\1/C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@H]32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P17 compound treatment 2024.0 -50.733 -0.0438 1521.0 -165.63 -0.1342 -0.1258 -0.8915 3474312 BSPBio_000635 Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2CC3CCCC3C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P18 compound treatment 2304.0 229.27 0.1977 1391.0 -295.63 -0.2395 -0.0295 -0.0951 3187609 BSPBio_000636 C[C@H]1[C@H]2CC[C@H]3[C@@H]4CC=C5C[C@H](CC[C@]5(C)[C@H]4CC[C@]23CN1C)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P19 compound treatment 708.0 -1366.7 -1.1788 421.0 -1265.6 -1.0253 -1.5585 -0.9976 3060137 BSPBio_000637 COc1ccccc1N2CCN(CCCCNC(=O)c3ccc4ccccc4c3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P20 compound treatment 1338.0 -736.73 -0.6354 1642.0 -44.625 -0.0362 -0.4749 -0.7461 3616767 BSPBio_000638 CC[C@@H](C)C(=O)O[C@H]1[C@H](O)[C@H]2[C@@H](CN3C[C@@H](C)CC[C@H]3[C@@]2(C)O)C4C[C@]5(O[C@]6(O)[C@H]7[C@@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]5[C@@]41O)[C@@]7(C)CC[C@@H]6OC(=O)[C@](C)(O)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P21 compound treatment 52.0 -2022.7 -1.7445 80.0 -1606.6 -1.3015 -2.1539 -0.9896 3616746 BSPBio_000639 CC(O)C(=O)C.CC(Cc1ccccc1)NCCC(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P22 compound treatment 607.0 -1467.7 -1.2659 944.0 -742.63 -0.6016 -1.3205 -0.9422 3616768 BSPBio_000640 C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5C[C@H](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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P23 mock treatment 1576.0 -498.73 -0.4301 1078.0 -608.63 -0.4931 -0.6528 -0.9977 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2454 P24 mock treatment 1015.0 -1059.7 -0.914 1479.0 -207.63 -0.1682 -0.7652 -0.8234 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A01 mock treatment 1131.0 -701.34 -0.6049 59.0 -1474.3 -1.1943 -1.2722 -0.9503 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A02 mock treatment 1190.0 -642.34 -0.554 815.0 -718.28 -0.5819 -0.8032 -0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A03 compound treatment 1572.0 -260.34 -0.2245 1525.0 -8.2813 -0.0067 -0.1635 -0.7279 3187611 BSPBio_000641 COc1cc(ccc1c2nc3ncccc3[nH]2)S(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A04 compound treatment 1143.0 -689.34 -0.5945 49.0 -1484.3 -1.2024 -1.2706 -0.9473 1606 BSPBio_000642 NS(=O)(=O)c1cc2c(NC(CSCC=C)NS2(=O)=O)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A05 compound treatment 1370.0 -462.34 -0.3988 1082.0 -451.28 -0.3656 -0.5405 -0.9991 1254 BSPBio_000643 O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A06 compound treatment 1444.0 -388.34 -0.3349 715.0 -818.28 -0.6629 -0.7056 -0.95 1524 BSPBio_000644 CC(C)Nc1c(C)n(C)n(c2ccccc2)c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A07 compound treatment 248.0 -1584.3 -1.3664 235.0 -1298.3 -1.0518 -1.7099 -0.9916 3187612 BSPBio_000645 CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A08 compound treatment 461.0 -1371.3 -1.1827 485.0 -1048.3 -0.8492 -1.4368 -0.9868 883 BSPBio_000646 CC(Oc1ccccc1)C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A09 compound treatment 1348.0 -484.34 -0.4177 982.0 -551.28 -0.4466 -0.6112 -0.9994 3069530 BSPBio_000647 CC(=O)NC1CCSC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A10 compound treatment 1448.0 -384.34 -0.3315 584.0 -949.28 -0.769 -0.7782 -0.9292 887 BSPBio_000648 COc1ccc(NS(=O)(=O)c2ccc(N)cc2)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A11 compound treatment 261.0 -1571.3 -1.3552 466.0 -1067.3 -0.8646 -1.5697 -0.9764 1000240 BSPBio_000649 CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)CC[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A12 compound treatment 839.0 -993.34 -0.8567 652.0 -881.28 -0.7139 -1.1106 -0.9959 745 BSPBio_000650 CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A13 compound treatment 1542.0 -290.34 -0.2504 997.0 -536.28 -0.4344 -0.4843 -0.9657 3616769 BSPBio_000651 C[C@H]1O[C@H](C[C@H](O)[C@@H]1O)OC2CC[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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A14 compound treatment 785.0 -1047.3 -0.9033 545.0 -988.28 -0.8006 -1.2048 -0.9982 3263 BSPBio_000652 CNC(C)(C)Cc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A15 compound treatment 1144.0 -688.34 -0.5937 1097.0 -436.28 -0.3534 -0.6697 -0.9693 2060360 BSPBio_000653 C1CN=C(C1)c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A16 compound treatment 88.0 -1744.3 -1.5044 109.0 -1424.3 -1.1538 -1.8797 -0.9914 3187750 BSPBio_000654 CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]7CCCN7C1=O)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A17 compound treatment 1317.0 -515.34 -0.4445 908.0 -625.28 -0.5065 -0.6725 -0.9979 3069532 BSPBio_000655 C[N+]1(C)C[C@@H](O)C[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A18 compound treatment 939.0 -893.34 -0.7705 692.0 -841.28 -0.6815 -1.0267 -0.9981 751 BSPBio_000656 COc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A19 compound treatment 1371.0 -461.34 -0.3979 1023.0 -510.28 -0.4134 -0.5737 -0.9998 946 BSPBio_000657 OCCNC(=O)Cn1ccnc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A20 compound treatment 449.0 -1383.3 -1.1931 642.0 -891.28 -0.722 -1.3542 -0.9711 1146 BSPBio_000658 Nc1ccc(cc1)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A21 compound treatment 1162.0 -670.34 -0.5781 1295.0 -238.28 -0.193 -0.5453 -0.8947 3616770 BSPBio_000659 NCCC(O)C(=O)N[C@@H]1C[C@H](N)[C@@H](OC2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2N)[C@H](OC3O[C@H](CO)C(O)[C@H]3O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A22 compound treatment 366.0 -1466.3 -1.2647 884.0 -649.28 -0.526 -1.2662 -0.9244 3616809 BSPBio_000660 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@@]61CC[C@@H](C)CO6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A23 mock treatment 970.0 -862.34 -0.7437 1550.0 16.719 0.0135 -0.5163 -0.6941 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 A24 mock treatment 704.0 -1128.3 -0.9731 11.0 -1522.3 -1.2332 -1.5601 -0.9931 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B01 mock treatment 2308.0 475.66 0.4102 2061.0 527.72 0.4275 0.5924 0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B02 mock treatment 1835.0 2.6563 0.0023 2035.0 501.72 0.4064 0.289 0.7111 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B03 compound treatment 2302.0 469.66 0.4051 2220.0 686.72 0.5563 0.6798 0.9878 1412 BSPBio_000661 CN(C)CCOC(c1ccc(Cl)cc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B04 compound treatment 2063.0 230.66 0.1989 1821.0 287.72 0.2331 0.3055 0.9969 1300 BSPBio_000662 OC(=O)c1cccnc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B05 compound treatment 2485.0 652.66 0.5629 2264.0 730.72 0.592 0.8166 0.9997 3069629 BSPBio_000663 CC(=O)/N=c/1\sc(nn1C)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B06 compound treatment 2235.0 402.66 0.3473 1670.0 136.72 0.1108 0.3239 0.8885 2819 BSPBio_000664 CCC1(C)CC(=O)NC(=O)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B07 compound treatment 2409.0 576.66 0.4973 2023.0 489.72 0.3967 0.6322 0.9937 818 BSPBio_000665 CCC1(CC)C(=O)NC=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B08 compound treatment 1620.0 -212.34 -0.1831 1585.0 51.719 0.0419 -0.0999 -0.5316 3187897 BSPBio_000666 C[C@]12[C@H](CC[C@]2(O)[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3C[C@H]1O)C5=CC(=O)OC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B09 compound treatment 2270.0 437.66 0.3775 2145.0 611.72 0.4956 0.6173 0.991 795 BSPBio_000667 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B10 compound treatment 1738.0 -94.344 -0.0814 1336.0 -197.28 -0.1598 -0.1705 -0.951 4370 BSPBio_000668 CNCC(O)C(O)C(O)C(O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B11 compound treatment 2097.0 264.66 0.2283 1836.0 302.72 0.2452 0.3348 0.9994 1129 BSPBio_000669 CCn1cc(C(=O)O)c(=O)c2cnc(nc12)N3CCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B12 compound treatment 1.0 -1831.3 -1.5795 4.0 -1529.3 -1.2389 -1.9929 -0.9928 2117591 BSPBio_000670 C[C@]12[C@H]3CC[C@H](O3)[C@]2(C)C(=O)OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B13 compound treatment 413.0 -1419.3 -1.2241 561.0 -972.28 -0.7877 -1.4225 -0.9773 755 BSPBio_000671 CC(CN(C)C)CN1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B14 compound treatment 532.0 -1300.3 -1.1215 673.0 -860.28 -0.6969 -1.2858 -0.9738 1999 BSPBio_000672 Oc1c(I)cc(Cl)c2cccnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B15 compound treatment 654.0 -1178.3 -1.0163 1258.0 -275.28 -0.223 -0.8763 -0.8422 1088922 BSPBio_000673 CN(C)CCN(Cc1ccc(Cl)cc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B16 compound treatment 1199.0 -633.34 -0.5462 1716.0 182.72 0.148 -0.2816 -0.4975 838 BSPBio_000674 COc1ccc(C(=O)c2ccccc2)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B17 compound treatment 1417.0 -415.34 -0.3582 1364.0 -169.28 -0.1371 -0.3503 -0.9132 3043753 BSPBio_000675 [O-][N+](=O)c1ccc(/C=N/N2CCOC2=O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B18 compound treatment 280.0 -1552.3 -1.3388 570.0 -963.28 -0.7804 -1.4985 -0.967 681 BSPBio_000676 CC(CN1c2ccccc2Sc3ccccc13)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B19 compound treatment 1815.0 -17.344 -0.015 1944.0 410.72 0.3327 0.2247 0.6746 2570 BSPBio_000677 NS(=O)(=O)c1cc(Cl)c(Cl)c(c1)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B20 compound treatment 1043.0 -789.34 -0.6808 1484.0 -49.281 -0.0399 -0.5096 -0.7473 1225 BSPBio_000678 Oc1cc(O)c2c(=O)cc(oc2c1)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B21 compound treatment 24.0 -1808.3 -1.5596 59.0 -1474.3 -1.1943 -1.9473 -0.9913 871 BSPBio_000679 Clc1ccc(CSC(Cn2ccnc2)c3ccc(Cl)cc3Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B22 compound treatment 1226.0 -606.34 -0.5229 1252.0 -281.28 -0.2279 -0.5309 -0.9307 3487233 BSPBio_000680 CC(O)Cn1cnc2n(C)c(=O)n(C)c(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B23 mock treatment 1592.0 -240.34 -0.2073 1637.0 103.72 0.084 -0.0872 -0.3897 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 B24 mock treatment 955.0 -877.34 -0.7567 978.0 -555.28 -0.4498 -0.8531 -0.9692 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C01 mock treatment 2785.0 952.66 0.8216 2264.0 730.72 0.592 0.9996 0.9871 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C02 mock treatment 2220.0 387.66 0.3343 2093.0 559.72 0.4534 0.557 0.9888 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C03 compound treatment 2651.0 818.66 0.7061 2304.0 770.72 0.6244 0.9408 0.9981 1624 BSPBio_000681 CCC1=C(C)CN(C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)N[C@H]3CC[C@H](C)CC3)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C04 compound treatment 2267.0 434.66 0.3749 2133.0 599.72 0.4858 0.6086 0.9918 706 BSPBio_000682 Nc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C05 compound treatment 1805.0 -27.344 -0.0236 1699.0 165.72 0.1343 0.0783 0.5741 3616771 BSPBio_000683 CC(=C)[C@H]1[C@H]2OC(=O)C1[C@]3(O)CC4O[C@]45C(=O)O[C@H]2[C@@]53C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C06 compound treatment 2356.0 523.66 0.4516 1880.0 346.72 0.2809 0.518 0.9739 1149 BSPBio_000684 CN(N=O)C(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C07 compound treatment 2736.0 903.66 0.7794 2604.0 1070.7 0.8674 1.1644 0.9986 1244 BSPBio_000685 C[N+]1(C)CCCC(C1)OC(=O)C(O)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C08 compound treatment 1981.0 148.66 0.1282 1711.0 177.72 0.144 0.1925 0.9983 3616810 BSPBio_000686 COCCc1ccc(OCC(O)CNC(C)C)cc1.O[C@H]([C@@H](O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C09 compound treatment 2136.0 303.66 0.2619 2297.0 763.72 0.6187 0.6227 0.9268 3187616 BSPBio_000687 C/C(=C(\CCOP(=O)(O)O)/SC(=O)c1ccccc1)/N(Cc2cnc(C)nc2N)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C10 compound treatment 499.0 -1333.3 -1.15 372.0 -1161.3 -0.9408 -1.4784 -0.995 3187752 BSPBio_000688 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C11 compound treatment 329.0 -1503.3 -1.2966 282.0 -1251.3 -1.0137 -1.6336 -0.9926 3069534 BSPBio_000689 CC1(C)O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C12 compound treatment 1442.0 -390.34 -0.3367 986.0 -547.28 -0.4434 -0.5516 -0.9908 359 BSPBio_000690 FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NCC2CCCCN2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C13 compound treatment 1116.0 -716.34 -0.6178 2110.0 576.72 0.4672 -0.1065 -0.1375 3616772 BSPBio_000691 C[C@H]1O[C@H](C[C@H](O)[C@@H]1O[C@H]2C[C@H](O)[C@H](O[C@H]3C[C@H](OC(=O)C)[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](C)O3)[C@@H](C)O2)O[C@H]5CC[C@@]6(C)[C@H](CC[C@@]7(C)[C@@]8(O)CC[C@H](C9=CC(=O)OC9)[C@@]8(C)[C@H](O)C[C@]67C)C5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C14 compound treatment 1795.0 -37.344 -0.0322 1448.0 -85.281 -0.0691 -0.0716 -0.9397 689 BSPBio_000692 Cc1nnc(SCC2=C(N3[C@H](SC2)[C@H](NC(=O)Cn4cnnn4)C3=O)C(=O)O)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C15 compound treatment 1583.0 -249.34 -0.215 1869.0 335.72 0.272 0.0402 0.1161 3103678 BSPBio_000693 N/C(=N\C(=O)c1nc(Cl)c(N)nc1N)/NCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C16 compound treatment 1785.0 -47.344 -0.0408 1478.0 -55.281 -0.0448 -0.0605 -0.9989 3616811 BSPBio_000694 CC(C)CC(=O)O[C@H]1[C@@H](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)O[C@H](CO)[C@@H](OS(=O)(=O)O)[C@@H]1OS(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C17 compound treatment 2122.0 289.66 0.2498 1857.0 323.72 0.2622 0.3621 0.9997 827 BSPBio_000695 CCCCC1(COC(=O)CCC(=O)O)C(=O)N(N(C1=O)c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C18 compound treatment 1430.0 -402.34 -0.347 1205.0 -328.28 -0.2659 -0.4334 -0.9914 873 BSPBio_000696 Nc1nc(=O)c2N(C=O)C(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)CNc2[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C19 compound treatment 1847.0 14.656 0.0126 1728.0 194.72 0.1577 0.1205 0.7613 3069535 BSPBio_000697 C(Nc1ncnc2nc[nH]c12)c3ccco3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C20 compound treatment 1376.0 -456.34 -0.3936 1367.0 -166.28 -0.1347 -0.3736 -0.898 953 BSPBio_000698 C[C@H](N)[C@H](O)c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C21 compound treatment 969.0 -863.34 -0.7446 969.0 -564.28 -0.4571 -0.8498 -0.9726 BSPBio_000699 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C22 compound treatment 42.0 -1790.3 -1.5441 0.0 -1533.3 -1.2421 -1.9702 -0.9942 1531 BSPBio_000700 O=c1n([se]c2ccccc12)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C23 mock treatment 1708.0 -124.34 -0.1072 1616.0 82.719 0.067 -0.0284 -0.225 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 C24 mock treatment 1067.0 -765.34 -0.6601 957.0 -576.28 -0.4669 -0.7969 -0.9856 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D01 mock treatment 2803.0 970.66 0.8372 2717.0 1183.7 0.9589 1.27 0.9977 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D02 mock treatment 2592.0 759.66 0.6552 1811.0 277.72 0.225 0.6224 0.8984 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D03 compound treatment 2744.0 911.66 0.7863 1879.0 345.72 0.2801 0.754 0.9034 3472295 BSPBio_000701 COc1c(O)cc2C(=O)OC3C(O)C(O)C(CO)OC3c2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D04 compound treatment 2369.0 536.66 0.4628 2624.0 1090.7 0.8836 0.9521 0.9545 1022907 BSPBio_000702 CC(=O)c1cc2ccccc2oc1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D05 compound treatment 2324.0 491.66 0.424 2771.0 1237.7 1.0027 1.0088 0.9267 1446 BSPBio_000703 OC(COc1cccc2oc(cc(=O)c12)C(=O)O)COc3cccc4oc(cc(=O)c34)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D06 compound treatment 1069.0 -763.34 -0.6584 767.0 -766.28 -0.6208 -0.9045 -0.9996 3616845 BSPBio_000704 OC[C@H]1OC(Oc2cc3ccc(=O)oc3cc2O)[C@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D07 compound treatment 2884.0 1051.7 0.907 2711.0 1177.7 0.9541 1.316 0.9997 3616827 BSPBio_000705 CCCC(=O)Nc1ncnc2n(cnc12)[C@@H]3O[C@@H]4OP(=O)(O)OC[C@H]4[C@H]3OC(=O)CCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D08 compound treatment 3070.0 1237.7 1.0674 2317.0 783.72 0.6349 1.2037 0.9692 2776 BSPBio_000706 OC(=O)Cc1ccc(cc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D09 compound treatment 1806.0 -26.344 -0.0227 2970.0 1436.7 1.1639 0.8069 0.6932 3176931 BSPBio_000707 NC(=O)c1cc[n+](CC2=C(N3[C@H](SC2)[C@H](NC(=O)[C@@H](c4ccccc4)S(=O)(=O)O)C3=O)C(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D10 compound treatment 1908.0 75.656 0.0653 1388.0 -145.28 -0.1177 -0.0371 -0.2756 1012530 BSPBio_000708 CCCCOC(=O)c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D11 compound treatment 2474.0 641.66 0.5534 2111.0 577.72 0.468 0.7223 0.9965 717 BSPBio_000709 OC(=O)c1ccccc1OP(=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D12 compound treatment 1864.0 31.656 0.0273 1357.0 -176.28 -0.1428 -0.0817 -0.5617 1299 BSPBio_000710 Nc1ccc(cc1)C(=O)NCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D13 compound treatment 2830.0 997.66 0.8604 2370.0 836.72 0.6778 1.0877 0.993 1102 BSPBio_000711 CC(C(=O)O)c1ccc(cc1)C(=O)c2cccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D14 compound treatment 2288.0 455.66 0.393 595.0 -938.28 -0.7601 -0.2596 -0.3034 1231 BSPBio_000712 CC(C)C[C@H](NC(=O)C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D15 compound treatment 2710.0 877.66 0.7569 2172.0 638.72 0.5174 0.9011 0.9828 1047041 BSPBio_000713 OC1Cc2c(O)cc(O)cc2OC1c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D16 compound treatment 1884.0 51.656 0.0446 1309.0 -224.28 -0.1817 -0.097 -0.5184 1258 BSPBio_000714 CCn1cc(C(=O)O)c(=O)c2cnc(nc12)N3CCNCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D17 compound treatment 2155.0 322.66 0.2783 1926.0 392.72 0.3181 0.4217 0.9978 1555091 BSPBio_000715 CC(C)(C)NCC(O)COc1cccc2CC(O)C(O)Cc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D18 compound treatment 1371.0 -461.34 -0.3979 1266.0 -267.28 -0.2165 -0.4345 -0.9591 3059213 BSPBio_000716 COc1ccc(C(=O)c2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D19 compound treatment 2301.0 468.66 0.4042 2155.0 621.72 0.5037 0.642 0.9941 3066 BSPBio_000717 CO[C@]1(NC(=O)[C@H](C(=O)O)c2ccc(O)cc2)[C@H]3OCC(=C(N3C1=O)C(=O)O)CSc4nnnn4C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D20 compound treatment 1754.0 -78.344 -0.0676 1118.0 -415.28 -0.3364 -0.2857 -0.8325 3187899 BSPBio_000718 C[C@@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D21 compound treatment 1767.0 -65.344 -0.0564 1724.0 190.72 0.1545 0.0694 0.422 856 BSPBio_000719 Cn1c(=O)n(C)c2nc[nH]c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D22 compound treatment 1513.0 -319.34 -0.2754 1537.0 3.7188 0.003 -0.1926 -0.6993 3616847 BSPBio_000720 C[N+]1(C)C2CC[C@H]1C[C@H](C2)OC(=O)C(CO)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D23 mock treatment 1674.0 -158.34 -0.1366 1499.0 -34.281 -0.0278 -0.1162 -0.8338 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 D24 mock treatment 1274.0 -558.34 -0.4815 1060.0 -473.28 -0.3834 -0.6116 -0.9936 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E01 mock treatment 2319.0 486.66 0.4197 2004.0 470.72 0.3813 0.5664 0.9989 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E02 mock treatment 2972.0 1139.7 0.9829 1537.0 3.7188 0.003 0.6972 0.7093 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E03 compound treatment 2593.0 760.66 0.656 2301.0 767.72 0.6219 0.9037 0.9996 3069536 BSPBio_000721 OC[C@H]1OC([C@H](O)[C@@H](O)[C@@H]1O)c2c(O)cc(O)c3c(=O)cc(oc23)c4ccc(O)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E04 compound treatment 1915.0 82.656 0.0713 1434.0 -99.281 -0.0804 -0.0065 -0.0601 1000108 BSPBio_000722 NC(=O)c1ccc[n+](c1)[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E05 compound treatment 2712.0 879.66 0.7587 2754.0 1220.7 0.9889 1.2357 0.9914 3616774 BSPBio_000723 CN1C[C@@]2(C=C)C3CC4OC[C@@H]3[C@@H]1[C@H]2[C@@]45C(=O)Nc6ccccc65 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E06 compound treatment 3159.0 1326.7 1.1442 2011.0 477.72 0.387 1.0827 0.8964 799 BSPBio_000724 Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E07 compound treatment 2155.0 322.66 0.2783 1769.0 235.72 0.191 0.3318 0.9831 3616775 BSPBio_000725 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)CN6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E08 compound treatment 726.0 -1106.3 -0.9542 376.0 -1157.3 -0.9375 -1.3376 -1.0 3187753 BSPBio_000726 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E09 compound treatment 2501.0 668.66 0.5767 2273.0 739.72 0.5993 0.8315 0.9998 3616777 BSPBio_000727 CCN1C[C@]2(COC)CC[C@H](OC)[C@]3([C@@H]4C[C@H]5[C@H](OC)[C@@H]4[C@@]6(C[C@@H]5OC)OCO[C@]76[C@@H](O)[C@@H]32)C17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E10 compound treatment 2815.0 982.66 0.8475 1657.0 123.72 0.1002 0.6701 0.7853 3187754 BSPBio_000728 CNCC(O)C(O)C(O)C(O)CO.Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E11 compound treatment 2066.0 233.66 0.2015 1716.0 182.72 0.148 0.2472 0.9885 3616778 BSPBio_000729 COc1c(OC[C@@H](O)C(C)(C)O)ccc2c(OC)c3ccoc3nc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E12 compound treatment 3028.0 1195.7 1.0312 2784.0 1250.7 1.0132 1.4456 1.0 BSPBio_000730 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E13 compound treatment 2574.0 741.66 0.6396 2090.0 556.72 0.451 0.7712 0.9854 3187620 BSPBio_000731 C[C@H]1CCC[C@@H](C)N1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E14 compound treatment 1892.0 59.656 0.0515 1696.0 162.72 0.1318 0.1296 0.9158 3069580 BSPBio_000732 C[N+]1(C)CCC(C1)OC(=O)C(O)(C2CCCC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E15 compound treatment 1634.0 -198.34 -0.1711 1256.0 -277.28 -0.2246 -0.2798 -0.991 1540789 BSPBio_000733 COc1cc(=O)n(C)c2c(OCC(O)C(C)(C)O)cccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E16 compound treatment 2089.0 256.66 0.2214 1340.0 -193.28 -0.1566 0.0458 0.1689 3069581 BSPBio_000734 Cn1nnnc1SCC2=C(N3[C@H](SC2)[C@H](NC(=O)[C@H](O)c4ccccc4)C3=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E17 compound treatment 2367.0 534.66 0.4611 2015.0 481.72 0.3902 0.602 0.9966 1054505 BSPBio_000735 COc1ccc2c(OC)c3ccoc3nc2c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E18 compound treatment 0.0 -1832.3 -1.5803 6.0 -1527.3 -1.2373 -1.9923 -0.9927 3616814 BSPBio_000736 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@H](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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E19 compound treatment 2200.0 367.66 0.3171 1665.0 131.72 0.1067 0.2997 0.8957 3616780 BSPBio_000737 C1CC[C@@H](NC1)c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E20 compound treatment 1586.0 -246.34 -0.2125 1370.0 -163.28 -0.1323 -0.2438 -0.974 4338 BSPBio_000738 CCC(NC(C)C)C(O)c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E21 compound treatment 2.0 -1830.3 -1.5786 0.0 -1533.3 -1.2421 -1.9946 -0.993 193 BSPBio_000739 COc1cc2CCN(C)[C@H]3Cc4ccc(OC)c(Oc5ccc(C[C@@H]6N(C)CCc7cc(OC)c(Oc(c1OC)c32)cc67)cc5)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E22 compound treatment 1600.0 -232.34 -0.2004 866.0 -667.28 -0.5406 -0.5239 -0.9088 1050972 BSPBio_000740 CC1(O)CCOC(=O)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E23 mock treatment 1479.0 -353.34 -0.3047 1361.0 -172.28 -0.1396 -0.3142 -0.9373 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 E24 mock treatment 1133.0 -699.34 -0.6032 503.0 -1030.3 -0.8346 -1.0167 -0.9873 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F01 mock treatment 2161.0 328.66 0.2835 2042.0 508.72 0.4121 0.4918 0.9833 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F02 mock treatment 2358.0 525.66 0.4534 1695.0 161.72 0.131 0.4132 0.8756 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F03 compound treatment 2126.0 293.66 0.2533 2230.0 696.72 0.5644 0.5782 0.9346 3616829 BSPBio_000741 CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)N3CCNC3=O)c4ccccc4)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F04 compound treatment 1824.0 -8.3438 -0.0072 1402.0 -131.28 -0.1064 -0.0803 -0.7532 2732 BSPBio_000742 Cc1cc(=O)oc2cc(O)ccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F05 compound treatment 3303.0 1470.7 1.2684 4593.0 3059.7 2.4787 2.6496 0.9516 1303 BSPBio_000743 C[N+]1(CCC2CC1)CC2OC(=O)C(O)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F06 compound treatment 2687.0 854.66 0.7371 2038.0 504.72 0.4089 0.8103 0.9613 1978 BSPBio_000744 OC(=O)/C=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F07 compound treatment 3426.0 1593.7 1.3745 2520.0 986.72 0.7994 1.5371 0.9667 1529 BSPBio_000745 COc1cc(NS(=O)(=O)c2ccc(N)cc2)ncn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F08 compound treatment 3371.0 1538.7 1.327 2393.0 859.72 0.6965 1.4308 0.9547 3069737 BSPBio_000746 CN(C(=O)C(Cl)Cl)c1ccc(OC(=O)c2ccco2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F09 compound treatment 3326.0 1493.7 1.2882 2475.0 941.72 0.7629 1.4504 0.9687 1114 BSPBio_000747 NS(=O)(=O)c1cc2c(N=C(CSCc3ccccc3)NS2(=O)=O)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F10 compound treatment 2684.0 851.66 0.7345 1603.0 69.719 0.0565 0.5593 0.7592 2743 BSPBio_000748 CC(C)(C(=O)c1cccnc1)c2cccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F11 compound treatment 3459.0 1626.7 1.4029 2467.0 933.72 0.7564 1.5269 0.958 1000 BSPBio_000749 NS(=O)(=O)c1cc2c(NC(NS2(=O)=O)C(Cl)Cl)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F12 compound treatment 2275.0 442.66 0.3818 2127.0 593.72 0.481 0.6101 0.9935 3202 BSPBio_000750 COc1ccccc1N2CCN(CCCNc3cc(=O)n(C)c(=O)n3C)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F13 compound treatment 2762.0 929.66 0.8018 1687.0 153.72 0.1245 0.655 0.8073 1052436 BSPBio_000751 CCN(CC)CCc1nc(no1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F14 compound treatment 0.0 -1832.3 -1.5803 39.0 -1494.3 -1.2105 -1.9734 -0.9913 23081 BSPBio_000752 Fc1ccc(cc1)C(CCCN2CCC3(CC2)N(CNC3=O)c4ccccc4)c5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F15 compound treatment 2416.0 583.66 0.5034 1529.0 -4.2813 -0.0035 0.3535 0.7022 1397 BSPBio_000753 CC(C)[N+](C)(CCOC(=O)C1c2ccccc2Oc3ccccc13)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F16 compound treatment 1935.0 102.66 0.0885 1458.0 -75.281 -0.061 0.0195 0.1812 1472 BSPBio_000754 CC(C)Cc1ccc(cc1)[C@H](C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F17 compound treatment 4.0 -1828.3 -1.5769 1.0 -1532.3 -1.2413 -1.9928 -0.993 3187885 BSPBio_000755 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F18 compound treatment 787.0 -1045.3 -0.9016 635.0 -898.28 -0.7277 -1.1521 -0.9944 3187900 BSPBio_000756 CC(=O)O[C@H]1CC[C@@H]2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(OC(=O)C)C#C)[C@@H]3CCC2=C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F19 compound treatment 2405.0 572.66 0.4939 1540.0 6.7188 0.0054 0.3531 0.7149 1519 BSPBio_000757 CC1(C)OC(=O)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F20 compound treatment 1822.0 -10.344 -0.0089 1256.0 -277.28 -0.2246 -0.1651 -0.7346 1440 BSPBio_000758 COc1ccc2cc(CCC(=O)C)ccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F21 compound treatment 45.0 -1787.3 -1.5415 3.0 -1530.3 -1.2397 -1.9666 -0.9942 852 BSPBio_000759 CCOc1ccc(Cc2nccc3cc(OCC)c(OCC)cc23)cc1OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F22 compound treatment 1248.0 -584.34 -0.504 942.0 -591.28 -0.479 -0.6951 -0.9997 907434 BSPBio_000760 CNCCC(Oc1ccccc1OC)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F23 mock treatment 1778.0 -54.344 -0.0469 170.0 -1363.3 -1.1044 -0.8141 -0.7365 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 F24 mock treatment 1041.0 -791.34 -0.6825 731.0 -802.28 -0.6499 -0.9422 -0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G01 mock treatment 1823.0 -9.3438 -0.0081 1399.0 -134.28 -0.1088 -0.0826 -0.7574 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G02 mock treatment 1233.0 -599.34 -0.5169 1318.0 -215.28 -0.1744 -0.4888 -0.8961 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G03 compound treatment 677.0 -1155.3 -0.9964 520.0 -1013.3 -0.8209 -1.285 -0.9954 3129 BSPBio_000761 CC(=O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@@]4(C)[C@@H]3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G04 compound treatment 936.0 -896.34 -0.7731 1051.0 -482.28 -0.3907 -0.8229 -0.95 3480633 BSPBio_000762 COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)C4CCCO4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G05 compound treatment 59.0 -1773.3 -1.5294 55.0 -1478.3 -1.1976 -1.9283 -0.9927 1025381 BSPBio_000763 COc1ccc2CC3N(CCc4cc5OCOc5cc34)Cc2c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G06 compound treatment 1267.0 -565.34 -0.4876 1100.0 -433.28 -0.351 -0.593 -0.987 1404 BSPBio_000764 Nc1ccc(N=Nc2ccccc2)c(N)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G07 compound treatment 1823.0 -9.3438 -0.0081 2080.0 546.72 0.4429 0.3075 0.6941 3616781 BSPBio_000765 CCN1C[C@]2(C)CC[C@H](OC)[C@@]34[C@@H]2[C@H](OC(=O)C)[C@@]5(OCO[C@]65C[C@H](OC)[C@H]7C[C@]4(O)[C@@H]6[C@H]7OC)C13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G08 compound treatment 797.0 -1035.3 -0.8929 640.0 -893.28 -0.7237 -1.1431 -0.9946 1451 BSPBio_000766 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G09 compound treatment 1526.0 -306.34 -0.2642 1018.0 -515.28 -0.4174 -0.482 -0.9757 1182082 BSPBio_000767 Cn1c(cc(=O)c2ccccc12)c3ccc4OCOc4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G10 compound treatment 1475.0 -357.34 -0.3082 749.0 -784.28 -0.6354 -0.6672 -0.9448 1438 BSPBio_000768 CC(C(=O)O)c1cccc(Oc2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G11 compound treatment 980.0 -852.34 -0.7351 860.0 -673.28 -0.5454 -0.9055 -0.9892 3616783 BSPBio_000769 CN1CCC2=C[C@H](O)[C@H]3OC(=O)c4cc5OCOc5cc4[C@H]3[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G12 compound treatment 1325.0 -507.34 -0.4376 1115.0 -418.28 -0.3389 -0.549 -0.992 963 BSPBio_000770 CCN1CCN(C(=O)N[C@@H](C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4ccccc4)C(=O)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G13 compound treatment 45.0 -1787.3 -1.5415 7.0 -1526.3 -1.2365 -1.9643 -0.994 BSPBio_000771 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G14 compound treatment 707.0 -1125.3 -0.9706 818.0 -715.28 -0.5795 -1.096 -0.9696 1138 BSPBio_000772 CC/C(=C(/CC)\c1ccc(O)cc1)/c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G15 compound treatment 12.0 -1820.3 -1.57 14.0 -1519.3 -1.2308 -1.9804 -0.9927 829 BSPBio_000773 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G16 compound treatment 717.0 -1115.3 -0.9619 447.0 -1086.3 -0.88 -1.3025 -0.999 3057880 BSPBio_000774 COc1ccc(cc1)C(=C(c2ccc(OC)cc2)c3ccc(OC)cc3)Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G17 compound treatment 1023.0 -809.34 -0.698 826.0 -707.28 -0.573 -0.8987 -0.9952 1115322 BSPBio_000775 COc1ccn(C)c(=O)c1C#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G18 compound treatment 67.0 -1765.3 -1.5225 303.0 -1230.3 -0.9967 -1.7813 -0.9789 3616815 BSPBio_000776 NC[C@H]1O[C@H](OC2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)[C@H](N)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G19 compound treatment 1516.0 -316.34 -0.2728 970.0 -563.28 -0.4563 -0.5156 -0.9698 3616785 BSPBio_000777 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)[C@@H](OC)[C@@H]32)C16 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G20 compound treatment 947.0 -885.34 -0.7636 1021.0 -512.28 -0.415 -0.8334 -0.9589 1094620 BSPBio_000778 CC(C[N+](C)(C)C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G21 compound treatment 1138.0 -694.34 -0.5988 1039.0 -494.28 -0.4004 -0.7066 -0.9809 3616786 BSPBio_000779 C/C=C\1/C[N+]2(C)CCC34[C@@H]2C[C@@H]1C(=C4Nc5ccccc53)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G22 compound treatment 993.0 -839.34 -0.7239 521.0 -1012.3 -0.8201 -1.0917 -0.9981 1246 BSPBio_000780 CC[N+]1(C)CCCC(C1)OC(=O)C(O)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G23 mock treatment 1004.0 -828.34 -0.7144 1250.0 -283.28 -0.2295 -0.6674 -0.8895 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 G24 mock treatment 936.0 -896.34 -0.7731 823.0 -710.28 -0.5754 -0.9535 -0.9894 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H01 mock treatment 2410.0 577.66 0.4982 2271.0 737.72 0.5976 0.7749 0.9959 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H02 mock treatment 2500.0 667.66 0.5758 2104.0 570.72 0.4623 0.7341 0.9941 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H03 compound treatment 2764.0 931.66 0.8035 2206.0 672.72 0.545 0.9535 0.9821 1452 BSPBio_000781 CCCCN(CCCC)CCCOC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H04 compound treatment 2559.0 726.66 0.6267 1981.0 447.72 0.3627 0.6996 0.9662 3616848 BSPBio_000782 CC(C)NC[C@@H](O)c1ccc(O)c(O)c1.O[C@H]([C@@H](O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H05 compound treatment 2665.0 832.66 0.7181 2762.0 1228.7 0.9954 1.2117 0.9872 1189 BSPBio_000783 CO[C@]1(NC(=O)Cc2cccs2)[C@H]3SCC(=C(N3C1=O)C(=O)O)COC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H06 compound treatment 74.0 -1758.3 -1.5165 108.0 -1425.3 -1.1546 -1.8888 -0.9909 1001471 BSPBio_000784 Oc1ccc(OCc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H07 compound treatment 2787.0 954.66 0.8234 2879.0 1345.7 1.0902 1.3531 0.9904 1000080 BSPBio_000785 ClCCNP1(=O)OCCCN1CCCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H08 compound treatment 2631.0 798.66 0.6888 1945.0 411.72 0.3335 0.7229 0.9446 1025776 BSPBio_000786 Nc1ccccc1S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H09 compound treatment 2820.0 987.66 0.8518 2444.0 910.72 0.7378 1.124 0.9974 3616830 BSPBio_000787 CO[C@@H]1[C@@H](OC(=O)N)[C@@H](O)C(Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H10 compound treatment 1904.0 71.656 0.0618 1373.0 -160.28 -0.1298 -0.0481 -0.3346 3060043 BSPBio_000788 C[C@@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H11 compound treatment 1263.0 -569.34 -0.491 1224.0 -309.28 -0.2506 -0.5244 -0.9512 1232 BSPBio_000789 OC1=C(O)C(=O)C(=C(O)C1=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H12 compound treatment 2746.0 913.66 0.788 531.0 -1002.3 -0.812 -0.017 -0.015 907370 BSPBio_000790 CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H13 compound treatment 2703.0 870.66 0.7509 2445.0 911.72 0.7386 1.0532 1.0 1029 BSPBio_000791 CC(C(=O)O)c1ccc(cc1)N2Cc3ccccc3C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H14 compound treatment 800.0 -1032.3 -0.8904 542.0 -991.28 -0.8031 -1.1974 -0.9987 117 BSPBio_000792 CCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H15 compound treatment 2987.0 1154.7 0.9958 2508.0 974.72 0.7896 1.2625 0.9934 1276 BSPBio_000793 CC1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@]3(C)[C@@H]2C(=O)C=C4[C@@H]5C[C@](C)(CC[C@]5(C)CC[C@]43C)C(=O)O)OC(=O)CCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H16 compound treatment 2016.0 183.66 0.1584 1854.0 320.72 0.2598 0.2957 0.9718 1000135 BSPBio_000794 CC(C(=O)O)c1ccc(c(F)c1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H17 compound treatment 1084.0 -748.34 -0.6454 681.0 -852.28 -0.6904 -0.9446 -0.9994 3187887 BSPBio_000795 CC(CN(C(=O)C)c1c(I)cc(I)c(N)c1I)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H18 compound treatment 369.0 -1463.3 -1.2621 389.0 -1144.3 -0.927 -1.5479 -0.9885 115 BSPBio_000796 COCCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC(C)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H19 compound treatment 2046.0 213.66 0.1843 1832.0 298.72 0.242 0.3014 0.991 1670 BSPBio_000797 Nc1nc2n(COC(CO)CO)cnc2c(=O)[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H20 compound treatment 1818.0 -14.344 -0.0124 848.0 -685.28 -0.5552 -0.4013 -0.7227 3221506 BSPBio_000798 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)N[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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H21 compound treatment 338.0 -1494.3 -1.2888 549.0 -984.28 -0.7974 -1.4752 -0.9734 727 BSPBio_000799 CCN(CC)C(C)CN1c2ccccc2Sc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H22 compound treatment 1009.0 -823.34 -0.7101 1018.0 -515.28 -0.4174 -0.7973 -0.9679 3616849 BSPBio_000800 O[C@@H]1CCCC[C@H]1N2CCC(CC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H23 mock treatment 1795.0 -37.344 -0.0322 1512.0 -21.281 -0.0172 -0.035 -0.9571 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 H24 mock treatment 1167.0 -665.34 -0.5738 1296.0 -237.28 -0.1922 -0.5417 -0.8951 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I01 mock treatment 3124.0 1291.7 1.114 1724.0 190.72 0.1545 0.897 0.7975 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I02 mock treatment 2859.0 1026.7 0.8854 1325.0 -208.28 -0.1687 0.5068 0.5622 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I03 compound treatment 2712.0 879.66 0.7587 2643.0 1109.7 0.899 1.1721 0.9964 3069541 BSPBio_000801 C[C@H]1[C@H]2[C@H](OC1=O)[C@H]3C(=CC(=O)C3=C(C)C[C@@H]2O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I04 compound treatment 1900.0 67.656 0.0584 1901.0 367.72 0.2979 0.2519 0.8298 1429 BSPBio_000802 CCCCOC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I05 compound treatment 640.0 -1192.3 -1.0283 1440.0 -93.281 -0.0756 -0.7806 -0.757 3616789 BSPBio_000803 CC[N+]1(C)[C@H]2CC[C@@H]1CC(C2)OC(=O)[C@H]3CCC(C(=O)OC4C[C@@H]5CC[C@H](C4)[N+]5(C)CC)(c6ccccc6)c7ccccc37 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I06 compound treatment 3121.0 1288.7 1.1114 2556.0 1022.7 0.8285 1.3717 0.9895 867 BSPBio_000804 Nc1ccc(cc1)S(=O)(=O)Nc2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I07 compound treatment 2688.0 855.66 0.738 3672.0 2138.7 1.7326 1.747 0.9276 3173628 BSPBio_000805 CN1C(C)(C)CCCC1(C)C.OC(C(O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I08 compound treatment 2219.0 386.66 0.3335 2223.0 689.72 0.5588 0.6309 0.9696 1001 BSPBio_000806 CN(C)CCOC(=O)COc1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I09 compound treatment 2191.0 358.66 0.3093 2958.0 1424.7 1.1542 1.0349 0.8661 3616793 BSPBio_000807 CO[C@H](C)C(O)(C(C)C)C(=O)OCC1=CCN2CC[C@H](O)[C@H]21 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I10 compound treatment 2306.0 473.66 0.4085 1374.0 -159.28 -0.129 0.1976 0.4613 3069584 BSPBio_000808 [O-][N+](=O)c1ccc(/C=N/N2CC(CN3CCOCC3)OC2=O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I11 compound treatment 1151.0 -681.34 -0.5876 1262.0 -271.28 -0.2198 -0.5709 -0.91 3616795 BSPBio_000809 C1CN[C@H]2[C@@H](C1)C3CCC2[C@H]4N3CCc5c4[nH]c6ccccc56 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I12 compound treatment 1112.0 -720.34 -0.6213 742.0 -791.28 -0.641 -0.8926 -0.9999 837 BSPBio_000810 CCOc1ccc2NC(C)(C)C=C(C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I13 compound treatment 91.0 -1741.3 -1.5018 46.0 -1487.3 -1.2049 -1.9139 -0.994 3069543 BSPBio_000811 O[C@H]1C=C2CCN3Cc4cc5OCOc5cc4[C@@H](C32)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I14 compound treatment 2677.0 844.66 0.7285 2324.0 790.72 0.6406 0.9681 0.9979 2575 BSPBio_000812 CCS(=O)(=O)CCn1c(C)ncc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I15 compound treatment 2531.0 698.66 0.6026 2382.0 848.72 0.6876 0.9123 0.9978 3616797 BSPBio_000813 CCN1C[C@]2(C)CC[C@H](O)[C@]3([C@@H]4C[C@H]5C(O)[C@@H]4[C@](O)(C[C@@H]5OC)[C@H]6C[C@@H]32)C61 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I16 compound treatment 2090.0 257.66 0.2222 1286.0 -247.28 -0.2003 0.0155 0.0517 3187758 BSPBio_000814 NC(=N)NCC1COC2(CCCCC2)O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I17 compound treatment 2576.0 743.66 0.6414 2332.0 798.72 0.6471 0.9111 1.0 3187745 BSPBio_000815 C[C@@]12CC[C@H]3[C@@H](CCc4cc(OS(=O)(=O)O)ccc34)[C@@H]2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I18 compound treatment 1891.0 58.656 0.0506 1408.0 -125.28 -0.1015 -0.036 -0.3174 3616817 BSPBio_000816 Nc1ncnc2n(cnc12)C3O[C@H](CO)[C@@H](O)[C@@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I19 compound treatment 2466.0 633.66 0.5465 2383.0 849.72 0.6884 0.8732 0.9935 3616800 BSPBio_000817 CO[C@H]1C=C2CCN(C)[C@H]2C3[C@@H]1OC(=O)c4cc5OCOc5cc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I20 compound treatment 1795.0 -37.344 -0.0322 2235.0 701.72 0.5685 0.3792 0.666 1094 BSPBio_000818 COc1cnc(NS(=O)(=O)c2ccc(N)cc2)nc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I21 compound treatment 1912.0 79.656 0.0687 1666.0 132.72 0.1075 0.1246 0.9766 3616802 BSPBio_000819 CCN1C[C@]2(C)CC[C@H](O)[C@]3([C@@H]2C[C@H]4C13)[C@@H]5C[C@H](O)[C@H]6C[C@]45[C@H](O)C6=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I22 compound treatment 1462.0 -370.34 -0.3194 1059.0 -474.28 -0.3842 -0.4975 -0.9958 888 BSPBio_000820 CC(C)[N+](C)(CCC(C(=O)N)(c1ccccc1)c2ccccc2)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I23 mock treatment 1650.0 -182.34 -0.1573 1745.0 211.72 0.1715 0.0101 0.0433 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 I24 mock treatment 1223.0 -609.34 -0.5255 967.0 -566.28 -0.4588 -0.696 -0.9977 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J01 mock treatment 2190.0 357.66 0.3085 1821.0 287.72 0.2331 0.3829 0.9905 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J02 mock treatment 2393.0 560.66 0.4835 1806.0 272.72 0.2209 0.4981 0.937 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J03 compound treatment 1281.0 -551.34 -0.4755 601.0 -932.28 -0.7553 -0.8703 -0.9751 3187888 BSPBio_000821 O=C1OC2(C[C@H]3C=CC2=C1)[C@H]4CCCCN34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J04 compound treatment 2516.0 683.66 0.5896 1379.0 -154.28 -0.125 0.3286 0.5451 1637 BSPBio_000822 CN/C(=C/[N+](=O)[O-])/NCCSCc1csc(CN(C)C)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J05 compound treatment 328.0 -1504.3 -1.2974 415.0 -1118.3 -0.9059 -1.558 -0.9846 3044756 BSPBio_000823 CC(CN(C)C)CN1c2ccccc2Sc3ccccc13.OC(C(O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J06 compound treatment 1446.0 -386.34 -0.3332 943.0 -590.28 -0.4782 -0.5737 -0.9844 3188017 BSPBio_000824 S=C(NC1CCCCC1)N2CCC(CC2)C3C=NC=N3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J07 compound treatment 2552.0 719.66 0.6207 1405.0 -128.28 -0.1039 0.3654 0.5806 3187889 BSPBio_000825 CCOc1ccc2ccccc2c1C(=O)N[C@H]3[C@H]4SC(C)(C)[C@@H](N4C3=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J08 compound treatment 1704.0 -128.34 -0.1107 1900.0 366.72 0.2971 0.1318 0.4157 3061617 BSPBio_000826 OC(CNCCNC(=O)N1CCOCC1)COc2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J09 compound treatment 2445.0 612.66 0.5284 2207.0 673.72 0.5458 0.7596 0.9999 1057 BSPBio_000827 OC(CCN1CCCC1)(C2CCCCC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J10 compound treatment 2957.0 1124.7 0.97 1306.0 -227.28 -0.1841 0.5557 0.5628 1000092 BSPBio_000828 COc1ccc(cc1OC2CCCC2)C3CNC(=O)C3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J11 compound treatment 3184.0 1351.7 1.1657 1971.0 437.72 0.3546 1.075 0.8823 3074401 BSPBio_000829 CN(C)CCCO[C@H]1[C@H](O[C@@H]2OC(C)(C)O[C@H]12)[C@H](O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J12 compound treatment 5.0 -1827.3 -1.576 7.0 -1526.3 -1.2365 -1.9887 -0.9928 1007994 BSPBio_000830 CCCCCCCCCCCCCCCC[N+](C)(C)CCN(Cc1ccc(OC)cc1)c2ncccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J13 compound treatment 3157.0 1324.7 1.1425 1620.0 86.719 0.0703 0.8575 0.7492 2710 BSPBio_000831 COc1ccc2[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#C)[C@@H]3CCc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J14 compound treatment 2004.0 171.66 0.148 1022.0 -511.28 -0.4142 -0.1882 -0.4279 3060036 BSPBio_000832 C1CN=C(N1)C2COc3ccccc3O2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J15 compound treatment 3044.0 1211.7 1.045 1928.0 394.72 0.3198 0.965 0.8831 3452 BSPBio_000833 CC(C)(C)NC[C@H](O)COc1cccc2C(=O)CCCc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J16 compound treatment 2576.0 743.66 0.6414 1486.0 -47.281 -0.0383 0.4264 0.6637 2844 BSPBio_000834 CCN(CC)C(=O)N[C@H]1C[C@H]2[C@@H](Cc3c[nH]c4cccc2c34)N(C)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J17 compound treatment 2971.0 1138.7 0.982 2012.0 478.72 0.3878 0.9686 0.9174 3487254 BSPBio_000835 CC(=O)N(CC(O)CN(C(=O)C)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I)c2c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c2I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J18 compound treatment 2042.0 209.66 0.1808 1255.0 -278.28 -0.2254 -0.0316 -0.1092 1765 BSPBio_000836 CC1(C)NC(=O)N(C1=O)c2ccc([N+](=O)[O-])c(c2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J19 compound treatment 2821.0 988.66 0.8527 1725.0 191.72 0.1553 0.7128 0.8224 3069696 BSPBio_000837 CN(C)[C@H]1C2CC3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)NCN4CCCC4)C(=O)c5c(O)cccc5[C@@]3(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J20 compound treatment 2179.0 346.66 0.299 1435.0 -98.281 -0.0796 0.1551 0.5013 3172846 BSPBio_000838 NC(CO)(CO)CO.OC(=O)C1CCn2c(ccc12)C(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J21 compound treatment 1766.0 -66.344 -0.0572 1413.0 -120.28 -0.0974 -0.1094 -0.9678 1405 BSPBio_000839 C[C@@]12CC[C@H]3C(=CCc4cc(O)ccc34)[C@@H]2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J22 compound treatment 249.0 -1583.3 -1.3656 94.0 -1439.3 -1.166 -1.7901 -0.9969 4487 BSPBio_000840 CNCCCC1c2ccccc2C=Cc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J23 mock treatment 2230.0 397.66 0.343 1385.0 -148.28 -0.1201 0.1576 0.4336 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 J24 mock treatment 1581.0 -251.34 -0.2168 1210.0 -323.28 -0.2619 -0.3385 -0.9956 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K01 mock treatment 2720.0 887.66 0.7656 2688.0 1154.7 0.9355 1.2028 0.995 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K02 mock treatment 2051.0 218.66 0.1886 1706.0 172.72 0.1399 0.2323 0.9892 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K03 compound treatment 2331.0 498.66 0.4301 2570.0 1036.7 0.8399 0.898 0.9517 3616804 BSPBio_000841 COc1cc(ccc1O)C(=O)O[C@@H]2C[C@@H]3CC[C@H](C2)N3C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K04 compound treatment 286.0 -1546.3 -1.3337 223.0 -1310.3 -1.0615 -1.6936 -0.9936 3187759 BSPBio_000842 CCC(=O)OCC(=O)C1(OC(=O)CC)[C@H](C)C[C@H]2[C@@H]3[C@H](Cl)CC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K05 compound treatment 2028.0 195.66 0.1687 2458.0 924.72 0.7491 0.649 0.8452 3480066 BSPBio_000843 CN(C)CCCC1(OCc2cc(C#N)ccc21)c3ccc(F)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K06 compound treatment 518.0 -1314.3 -1.1336 925.0 -608.28 -0.4928 -1.15 -0.9304 1499 BSPBio_000844 Cc1oncc1C(=O)Nc2ccc(cc2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K07 compound treatment 423.0 -1409.3 -1.2155 621.0 -912.28 -0.7391 -1.3821 -0.9716 1047 BSPBio_000845 CN(C)CCCN1c2ccccc2Sc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K08 compound treatment 2083.0 250.66 0.2162 1495.0 -38.281 -0.031 0.1309 0.5995 3069624 BSPBio_000846 CC[C@@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K09 compound treatment 2666.0 833.66 0.719 2681.0 1147.7 0.9298 1.1659 0.9919 1177 BSPBio_000847 Cc1ccnc(NS(=O)(=O)c2ccc(N)cc2)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K10 compound treatment 286.0 -1546.3 -1.3337 252.0 -1281.3 -1.038 -1.677 -0.9923 3187760 BSPBio_000848 CC(=O)OCC(=O)[C@]12OC(C)(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@@]31C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K11 compound treatment 2199.0 366.66 0.3162 1699.0 165.72 0.1343 0.3185 0.9272 1463 BSPBio_000849 COc1ccc(cc1)c2cc(=O)c3c(O)cc(O)cc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K12 compound treatment 2588.0 755.66 0.6517 2656.0 1122.7 0.9095 1.104 0.9866 934 BSPBio_000850 Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K13 compound treatment 2738.0 905.66 0.7811 2432.0 898.72 0.7281 1.0671 0.9994 1424515 BSPBio_000851 CCN1C(=O)NC(C1=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K14 compound treatment 2558.0 725.66 0.6258 1823.0 289.72 0.2347 0.6085 0.9104 896 BSPBio_000852 COc1ccccc1OCC(O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K15 compound treatment 2476.0 643.66 0.5551 2199.0 665.72 0.5393 0.7739 0.9999 3069570 BSPBio_000853 C[C@@]12CCC3[C@@H](CC[C@@H]4C[C@H](O)CC[C@@]43C)[C@@H]2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K16 compound treatment 6.0 -1826.3 -1.5751 5.0 -1528.3 -1.2381 -1.9893 -0.9929 1324 BSPBio_000854 CCCCC(CC)CNC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NCC(CC)CCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K17 compound treatment 2669.0 836.66 0.7216 2284.0 750.72 0.6082 0.9403 0.9964 1444 BSPBio_000855 C1CN=C(N1)C2CCCc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K18 compound treatment 1018.0 -814.34 -0.7023 382.0 -1151.3 -0.9327 -1.1561 -0.9902 1338 BSPBio_000856 CCCC(C(=O)OCCN(CC)CC)(c1ccccc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K19 compound treatment 1583.0 -249.34 -0.215 1147.0 -386.28 -0.3129 -0.3733 -0.9832 1070 BSPBio_000857 CCC(C(CC)c1ccc(O)cc1)c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K20 compound treatment 1559.0 -273.34 -0.2357 1511.0 -22.281 -0.0181 -0.1795 -0.759 1533 BSPBio_000858 Cc1cc(CC(=O)O)n(C)c1C(=O)c2ccc(Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K21 compound treatment 1835.0 2.6563 0.0023 1514.0 -19.281 -0.0156 -0.0094 -0.597 1000312 BSPBio_000859 CO[C@]1(NC(=O)CSCC#N)[C@H]2SCC(=C(N2C1=O)C(=O)O)CSc3nnnn3C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K22 compound treatment 1473.0 -359.34 -0.3099 1213.0 -320.28 -0.2595 -0.4026 -0.9961 956 BSPBio_000860 CCn1nc(C(=O)O)c(=O)c2cc3OCOc3cc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K23 mock treatment 1677.0 -155.34 -0.134 1247.0 -286.28 -0.2319 -0.2587 -0.966 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 K24 mock treatment 1386.0 -446.34 -0.385 1350.0 -183.28 -0.1485 -0.3772 -0.9142 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L01 mock treatment 2933.0 1100.7 0.9493 2249.0 715.72 0.5798 1.0812 0.972 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L02 mock treatment 2391.0 558.66 0.4818 1876.0 342.72 0.2776 0.537 0.9657 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L03 compound treatment 578.0 -1254.3 -1.0818 235.0 -1298.3 -1.0518 -1.5087 -0.9999 3197 BSPBio_000861 Fc1ccc(cc1)[C@@H]2CCNC[C@H]2COc3ccc4OCOc4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L04 compound treatment 840.0 -992.34 -0.8559 188.0 -1345.3 -1.0898 -1.3758 -0.9928 1677 BSPBio_000862 CC(C)c1cccc(C(C)C)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L05 compound treatment 2499.0 666.66 0.575 2183.0 649.72 0.5263 0.7787 0.999 3187892 BSPBio_000863 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)C3(O)C(=C2C(=O)c4c(O)cccc14)O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L06 compound treatment 741.0 -1091.3 -0.9412 469.0 -1064.3 -0.8622 -1.2752 -0.999 3560914 BSPBio_000864 CCN1CCC[C@H]1CNC(=O)c2c(O)c(CC)cc(Cl)c2OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L07 compound treatment 2789.0 956.66 0.8251 2562.0 1028.7 0.8334 1.1727 1.0 1000323 BSPBio_000865 N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L08 compound treatment 2575.0 742.66 0.6405 1912.0 378.72 0.3068 0.6699 0.9432 962 BSPBio_000866 CCC1(C(=O)NCNC1=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L09 compound treatment 2576.0 743.66 0.6414 2430.0 896.72 0.7264 0.9672 0.9981 3616837 BSPBio_000867 CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2C[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(=N\OCOCCOC)/[C@H](C)[C@@H](O)[C@]1(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L10 compound treatment 2303.0 470.66 0.4059 1591.0 57.719 0.0468 0.3201 0.7834 1910 BSPBio_000868 Nc1nc(=O)[nH]cc1F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L11 compound treatment 868.0 -964.34 -0.8317 751.0 -782.28 -0.6337 -1.0362 -0.991 1000270 BSPBio_000869 CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@@]21C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L12 compound treatment 2995.0 1162.7 1.0027 2164.0 630.72 0.511 1.0703 0.9511 3069740 BSPBio_000870 C[C@]1(N[C@H]2Cc3ccccc31)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L13 compound treatment 2816.0 983.66 0.8484 2411.0 877.72 0.7111 1.1027 0.9961 865 BSPBio_000871 Cc1ccc(cc1)C(=O)c2ccc(CC(=O)O)n2C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L14 compound treatment 2210.0 377.66 0.3257 1346.0 -187.28 -0.1517 0.123 0.3424 3616850 BSPBio_000872 C[N+](C)(CCOc1ccccc1)Cc2ccccc2.OC(=O)c1cc2ccccc2cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L15 compound treatment 2760.0 927.66 0.8001 2313.0 779.72 0.6317 1.0124 0.9932 3069698 BSPBio_000873 CC(C)(C)NC[C@@H](O)COc1cccc2C(=O)CCCc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L16 compound treatment 1974.0 141.66 0.1222 1722.0 188.72 0.1529 0.1945 0.9938 3069741 BSPBio_000874 CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3CC=C2C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L17 compound treatment 1644.0 -188.34 -0.1624 1157.0 -376.28 -0.3048 -0.3304 -0.9566 1215118 BSPBio_000875 COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)C4COc5ccccc5O4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L18 compound treatment 1478.0 -354.34 -0.3056 1409.0 -124.28 -0.1007 -0.2873 -0.8929 1095 BSPBio_000876 NC(CO)C(=O)NNCc1ccc(O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L19 compound treatment 248.0 -1584.3 -1.3664 328.0 -1205.3 -0.9764 -1.6566 -0.9864 3616839 BSPBio_000877 CC(C)n1c(/C=C/[C@H](O)C[C@H](O)CC(=O)O)c(c2ccc(F)cc2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L20 compound treatment 648.0 -1184.3 -1.0214 1160.0 -373.28 -0.3024 -0.9361 -0.8787 2685 BSPBio_000878 OC(=O)c1c(I)cc(I)c(NC(=O)CCCCC(=O)Nc2c(I)cc(I)c(C(=O)O)c2I)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L21 compound treatment 2145.0 312.66 0.2697 2018.0 484.72 0.3927 0.4683 0.9832 3069699 BSPBio_000879 C[C@@H]1NC(=O)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L22 compound treatment 1036.0 -796.34 -0.6868 813.0 -720.28 -0.5835 -0.8983 -0.9967 1020463 BSPBio_000880 Oc1cc2ccc(=O)oc2cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L23 mock treatment 1741.0 -91.344 -0.0788 1527.0 -6.2813 -0.0051 -0.0593 -0.7512 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 L24 mock treatment 1481.0 -351.34 -0.303 1461.0 -72.281 -0.0586 -0.2557 -0.8284 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M01 mock treatment 2479.0 646.66 0.5577 2492.0 958.72 0.7767 0.9436 0.9868 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M02 mock treatment 2330.0 497.66 0.4292 1816.0 282.72 0.229 0.4654 0.9567 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M03 compound treatment 2365.0 532.66 0.4594 1657.0 123.72 0.1002 0.3957 0.8416 1005 BSPBio_000881 OC(CCN1CCCCC1)(C2CCCCC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M04 compound treatment 315.0 -1517.3 -1.3086 235.0 -1298.3 -1.0518 -1.6691 -0.9941 3069627 BSPBio_000882 CCC(=O)OC1([C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C)C(=O)CCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M05 compound treatment 2439.0 606.66 0.5232 2781.0 1247.7 1.0108 1.0847 0.953 1603 BSPBio_000883 OC(=O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc2nccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M06 compound treatment 17.0 -1815.3 -1.5657 41.0 -1492.3 -1.2089 -1.9619 -0.9918 1001531 BSPBio_000884 COc1cc(cc(OC)c1OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@@H](O)c4cc5OCOc5cc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M07 compound treatment 569.0 -1263.3 -1.0896 342.0 -1191.3 -0.9651 -1.4529 -0.9982 907320 BSPBio_000885 CC(C)c1c(CN(C)C(C)Cc2ccccc2)n(C)n(c3ccccc3)c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M08 compound treatment 2322.0 489.66 0.4223 1822.0 288.72 0.2339 0.464 0.9612 877 BSPBio_000886 CC(C)(Oc1ccc(Cl)cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M09 compound treatment 2539.0 706.66 0.6095 1788.0 254.72 0.2064 0.5769 0.8965 955 BSPBio_000887 CCN(CC)CCNC(=O)c1cc(Br)c(N)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M10 compound treatment 2896.0 1063.7 0.9174 2156.0 622.72 0.5045 1.0054 0.9603 917 BSPBio_000888 NS(=O)(=O)c1cc2c(NC(Cc3ccccc3)NS2(=O)=O)cc1C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M11 compound treatment 62.0 -1770.3 -1.5268 9.0 -1524.3 -1.2348 -1.9528 -0.9945 1286 BSPBio_000889 Cc1cc(ccc1OCCOCC[N+](C)(C)Cc2ccccc2)C(C)(C)CC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M12 compound treatment 2515.0 682.66 0.5888 2785.0 1251.7 1.014 1.1333 0.9666 1481 BSPBio_000890 Oc1c(Cc2c(O)c3ccccc3oc2=O)c(=O)oc4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M13 compound treatment 802.0 -1030.3 -0.8886 686.0 -847.28 -0.6864 -1.1137 -0.9919 863 BSPBio_000891 CN1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M14 compound treatment 1932.0 99.656 0.0859 1500.0 -33.281 -0.027 0.0417 0.463 3092 BSPBio_000892 Cn1ccnc1S 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M15 compound treatment 1743.0 -89.344 -0.0771 1567.0 33.719 0.0273 -0.0352 -0.4302 1441 BSPBio_000893 CN1CCC(CC1)OC(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M16 compound treatment 7268.0 5435.7 4.688 7816.0 6282.7 5.0897 6.9139 0.9992 3616821 BSPBio_000894 O[Hg]c1c(O)c(Br)cc2c1Oc3cc(O)c(Br)cc3C42OC(=O)c5ccccc54 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M17 compound treatment 4.0 -1828.3 -1.5769 5.0 -1528.3 -1.2381 -1.9905 -0.9928 1373 BSPBio_000895 CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M18 compound treatment 2286.0 453.66 0.3913 1473.0 -60.281 -0.0488 0.2421 0.6141 3187761 BSPBio_000896 CC(CNC1CCCCC1)OC(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M19 compound treatment 2103.0 270.66 0.2334 1727.0 193.72 0.1569 0.276 0.9813 1012 BSPBio_000897 Cc1cc2cc3c(C)cc(=O)oc3c(C)c2o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M20 compound treatment 225.0 -1607.3 -1.3863 331.0 -1202.3 -0.974 -1.669 -0.9851 793 BSPBio_000898 CCN(CC)CCOC(=O)C(C1CCCCC1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M21 compound treatment 1751.0 -81.344 -0.0702 1407.0 -126.28 -0.1023 -0.1219 -0.9831 2117332 BSPBio_000899 C[C@@]12CC[C@H]3[C@@H](CC[C@]4(O)C[C@@H](O)CC[C@]34C=O)[C@@]2(O)CC[C@@H]1C5=CC(=O)OC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M22 compound treatment 8.0 -1824.3 -1.5734 2.0 -1531.3 -1.2405 -1.9898 -0.9931 2080598 BSPBio_000900 C[C@H]1C[C@H](C)C(=O)[C@@H](C1)[C@H](O)CC2CC(=O)NC(=O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M23 mock treatment 1796.0 -36.344 -0.0313 1781.0 247.72 0.2007 0.1197 0.5895 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 M24 mock treatment 1073.0 -759.34 -0.6549 1313.0 -220.28 -0.1785 -0.5893 -0.8681 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N01 mock treatment 2733.0 900.66 0.7768 2861.0 1327.7 1.0756 1.3098 0.9872 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N02 mock treatment 2573.0 740.66 0.6388 2256.0 722.72 0.5855 0.8657 0.9991 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N03 compound treatment 1848.0 15.656 0.0135 1613.0 79.719 0.0646 0.0552 0.8369 1764 BSPBio_000901 NCC1(CC(=O)O)CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N04 compound treatment 1995.0 162.66 0.1403 1590.0 56.719 0.0459 0.1317 0.8921 2030 BSPBio_000902 OC(=O)CN(CCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N05 compound treatment 1161.0 -671.34 -0.579 1119.0 -414.28 -0.3356 -0.6467 -0.9664 1694 BSPBio_000903 Oc1ccc(cc1)c2sc3cc(O)ccc3c2C(=O)c4ccc(OCCN5CCCCC5)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N06 compound treatment 2834.0 1001.7 0.8639 2267.0 733.72 0.5944 1.0312 0.9833 907192 BSPBio_000904 CC[N+](C)(C)Cc1ccccc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N07 compound treatment 2702.0 869.66 0.75 1910.0 376.72 0.3052 0.7462 0.9215 2764 BSPBio_000905 CC(O)(P(=O)(O)O)P(=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N08 compound treatment 2936.0 1103.7 0.9519 2365.0 831.72 0.6738 1.1495 0.9857 3172714 BSPBio_000906 C[n+]1ccccc1/C=N/O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N09 compound treatment 2858.0 1025.7 0.8846 2028.0 494.72 0.4008 0.9089 0.9359 3069699 BSPBio_000907 C[C@@H]1NC(=O)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N10 compound treatment 12.0 -1820.3 -1.57 48.0 -1485.3 -1.2032 -1.961 -0.9914 1395 BSPBio_000908 CC(COc1ccccc1)N(CCCl)Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N11 compound treatment 329.0 -1503.3 -1.2966 198.0 -1335.3 -1.0817 -1.6817 -0.9959 1000094 BSPBio_000909 CCC(C)(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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N12 compound treatment 695.0 -1137.3 -0.9809 673.0 -860.28 -0.6969 -1.1864 -0.986 3480629 BSPBio_000910 OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N13 compound treatment 1179.0 -653.34 -0.5635 1258.0 -275.28 -0.223 -0.5561 -0.9177 3616840 BSPBio_000911 Nc1ncn(C2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N14 compound treatment 3081.0 1248.7 1.0769 2133.0 599.72 0.4858 1.105 0.9353 1371 BSPBio_000912 CN(C)c1nc(nc(n1)N(C)C)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N15 compound treatment 2944.0 1111.7 0.9588 2410.0 876.72 0.7102 1.1802 0.9891 3616841 BSPBio_000913 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N16 compound treatment 621.0 -1211.3 -1.0447 569.0 -964.28 -0.7812 -1.2911 -0.9897 349 BSPBio_000914 COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)c4ccco4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N17 compound treatment 2675.0 842.66 0.7268 1860.0 326.72 0.2647 0.7011 0.9064 1267 BSPBio_000915 CC(=O)Nc1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N18 compound treatment 2114.0 281.66 0.2429 1736.0 202.72 0.1642 0.2879 0.9818 1428570 BSPBio_000916 CC(C)(C)NC[C@H](O)COc1nsnc1N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N19 compound treatment 1963.0 130.66 0.1127 1842.0 308.72 0.2501 0.2565 0.9352 1604 BSPBio_000917 OC(=O)c1ccccc1C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3nccs3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N20 compound treatment 1933.0 100.66 0.0868 1612.0 78.719 0.0638 0.1065 0.9885 893 BSPBio_000918 NCC(O)c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N21 compound treatment 683.0 -1149.3 -0.9913 512.0 -1021.3 -0.8274 -1.286 -0.996 2137 BSPBio_000919 Oc1cc(O)c2c(=O)cc(oc2c1)c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N22 compound treatment 2019.0 186.66 0.161 1671.0 137.72 0.1116 0.1927 0.984 806 BSPBio_000920 OC(=O)C1CCCNC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N23 mock treatment 2000.0 167.66 0.1446 1758.0 224.72 0.182 0.231 0.9935 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 N24 mock treatment 1175.0 -657.34 -0.5669 1171.0 -362.28 -0.2935 -0.6084 -0.953 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O01 mock treatment 2307.0 474.66 0.4094 1740.0 206.72 0.1675 0.4079 0.9222 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O02 mock treatment 2176.0 343.66 0.2964 1711.0 177.72 0.144 0.3114 0.945 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O03 compound treatment 2525.0 692.66 0.5974 2059.0 525.72 0.4259 0.7236 0.9862 1155 BSPBio_000921 Nc1ccc(cc1)S(=O)(=O)NC(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O04 compound treatment 966.0 -866.34 -0.7472 1309.0 -224.28 -0.1817 -0.6568 -0.8542 1000165 BSPBio_000922 COc1ccc2cc(ccc2c1)[C@@H](C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O05 compound treatment 2401.0 568.66 0.4904 2523.0 989.72 0.8018 0.9137 0.9722 1513 BSPBio_000923 CCOC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O06 compound treatment 2393.0 560.66 0.4835 1766.0 232.72 0.1885 0.4752 0.9157 244 BSPBio_000924 CC[N+](C)(CC)CCC[n+]1c(c2ccccc2)c3cc(N)ccc3c4ccc(N)cc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O07 compound treatment 1566.0 -266.34 -0.2297 4032.0 2498.7 2.0242 1.2689 0.6229 1242 BSPBio_000925 CN(CS(=O)(=O)O)c1c(C)n(C)n(c2ccccc2)c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O08 compound treatment 107.0 -1725.3 -1.488 84.0 -1449.3 -1.1741 -1.8824 -0.9931 1431 BSPBio_000926 Clc1ccc(cc1)C(OCCN2CCCCC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O09 compound treatment 2556.0 723.66 0.6241 2181.0 647.72 0.5247 0.8124 0.9963 1064 BSPBio_000927 [O-][N+](=O)O[C@@H]1CO[C@@H]2[C@H](CO[C@H]12)O[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O10 compound treatment 2335.0 502.66 0.4335 2794.0 1260.7 1.0213 1.0287 0.9272 3187762 BSPBio_000928 CC1CC(CC(C)(C)N1C)OC(=O)C(O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O11 compound treatment 3026.0 1193.7 1.0295 2786.0 1252.7 1.0148 1.4456 1.0 1668673 BSPBio_000929 Nc1ccc(cc1)S(=O)(=O)Nc2ccc(Cl)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O12 compound treatment 2394.0 561.66 0.4844 1664.0 130.72 0.1059 0.4174 0.8418 3383 BSPBio_000930 Cc1cc(no1)C(=O)NNCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O13 compound treatment 2165.0 332.66 0.2869 1328.0 -205.28 -0.1663 0.0853 0.2572 1467 BSPBio_000931 CCCCOc1ccc(OCCCN2CCOCC2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O14 compound treatment 2480.0 647.66 0.5586 1602.0 68.719 0.0557 0.4343 0.7737 2105063 BSPBio_000932 C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O15 compound treatment 2869.0 1036.7 0.8941 1745.0 211.72 0.1715 0.7535 0.8277 3069574 BSPBio_000933 CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O16 compound treatment 1192.0 -640.34 -0.5523 1037.0 -496.28 -0.402 -0.6748 -0.9878 2752 BSPBio_000934 COc1ccc2Sc3ccccc3N(C[C@H](C)CN(C)C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O17 compound treatment 383.0 -1449.3 -1.25 236.0 -1297.3 -1.0509 -1.627 -0.9963 2081008 BSPBio_000935 C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)C)[C@@]3(C)C[C@H](O)[C@]2(F)[C@@]4(C)C=CC(=O)C=C14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O18 compound treatment 2619.0 786.66 0.6785 774.0 -759.28 -0.6151 0.0448 0.0489 1370 BSPBio_000936 C/C=C(/C(=C/C)/c1ccc(O)cc1)\c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O19 compound treatment 1947.0 114.66 0.0989 1449.0 -84.281 -0.0683 0.0216 0.1801 759 BSPBio_000937 CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)Cc3cccs3)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O20 compound treatment 1332.0 -500.34 -0.4315 1323.0 -210.28 -0.1704 -0.4256 -0.9174 1328 BSPBio_000938 OC(CCN1CCCCC1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O21 compound treatment 1139.0 -693.34 -0.598 1785.0 251.72 0.2039 -0.2786 -0.441 3616807 BSPBio_000939 CO/N=C(\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)COC(=O)N)/c3ccco3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O22 compound treatment 1533.0 -299.34 -0.2582 1491.0 -42.281 -0.0343 -0.2068 -0.794 794 BSPBio_000940 Nc1cc(c[nH]c1=O)c2ccncc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O23 mock treatment 1203.0 -629.34 -0.5428 1221.0 -312.28 -0.253 -0.5627 -0.9396 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 O24 mock treatment 1047.0 -785.34 -0.6773 1185.0 -348.28 -0.2821 -0.6785 -0.9246 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P01 mock treatment 2156.0 323.66 0.2791 1836.0 302.72 0.2452 0.3708 0.9979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P02 mock treatment 1420.0 -412.34 -0.3556 1305.0 -228.28 -0.1849 -0.3822 -0.9536 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P03 compound treatment 2056.0 223.66 0.1929 1653.0 119.72 0.097 0.205 0.9494 3069701 BSPBio_000941 C[C@H](O)C(=O)Nc1c(I)c(C(=O)NC(CO)CO)c(I)c(C(=O)NC(CO)CO)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P04 compound treatment 1219.0 -613.34 -0.529 1067.0 -466.28 -0.3777 -0.6412 -0.9864 2660 BSPBio_000942 CCN(C(=O)/C=C/C)c1ccccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P05 compound treatment 1940.0 107.66 0.0928 2252.0 718.72 0.5822 0.4774 0.8096 3487261 BSPBio_000943 COCC(=O)Nc1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)N(C)CC(O)CO)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P06 compound treatment 1464.0 -368.34 -0.3177 2852.0 1318.7 1.0683 0.5308 0.4762 351 BSPBio_000944 CC(C)NCC(O)COc1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P07 compound treatment 551.0 -1281.3 -1.1051 751.0 -782.28 -0.6337 -1.2295 -0.9652 856 BSPBio_000945 Cn1c(=O)n(C)c2nc[nH]c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P08 compound treatment 1828.0 -4.3438 -0.0037 1410.0 -123.28 -0.0999 -0.0733 -0.7331 1001858 BSPBio_000946 CC(C)NC[C@H](O)COc1ccc(CC(=O)N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P09 compound treatment 1877.0 44.656 0.0385 1508.0 -25.281 -0.0205 0.0128 0.2923 1222 BSPBio_000947 Cn1cnc2n(C)c(=O)[nH]c(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P10 compound treatment 1626.0 -206.34 -0.178 886.0 -647.28 -0.5244 -0.4966 -0.8968 3188022 BSPBio_000948 CC(C)(C)CC(C)(C)c1ccc(OCOCCOCCO)c(Cc2cc(cc(Cc3cc(ccc3OCOCCOCCO)C(C)(C)CC(C)(C)C)c2OCOCCOCCO)C(C)(C)CC(C)(C)C)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P11 compound treatment 1112.0 -720.34 -0.6213 567.0 -966.28 -0.7828 -0.9928 -0.9934 687 BSPBio_000949 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P12 compound treatment 475.0 -1357.3 -1.1707 429.0 -1104.3 -0.8946 -1.4603 -0.9912 3069742 BSPBio_000950 CS(=O)(=O)c1ccc(cc1)[C@@H](O)[C@@H](CF)NC(=O)C(Cl)Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P13 compound treatment 2076.0 243.66 0.2101 1369.0 -164.28 -0.1331 0.0545 0.2191 989 BSPBio_000951 NC(=N)NCCCCNC(=N)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P14 compound treatment 1540.0 -292.34 -0.2521 1217.0 -316.28 -0.2562 -0.3595 -1.0 4369 BSPBio_000952 CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P15 compound treatment 1464.0 -368.34 -0.3177 1330.0 -203.28 -0.1647 -0.3411 -0.9532 3075421 BSPBio_000953 CN1[C@H]2C[C@@H](C[C@@H]1[C@H]3O[C@H]32)OC(=O)[C@H](CO)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P16 compound treatment 762.0 -1070.3 -0.9231 632.0 -901.28 -0.7301 -1.169 -0.9933 3069771 BSPBio_000954 C[C@@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]2CC[C@@H]1C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P17 compound treatment 1735.0 -97.344 -0.084 1189.0 -344.28 -0.2789 -0.2566 -0.8809 3487262 BSPBio_000955 OCCN(C(=O)CO)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P18 compound treatment 1429.0 -403.34 -0.3479 1286.0 -247.28 -0.2003 -0.3876 -0.9656 1000212 BSPBio_000956 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P19 compound treatment 1081.0 -751.34 -0.648 781.0 -752.28 -0.6094 -0.8891 -0.9995 446 BSPBio_000957 COc1cc(CNC(=O)CCCC/C=C/C(C)C)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P20 compound treatment 1352.0 -480.34 -0.4143 1060.0 -473.28 -0.3834 -0.5641 -0.9993 4481 BSPBio_000958 CCCOc1ccc(cc1N)C(=O)OCCN(CC)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P21 compound treatment 1506.0 -326.34 -0.2815 1489.0 -44.281 -0.0359 -0.2244 -0.7908 1327 BSPBio_000959 C[N+](C)(C)CCOC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P22 compound treatment 1131.0 -701.34 -0.6049 1333.0 -200.28 -0.1623 -0.5424 -0.8662 1167 BSPBio_000960 NCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P23 mock treatment 1365.0 -467.34 -0.4031 1268.0 -265.28 -0.2149 -0.437 -0.9566 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2455 P24 mock treatment 890.0 -942.34 -0.8127 1150.0 -383.28 -0.3105 -0.7942 -0.9129 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A01 mock treatment 1310.0 -146.61 -0.1264 1644.0 231.28 0.1874 0.0431 0.1906 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A02 mock treatment 665.0 -791.61 -0.6827 1392.0 -20.719 -0.0168 -0.4946 -0.7243 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A03 compound treatment 1144.0 -312.61 -0.2696 1878.0 465.28 0.3769 0.0759 0.1637 1073908 BSPBio_000961 CC[N+](CC)(CC(=O)Nc1c(C)cccc1C)Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A04 compound treatment 420.0 -1036.6 -0.894 1301.0 -111.72 -0.0905 -0.6962 -0.7747 3616869 BSPBio_000962 CCOC(=O)c1cncn1[C@@H](C)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A05 compound treatment 1106.0 -350.61 -0.3024 1867.0 454.28 0.368 0.0464 0.0974 1322 BSPBio_000963 COc1cc2ccc(=O)oc2cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A06 compound treatment 124.0 -1332.6 -1.1493 903.0 -509.72 -0.4129 -1.1047 -0.9045 3188157 BSPBio_000964 CC[N+](CC)(CC)CCC(O)(C1CCCCC1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A07 compound treatment 81.0 -1375.6 -1.1864 477.0 -935.72 -0.758 -1.3749 -0.9766 1081653 BSPBio_000965 Clc1ccc(C(Cn2ccnc2)OCC=C)c(Cl)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A08 compound treatment 5.0 -1451.6 -1.252 10.0 -1402.7 -1.1364 -1.6888 -0.9988 3487585 BSPBio_000966 CC(C)(C)NCC(O)COc1ccccc1C2CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A09 compound treatment 630.0 -826.61 -0.7129 1071.0 -341.72 -0.2768 -0.6999 -0.9151 1203 BSPBio_000967 CN(C)[C@H]1[C@@H]2[C@@H](O)[C@@H]3C(=C)c4cccc(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A10 compound treatment 127.0 -1329.6 -1.1467 176.0 -1236.7 -1.0019 -1.5193 -0.9977 3188158 BSPBio_000968 CCOC(=O)O[C@@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C)C(=O)COC(=O)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A11 compound treatment 437.0 -1019.6 -0.8794 1406.0 -6.7188 -0.0054 -0.6257 -0.7115 2060138 BSPBio_000969 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A12 compound treatment 33.0 -1423.6 -1.2278 346.0 -1066.7 -0.8642 -1.4792 -0.9852 3069813 BSPBio_000970 Clc1ccc(C(Cn2ccnc2)OCc3csc4c(Cl)cccc34)c(Cl)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A13 compound treatment 772.0 -684.61 -0.5904 1514.0 101.28 0.082 -0.3595 -0.6031 3480627 BSPBio_000971 CC(C)NCC(O)c1ccc(NS(=O)(=O)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A14 compound treatment 626.0 -830.61 -0.7164 1081.0 -331.72 -0.2687 -0.6966 -0.9104 3188159 BSPBio_000972 CCOc1cc(CC(=O)N[C@@H](CC(C)C)c2ccccc2N3CCCCC3)ccc1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A15 compound treatment 959.0 -497.61 -0.4292 1377.0 -35.719 -0.0289 -0.3239 -0.7531 3616851 BSPBio_000973 CN1[C@H]2C[C@@H](O)[C@@H]1CC(=O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A16 compound treatment 267.0 -1189.6 -1.026 874.0 -538.72 -0.4364 -1.0341 -0.9275 3168 BSPBio_000974 NS(=O)(=O)c1cc(cc(N2CCCC2)c1Oc3ccccc3)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A17 compound treatment 908.0 -548.61 -0.4732 1416.0 3.2813 0.0027 -0.3327 -0.7031 3855 BSPBio_000975 C[N+](C)(C)CCCCCCCCCC[N+](C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A18 compound treatment 10.0 -1446.6 -1.2476 138.0 -1274.7 -1.0327 -1.6124 -0.9956 3188160 BSPBio_000976 CC(=O)c1ccc2Sc3ccccc3N(CCCN4CCC(CCO)CC4)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A19 compound treatment 791.0 -665.61 -0.5741 1566.0 153.28 0.1242 -0.3181 -0.5416 1040327 BSPBio_000977 CC(=O)Nc1cc2ccccc2oc1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A20 compound treatment 126.0 -1330.6 -1.1476 509.0 -903.72 -0.7321 -1.3292 -0.9764 943 BSPBio_000978 CCCCC1C(=O)N(N(C1=O)c2ccc(O)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A21 compound treatment 718.0 -738.61 -0.637 1432.0 19.281 0.0156 -0.4394 -0.6896 1120 BSPBio_000979 Oc1ccc(cc1[N+](=O)[O-])[As](=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A22 compound treatment 228.0 -1228.6 -1.0596 1138.0 -274.72 -0.2226 -0.9066 -0.8374 3069814 BSPBio_000980 CCC1NC(=O)c2cc(c(Cl)cc2N1)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A23 mock treatment 505.0 -951.61 -0.8207 1585.0 172.28 0.1396 -0.4817 -0.5786 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 A24 mock treatment 767.0 -689.61 -0.5948 1607.0 194.28 0.1574 -0.3093 -0.5027 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B01 mock treatment 2152.0 695.39 0.5997 2116.0 703.28 0.5697 0.8269 0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B02 mock treatment 1931.0 474.39 0.4091 1147.0 -265.72 -0.2153 0.1371 0.2965 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B03 compound treatment 117.0 -1339.6 -1.1554 307.0 -1105.7 -0.8958 -1.4504 -0.9921 3001896 BSPBio_000981 C[C@H]1[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@@]24[C@@H](/C=C/C[C@H](C)C(=O)[C@@](C)(O)/C=C/[C@H]4OC(=O)C)[C@H](O)C1=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B04 compound treatment 173.0 -1283.6 -1.1071 199.0 -1213.7 -0.9833 -1.4781 -0.9983 440 BSPBio_000982 COC(=O)Nc1nc2cc(ccc2[nH]1)C(=O)c3cccs3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B05 compound treatment 1187.0 -269.61 -0.2325 1617.0 204.28 0.1655 -0.0474 -0.1661 3650125 BSPBio_000983 CC(=S)OC1CC2CC1C3CCCC23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B06 compound treatment 1126.0 -330.61 -0.2851 1556.0 143.28 0.1161 -0.1195 -0.3883 442 BSPBio_000984 CCCCCCCCCCCCCCCCCCc1ccc(cc1)C(=O)/C=C/C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B07 compound treatment 1593.0 136.39 0.1176 1924.0 511.28 0.4142 0.3761 0.8734 159 BSPBio_000985 COc1c(C=O)c(O)cc2C(=O)c3ccccc3C(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B08 compound treatment 1.0 -1455.6 -1.2554 3.0 -1409.7 -1.142 -1.6952 -0.9989 3103897 BSPBio_000986 C[C@@H](CC(O)[C@H]1OC2CC[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)CCC5O)O4)C)OC2[C@H](O)C1=C)C6O[C@@]7(CCCCO7)CC[C@H]6C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B09 compound treatment 870.0 -586.61 -0.5059 1085.0 -327.72 -0.2655 -0.5455 -0.9547 2370 BSPBio_000987 OCc1ccc(o1)c2nn(Cc3ccccc3)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B10 compound treatment 0.0 -1456.6 -1.2563 3.0 -1409.7 -1.142 -1.6959 -0.9989 3104621 BSPBio_000988 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@H](O)[C@@H](C)C(=O)[C@@](C)(O)[C@H](O)[C@@H](C)C\C=C\C=C1)[C@H]2C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B11 compound treatment 1898.0 441.39 0.3807 1779.0 366.28 0.2967 0.479 0.9924 3650126 BSPBio_000989 Nc1ncnc2n(cnc12)[C@]3(CO)OC(=C)[C@@H](O)[C@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B12 compound treatment 1105.0 -351.61 -0.3032 1687.0 274.28 0.2222 -0.0573 -0.1524 324 BSPBio_000990 Cn1cnc2c(NCc3ccccc3)nc(NCCO)nc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B13 compound treatment 1852.0 395.39 0.341 1730.0 317.28 0.257 0.4229 0.9903 398 BSPBio_000991 OC[C@H]1NC[C@@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B14 compound treatment 1223.0 -233.61 -0.2015 1604.0 191.28 0.155 -0.0329 -0.1294 3180124 BSPBio_000992 CC1OC(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(O)C(O)C1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B15 compound treatment 1338.0 -118.61 -0.1023 1312.0 -100.72 -0.0816 -0.13 -0.9937 1000053 BSPBio_000993 OC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B16 compound treatment 2.0 -1454.6 -1.2545 7.0 -1405.7 -1.1388 -1.6923 -0.9988 444 BSPBio_000994 COC(=O)C1=C(C)NC(=C(C1C)C(=O)OCCSc2ccccc2)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B17 compound treatment 200.0 -1256.6 -1.0838 399.0 -1013.7 -0.8212 -1.347 -0.9906 2081077 BSPBio_000995 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B18 compound treatment 369.0 -1087.6 -0.938 787.0 -625.72 -0.5069 -1.0217 -0.9583 453 BSPBio_000996 COc1cccc(c1N)c2cc(=O)c3ccccc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B19 compound treatment 947.0 -509.61 -0.4395 1519.0 106.28 0.0861 -0.2499 -0.558 409 BSPBio_000997 CCCC(=O)Nc1ncnc2n(cnc12)[C@@H]3O[C@@H]4COP(=O)(O)O[C@H]4[C@H]3OC(=O)CCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B20 compound treatment 340.0 -1116.6 -0.963 965.0 -447.72 -0.3627 -0.9374 -0.911 1907767 BSPBio_000998 CN(C)c1ccc(/C=C/2\C(=O)Nc3ccccc23)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B21 compound treatment 1138.0 -318.61 -0.2748 1518.0 105.28 0.0853 -0.134 -0.4657 3001899 BSPBio_000999 CCCC(=O)Nc1nc2n(cnc2c(=O)[nH]1)C3O[C@H]4COP(=O)(O)O[C@@H]4[C@@H]3OC(=O)CCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B22 compound treatment 1150.0 -306.61 -0.2644 1502.0 89.281 0.0723 -0.1358 -0.4955 387 BSPBio_001000 CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B23 mock treatment 1503.0 46.391 0.04 1909.0 496.28 0.402 0.3126 0.7737 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 B24 mock treatment 675.0 -781.61 -0.6741 1129.0 -283.72 -0.2298 -0.6392 -0.8975 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C01 mock treatment 2227.0 770.39 0.6644 1108.0 -304.72 -0.2469 0.2953 0.4166 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C02 mock treatment 1923.0 466.39 0.4022 1572.0 159.28 0.129 0.3757 0.8893 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C03 compound treatment 2210.0 753.39 0.6498 1986.0 573.28 0.4644 0.7879 0.9864 3188026 BSPBio_001001 CCN1CCC[C@H]1CNC(=O)c2c(OC)ccc(Br)c2OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C04 compound treatment 1659.0 202.39 0.1746 1331.0 -81.719 -0.0662 0.0766 0.4104 1267101 BSPBio_001002 CCOC(=O)Nc1ccc2Sc3ccccc3N(C(=O)CCN4CCOCC4)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C05 compound treatment 2132.0 675.39 0.5825 1900.0 487.28 0.3948 0.691 0.982 864 BSPBio_001003 Oc1noc2CNCCc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C06 compound treatment 1302.0 -154.61 -0.1333 1355.0 -57.719 -0.0468 -0.1274 -0.9013 1487 BSPBio_001004 CCC(Cc1c(I)cc(I)c(N)c1I)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C07 compound treatment 1552.0 95.391 0.0823 1088.0 -324.72 -0.2631 -0.1278 -0.4638 1134931 BSPBio_001005 Cc1ccc2n3CCNC4CCCc(c43)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C08 compound treatment 1851.0 394.39 0.3401 1596.0 183.28 0.1485 0.3455 0.9309 3188161 BSPBio_001006 CC(C)(C)C(=O)OCOC(=O)[C@@H]1N2[C@H](SC1(C)C)[C@H](/N=C/N3CCCCCC3)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C09 compound treatment 1831.0 374.39 0.3229 1605.0 192.28 0.1558 0.3385 0.9441 1512 BSPBio_001007 CC(C)NCC(O)c1ccc2ccccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C10 compound treatment 630.0 -826.61 -0.7129 1051.0 -361.72 -0.293 -0.7113 -0.9228 3188162 BSPBio_001008 CCC(=O)OC(Cc1ccccc1)(C(C)CN(C)C)c2ccccc2.OS(=O)(=O)c1ccc2ccccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C11 compound treatment 630.0 -826.61 -0.7129 575.0 -837.72 -0.6786 -0.984 -0.9997 3480607 BSPBio_001009 COc1ccccc1N2CCN(CC(O)COc3cccc4ccccc34)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C12 compound treatment 1155.0 -301.61 -0.2601 5298.0 3885.3 3.1475 2.0417 0.6465 772 BSPBio_001010 CCN1CCCC(C1)OC(=O)C(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C13 compound treatment 969.0 -487.61 -0.4205 936.0 -476.72 -0.3862 -0.5705 -0.9991 907524 BSPBio_001011 CCCCNc1c(C(=O)OCC)c(C)nc2n(CC)ncc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C14 compound treatment 50.0 -1406.6 -1.2131 73.0 -1339.7 -1.0853 -1.6253 -0.9985 1001642 BSPBio_001012 OC[C@H]1OC(C[C@@H]1O)n2cc(c(=O)[nH]c2=O)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C15 compound treatment 1777.0 320.39 0.2763 2623.0 1210.3 0.9805 0.8887 0.8724 2372 BSPBio_001013 COc1cc(ccc1OC(F)F)c2ccc(=O)[nH]n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C16 compound treatment 1109.0 -347.61 -0.2998 1954.0 541.28 0.4385 0.0981 0.1846 1001977 BSPBio_001014 CC(C)NCC(O)COc1ccccc1OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C17 compound treatment 1478.0 21.391 0.0184 1916.0 503.28 0.4077 0.3013 0.7383 733 BSPBio_001015 CC1(CC2CC3(C)C1)CC(N)(C2)C3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C18 compound treatment 1489.0 32.391 0.0279 1296.0 -116.72 -0.0946 -0.0471 -0.4778 1434439 BSPBio_001016 Cc1nccn1CC2CCc3c(C2=O)c4ccccc4n3C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C19 compound treatment 1647.0 190.39 0.1642 1564.0 151.28 0.1226 0.2028 0.9896 2742 BSPBio_001017 OC(=O)/C=C/c1ccc(Cn2ccnc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C20 compound treatment 1191.0 -265.61 -0.2291 1128.0 -284.72 -0.2307 -0.3251 -1.0 3069816 BSPBio_001018 CCCOc1cc(N)ccc1C(=O)OCCN(CC)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C21 compound treatment 1461.0 4.3906 0.0038 1188.0 -224.72 -0.182 -0.126 -0.6922 2245 BSPBio_001019 C(N1CCN(CC1)c2ncccn2)c3ccc4OCOc4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C22 compound treatment 1015.0 -441.61 -0.3809 1057.0 -355.72 -0.2882 -0.4731 -0.9905 1672 BSPBio_001020 OC(=O)CCc1nc(c(o1)c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C23 mock treatment 1361.0 -95.609 -0.0825 1222.0 -190.72 -0.1545 -0.1676 -0.9568 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 C24 mock treatment 45.0 -1411.6 -1.2175 5.0 -1407.7 -1.1404 -1.6673 -0.9995 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D01 mock treatment 2415.0 958.39 0.8266 2141.0 728.28 0.59 1.0017 0.9863 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D02 mock treatment 1450.0 -6.6094 -0.0057 1796.0 383.28 0.3105 0.2155 0.694 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D03 compound treatment 503.0 -953.61 -0.8224 283.0 -1129.7 -0.9152 -1.2287 -0.9986 1907768 BSPBio_001021 [O-][N+](=O)c1ccc(Cl)c(c1)C(=O)Nc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D04 compound treatment 2080.0 623.39 0.5376 1603.0 190.28 0.1541 0.4892 0.8746 384 BSPBio_001022 O=c1[nH]c2ccccc2c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D05 compound treatment 2467.0 1010.4 0.8714 1939.0 526.28 0.4263 0.9177 0.9459 2048 BSPBio_001023 NC1CCc2cc(O)c(O)cc2C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D06 compound treatment 1098.0 -358.61 -0.3093 1071.0 -341.72 -0.2768 -0.4144 -0.9985 290 BSPBio_001024 CCCCCCCCCCCCCC(=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)C)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D07 compound treatment 55.0 -1401.6 -1.2088 46.0 -1366.7 -1.1072 -1.6377 -0.999 2098 BSPBio_001025 CC(C)c1cccc(=O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D08 compound treatment 360.0 -1096.6 -0.9458 261.0 -1151.7 -0.933 -1.3285 -1.0 455 BSPBio_001026 Cc1ccc(cc1)C(=O)Cn2c3CCCCc3sc2=N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D09 compound treatment 2.0 -1454.6 -1.2545 0.0 -1412.7 -1.1445 -1.6964 -0.9989 411 BSPBio_001027 [I+]1c2ccccc2-c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D10 compound treatment 1148.0 -308.61 -0.2662 684.0 -728.72 -0.5903 -0.6056 -0.9353 1907770 BSPBio_001028 Clc1ccc(cc1)c2nc3sccn3c2/C=N/OCc4ccc(Cl)c(Cl)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D11 compound treatment 2.0 -1454.6 -1.2545 5.0 -1407.7 -1.1404 -1.6935 -0.9989 1961 BSPBio_001029 CC(C)(C)c1cc(O)c(cc1O)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D12 compound treatment 1491.0 34.391 0.0297 1519.0 106.28 0.0861 0.0819 0.8989 347 BSPBio_001030 CN1C(=C(O)c2ccccc2S1(=O)=O)C(=O)Nc3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D13 compound treatment 85.0 -1371.6 -1.183 44.0 -1368.7 -1.1088 -1.6205 -0.9995 1000279 BSPBio_001031 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D14 compound treatment 724.0 -732.61 -0.6318 880.0 -532.72 -0.4316 -0.7519 -0.9827 3650127 BSPBio_001032 C[C@@H]1[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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D15 compound treatment 1338.0 -118.61 -0.1023 2336.0 923.28 0.748 0.4566 0.6048 3000146 BSPBio_001033 OC[C@H]1O[C@H](C(O)[C@H]1O)n2cnc3cc(Cl)c(Cl)cc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D16 compound treatment 324.0 -1132.6 -0.9768 214.0 -1198.7 -0.9711 -1.3774 -1.0 275745 BSPBio_001034 Cc1ccc(cc1)c2nn(c3ncnc(N)c23)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D17 compound treatment 1746.0 289.39 0.2496 1973.0 560.28 0.4539 0.4974 0.9603 3650128 BSPBio_001035 OC(=O)c1ccc(cc1)C2=C3C=CC4=N3[Mn+3]5(N6=C7C=CC6=C(c8ccc2n85)c9ccc(cc9)C(=O)O)n%10c(=C4c%11ccc(cc%11)C(=O)O)ccc%10=C7c%12ccc(cc%12)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D18 compound treatment 1.0 -1455.6 -1.2554 0.0 -1412.7 -1.1445 -1.697 -0.9989 349 BSPBio_001036 COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)c4ccco4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D19 compound treatment 7.0 -1449.6 -1.2502 3.0 -1409.7 -1.142 -1.6916 -0.999 279 BSPBio_001037 COc1cc2CCN(C)[C@@H]3Cc4ccc(OC(=O)c5ccc(cc5)[N+](=O)[O-])c(Oc6ccc(C[C@@H]7N(C)CCc8cc(OC)c(Oc(c1OC)c32)cc78)cc6)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D20 compound treatment 739.0 -717.61 -0.6189 738.0 -674.72 -0.5466 -0.8241 -0.9981 244 BSPBio_001038 CC[N+](C)(CC)CCC[n+]1c(c2ccccc2)c3cc(N)ccc3c4ccc(N)cc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D21 compound treatment 1321.0 -135.61 -0.117 648.0 -764.72 -0.6195 -0.5208 -0.826 3650129 BSPBio_001039 CC(C)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H]1O[C@@H]1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D22 compound treatment 276.0 -1180.6 -1.0182 286.0 -1126.7 -0.9128 -1.3654 -0.9985 3002368 BSPBio_001040 CC(C)NC[C@H](O)COc1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D23 mock treatment 1763.0 306.39 0.2642 1526.0 113.28 0.0918 0.2517 0.9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 D24 mock treatment 889.0 -567.61 -0.4895 496.0 -916.72 -0.7426 -0.8713 -0.9795 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E01 mock treatment 1901.0 444.39 0.3833 1807.0 394.28 0.3194 0.4969 0.9959 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E02 mock treatment 1794.0 337.39 0.291 1780.0 367.28 0.2975 0.4162 0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E03 compound treatment 2003.0 546.39 0.4712 1995.0 582.28 0.4717 0.6668 1.0 3188027 BSPBio_001041 CCN(CC)CCOC(=O)C1(CCCC1)c2ccc(cc2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E04 compound treatment 1762.0 305.39 0.2634 1482.0 69.281 0.0561 0.2259 0.8389 3188163 BSPBio_001042 CN1C(=O)CC(C1=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E05 compound treatment 2133.0 676.39 0.5834 1707.0 294.28 0.2384 0.5811 0.9221 2098610 BSPBio_001043 C1CC1C(NC2=NCCO2)C3CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E06 compound treatment 1620.0 163.39 0.1409 1738.0 325.28 0.2635 0.286 0.957 2957 BSPBio_001044 CNC(=O)c1c(I)c(N(C)C(=O)C)c(I)c(C(=O)NCC(=O)Nc2c(I)c(C(=O)O)c(I)c(C(=O)NCCO)c2I)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E07 compound treatment 2140.0 683.39 0.5894 1936.0 523.28 0.4239 0.7165 0.9869 3723 BSPBio_001045 CN(C)CCCSC(=N)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E08 compound treatment 1249.0 -207.61 -0.1791 545.0 -867.72 -0.703 -0.6237 -0.8598 3069817 BSPBio_001046 CN(C/C=C/c1ccccc1)Cc2cccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E09 compound treatment 1858.0 401.39 0.3462 2162.0 749.28 0.607 0.674 0.9645 3069774 BSPBio_001047 CO[C@H]1[C@H](O)C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E10 compound treatment 1530.0 73.391 0.0633 1700.0 287.28 0.2327 0.2093 0.8679 907413 BSPBio_001048 CCCNC(C)(C)COC(=O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E11 compound treatment 1864.0 407.39 0.3514 1417.0 4.2813 0.0035 0.2509 0.7141 3069775 BSPBio_001049 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E12 compound treatment 2088.0 631.39 0.5445 1236.0 -176.72 -0.1432 0.2838 0.5041 1666 BSPBio_001050 Cc1[nH]c(=O)c(C#N)cc1c2ccncc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E13 compound treatment 1759.0 302.39 0.2608 2148.0 735.28 0.5957 0.6056 0.9313 3616854 BSPBio_001051 C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C)C4CC[C@]5(C)[C@H](CC[C@]5(O)C4CCC3=C2)c6ccc(=O)oc6)[C@H](O)[C@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E14 compound treatment 2217.0 760.39 0.6558 1395.0 -17.719 -0.0144 0.4536 0.6915 4382 BSPBio_001052 CC[N+](C)(CC)CCOC(=O)C1c2ccccc2Oc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E15 compound treatment 3.0 -1453.6 -1.2537 3.0 -1409.7 -1.142 -1.694 -0.9989 2549 BSPBio_001053 C[n+]1cc2c3OCOc3ccc2c4ccc5cc6OCOc6cc5c14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E16 compound treatment 2016.0 559.39 0.4825 1839.0 426.28 0.3453 0.5853 0.9866 3616870 BSPBio_001054 CC1(C)S[C@@H]2[C@H](NC(=O)C(C(=O)O)c3ccsc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E17 compound treatment 1552.0 95.391 0.0823 1514.0 101.28 0.082 0.1162 1.0 3552120 BSPBio_001055 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E18 compound treatment 81.0 -1375.6 -1.1864 294.0 -1118.7 -0.9063 -1.4798 -0.9912 3188276 BSPBio_001056 CCSc1ccc2Sc3ccccc3N(CCCN4CCN(C)CC4)c2c1.OC(CC(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E19 compound treatment 1754.0 297.39 0.2565 1550.0 137.28 0.1112 0.26 0.93 3616856 BSPBio_001057 C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)C5CC[C@]43C)[C@@H]2[C@H]1C)C(=O)O[C@@H]6O[C@H](COC7O[C@H](CO)[C@@H](OC8O[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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E20 compound treatment 1059.0 -397.61 -0.3429 1144.0 -268.72 -0.2177 -0.3964 -0.9759 1778 BSPBio_001058 Nc1ccc(O)c(c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E21 compound treatment 1292.0 -164.61 -0.142 1496.0 83.281 0.0675 -0.0527 -0.3352 3559616 BSPBio_001059 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E22 compound treatment 537.0 -919.61 -0.7931 1010.0 -402.72 -0.3262 -0.7915 -0.9229 3047 BSPBio_001060 C[C@H]1[C@@H]2CC[C@@]3(C)C=CC(=O)C(=C3[C@H]2OC1=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E23 mock treatment 1031.0 -425.61 -0.3671 1230.0 -182.72 -0.148 -0.3642 -0.9202 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 E24 mock treatment 676.0 -780.61 -0.6732 6.0 -1406.7 -1.1396 -1.2819 -0.9685 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F01 mock treatment 1580.0 123.39 0.1064 2279.0 866.28 0.7018 0.5715 0.8051 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F02 mock treatment 2296.0 839.39 0.7239 1913.0 500.28 0.4053 0.7985 0.9624 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F03 compound treatment 262.0 -1194.6 -1.0303 243.0 -1169.7 -0.9476 -1.3986 -0.9991 413 BSPBio_001061 CCCCCC[C@@H]([C@@H](C)O)n1cnc2c(N)ncnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F04 compound treatment 1.0 -1455.6 -1.2554 269.0 -1143.7 -0.9265 -1.5429 -0.9888 3650131 BSPBio_001062 COc1ccc(CC(N)C(=O)N[C@H]2[C@@H](O)[C@@H](O[C@@H]2CO)n3cnc4c(ncnc34)N(C)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F05 compound treatment 2994.0 1537.4 1.3259 2573.0 1160.3 0.94 1.6022 0.9858 3650132 BSPBio_001063 CC(=O)[C@H]1[C@@H](C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F06 compound treatment 1948.0 491.39 0.4238 1656.0 243.28 0.1971 0.439 0.9393 3650133 BSPBio_001064 NC(=O)c1ccc(cc1)c2nc(c([nH]2)c3ccccn3)c4ccc5OCOc5c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F07 compound treatment 1541.0 84.391 0.0728 1202.0 -210.72 -0.1707 -0.0692 -0.3731 386 BSPBio_001065 C[C@@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]2CC[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F08 compound treatment 1680.0 223.39 0.1927 721.0 -691.72 -0.5604 -0.26 -0.4388 1000035 BSPBio_001066 O=C1c2ccccc2-c3n[nH]c4cccc1c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F09 compound treatment 32.0 -1424.6 -1.2287 21.0 -1391.7 -1.1275 -1.666 -0.9991 2080384 BSPBio_001067 COc1cc(cc(OC)c1O)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](OC4OC5COC(C)OC5C(O)C4O)c6cc7OCOc7cc26 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F10 compound treatment 640.0 -816.61 -0.7043 303.0 -1109.7 -0.899 -1.1337 -0.9927 353 BSPBio_001068 Oc1cc(O)c2c(=O)c(O)c(oc2c1)c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F11 compound treatment 2.0 -1454.6 -1.2545 4.0 -1408.7 -1.1412 -1.6941 -0.9989 415 BSPBio_001069 FC(F)(F)Oc1ccc(NN=C(C#N)C#N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F12 compound treatment 271.0 -1185.6 -1.0225 251.0 -1161.7 -0.9411 -1.3885 -0.9991 3104890 BSPBio_001070 CO[C@@H]1CC(CC(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=C/C=C/C=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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F13 compound treatment 2878.0 1421.4 1.2259 2607.0 1194.3 0.9675 1.551 0.9931 3002452 BSPBio_001071 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F14 compound treatment 584.0 -872.61 -0.7526 232.0 -1180.7 -0.9565 -1.2085 -0.993 1907774 BSPBio_001072 CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F15 compound treatment 1.0 -1455.6 -1.2554 261.0 -1151.7 -0.933 -1.5475 -0.9893 3104393 BSPBio_001073 CO[C@H]1C[C@H](C)CC2=C(OC)C(=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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F16 compound treatment 192.0 -1264.6 -1.0907 83.0 -1329.7 -1.0772 -1.5329 -1.0 285 BSPBio_001074 O=C(NCCCCCCNC(=O)ON=C1CCCCC1)ON=C2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F17 compound treatment 1412.0 -44.609 -0.0385 1117.0 -295.72 -0.2396 -0.1966 -0.8103 3103903 BSPBio_001075 Cc1ccc(cc1)C2=CCc3cc(C)cc(C)c3C2=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F18 compound treatment 1519.0 62.391 0.0538 1391.0 -21.719 -0.0176 0.0256 0.4523 151 BSPBio_001076 CCCCCCCCCCCCCCCC(=O)C1=C(O)C(CO)OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F19 compound treatment 52.0 -1404.6 -1.2114 10.0 -1402.7 -1.1364 -1.6601 -0.9995 576 BSPBio_001077 Cn1cc(C2=C(C(=O)NC2=O)c3cn(CCCSC(=N)N)c4ccccc34)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F20 compound treatment 762.0 -694.61 -0.5991 115.0 -1297.7 -1.0513 -1.167 -0.9644 291 BSPBio_001078 CC[C@H](CO)Nc1nc(NCc2ccccc2)c3ncn(C(C)C)c3n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F21 compound treatment 2215.0 758.39 0.6541 919.0 -493.72 -0.4 0.1797 0.2344 162 BSPBio_001079 CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F22 compound treatment 25.0 -1431.6 -1.2347 4.0 -1408.7 -1.1412 -1.68 -0.9992 320 BSPBio_001080 CC(=O)c1c(O)c(C)c(O)c(Cc2c(O)c(C(=O)/C=C/c3ccccc3)c4OC(C)(C)C=Cc4c2O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F23 mock treatment 1160.0 -296.61 -0.2558 1869.0 456.28 0.3696 0.0805 0.179 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 F24 mock treatment 587.0 -869.61 -0.75 585.0 -827.72 -0.6705 -1.0045 -0.9984 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G01 mock treatment 1495.0 38.391 0.0331 2118.0 705.28 0.5714 0.4274 0.7468 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G02 mock treatment 1155.0 -301.61 -0.2601 1921.0 508.28 0.4118 0.1072 0.2202 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G03 compound treatment 1582.0 125.39 0.1081 2356.0 943.28 0.7642 0.6168 0.7992 1327636 BSPBio_001081 COc1ccc2c(c1)C(=O)N(CCc3ccc(cc3)S(=O)(=O)NC(=O)NC4CCCCC4)C(=O)C2(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G04 compound treatment 1315.0 -141.61 -0.1221 1869.0 456.28 0.3696 0.175 0.4496 3069853 BSPBio_001082 OCN1C(NC(=O)NCNC(=O)NC2N(CO)C(=O)NC2=O)C(=O)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G05 compound treatment 567.0 -889.61 -0.7673 1009.0 -403.72 -0.3271 -0.7738 -0.9278 3069778 BSPBio_001083 CN1CCC(=C2c3ccsc3CCc4ccccc24)CC1.OC(CC(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G06 compound treatment 689.0 -767.61 -0.662 1221.0 -191.72 -0.1553 -0.578 -0.8499 1503 BSPBio_001084 Cc1c(CS(=O)c2nc3ccccc3[nH]2)nccc1OCC(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G07 compound treatment 1351.0 -105.61 -0.0911 1905.0 492.28 0.3988 0.2176 0.5319 1380 BSPBio_001085 NC(=O)c1ncn(n1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G08 compound treatment 947.0 -509.61 -0.4395 2190.0 777.28 0.6297 0.1345 0.1751 834 BSPBio_001086 CC(C[N+](C)(C)C)OC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G09 compound treatment 1147.0 -309.61 -0.267 2100.0 687.28 0.5568 0.2049 0.3318 1057366 BSPBio_001087 NS(=O)(=O)c1cc2c(NC(CC3CCCC3)NS2(=O)=O)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G10 compound treatment 616.0 -840.61 -0.725 1447.0 34.281 0.0278 -0.493 -0.6795 3188277 BSPBio_001088 CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)C5CC5[C@]4(C)[C@H]3CC[C@@]21C)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G11 compound treatment 186.0 -1270.6 -1.0958 801.0 -611.72 -0.4956 -1.1253 -0.9356 3177109 BSPBio_001089 COCCCC/C(=N\OCCN)/c1ccc(cc1)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G12 compound treatment 328.0 -1128.6 -0.9734 1175.0 -237.72 -0.1926 -0.8245 -0.8309 3002368 BSPBio_001090 CC(C)NC[C@H](O)COc1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G13 compound treatment 1180.0 -276.61 -0.2386 2109.0 696.28 0.5641 0.2302 0.3758 3069779 BSPBio_001091 NC(=O)c1cc[n+](CC2=C(N3[C@H](SC2)[C@H](NC(=O)Cc4cccs4)C3=O)C(=O)O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G14 compound treatment 859.0 -597.61 -0.5154 1554.0 141.28 0.1145 -0.2835 -0.537 3903 BSPBio_001092 CC(C)(Oc1ccc(cc1)C2CC2(Cl)Cl)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G15 compound treatment 163.0 -1293.6 -1.1157 2315.0 902.28 0.731 -0.272 -0.204 1000221 BSPBio_001093 CCC(=O)O[C@@]1([C@H](C)C[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@@]21C)C(=O)SCF 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G16 compound treatment 173.0 -1283.6 -1.1071 362.0 -1050.7 -0.8512 -1.3847 -0.9916 1029881 BSPBio_001094 CN1C2CCC1CC(O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G17 compound treatment 76.0 -1380.6 -1.1907 179.0 -1233.7 -0.9995 -1.5487 -0.9962 3069780 BSPBio_001095 OCCN1CCN(CC/C=C\2/c3ccccc3Sc4ccc(Cl)cc24)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G18 compound treatment 801.0 -655.61 -0.5654 964.0 -448.72 -0.3635 -0.6569 -0.9772 954 BSPBio_001096 CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G19 compound treatment 1.0 -1455.6 -1.2554 4.0 -1408.7 -1.1412 -1.6947 -0.9989 4480 BSPBio_001097 CC(C)NC(=N)NC(=N)Nc1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G20 compound treatment 237.0 -1219.6 -1.0519 1977.0 564.28 0.4571 -0.4205 -0.3667 1295 BSPBio_001098 OC(=O)CCCc1ccc(cc1)N(CCCl)CCCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G21 compound treatment 538.0 -918.61 -0.7923 2162.0 749.28 0.607 -0.131 -0.1313 3188032 BSPBio_001099 CN(C)[C@H]1[C@@H]2C[C@H]3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)NCNC(CCCCN)C(=O)O)C(=O)c4c(O)cccc4[C@@]3(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G22 compound treatment 65.0 -1391.6 -1.2002 140.0 -1272.7 -1.031 -1.5777 -0.9971 3188278 BSPBio_001100 COC(=O)Nc1nc2cc(SC(C)C)ccc2[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G23 mock treatment 1015.0 -441.61 -0.3809 1422.0 9.2813 0.0075 -0.264 -0.693 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 G24 mock treatment 568.0 -888.61 -0.7664 332.0 -1080.7 -0.8755 -1.161 -0.9978 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H01 mock treatment 2346.0 889.39 0.7671 2109.0 696.28 0.5641 0.9413 0.9886 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H02 mock treatment 2069.0 612.39 0.5282 2266.0 853.28 0.6913 0.8623 0.9912 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H03 compound treatment 219.0 -1237.6 -1.0674 359.0 -1053.7 -0.8536 -1.3584 -0.9939 152 BSPBio_001101 Cn1c2ccccc2c3c4C(=O)NCc4c5c6ccccc6n(CCC#N)c5c13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H04 compound treatment 0.0 -1456.6 -1.2563 21.0 -1391.7 -1.1275 -1.6855 -0.9985 3650134 BSPBio_001102 CC(=O)OCOCC(=O)OCOP(=O)C(OCOC(=O)C)c1cc(ccc1Oc2ccc(Br)cc2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H05 compound treatment 2399.0 942.39 0.8128 1812.0 399.28 0.3235 0.8034 0.9185 1298 BSPBio_001103 CS(=O)(=O)Nc1ccc(cc1Oc2ccccc2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H06 compound treatment 1566.0 109.39 0.0943 971.0 -441.72 -0.3578 -0.1863 -0.5035 1000025 BSPBio_001104 CS(=O)c1ccc(cc1)c2nc(c([nH]2)c3ccncc3)c4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H07 compound treatment 2388.0 931.39 0.8033 1643.0 230.28 0.1866 0.6999 0.8487 414 BSPBio_001105 CC1CNCCN1S(=O)(=O)c2cccc3cnccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H08 compound treatment 1406.0 -50.609 -0.0436 498.0 -914.72 -0.741 -0.5548 -0.7475 457 BSPBio_001106 Oc1ccc(cc1)c2nc(c([nH]2)c3ccncc3)c4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H09 compound treatment 13.0 -1443.6 -1.2451 2.0 -1410.7 -1.1428 -1.6885 -0.9991 607 BSPBio_001107 Brc1ccc(/C=C/CNCCNS(=O)(=O)c2cccc3cnccc23)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H10 compound treatment 1495.0 38.391 0.0331 390.0 -1022.7 -0.8285 -0.5624 -0.6783 1000586 BSPBio_001108 O/N=C\1/C(=C\2/C(=O)Nc3ccccc23)/Nc4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H11 compound treatment 2328.0 871.39 0.7515 1769.0 356.28 0.2886 0.7355 0.9136 426 BSPBio_001109 NCCNS(=O)(=O)c1cccc2cnccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H12 compound treatment 1098.0 -358.61 -0.3093 1268.0 -144.72 -0.1172 -0.3016 -0.9118 3104892 BSPBio_001110 O=C/1Nc2ccccc2\C1=C/3\Nc4ccccc4C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H13 compound treatment 2156.0 699.39 0.6032 1458.0 45.281 0.0367 0.4525 0.7487 610 BSPBio_001111 O=S(=O)(N1CCCNCC1)c2cccc3cnccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H14 compound treatment 741.0 -715.61 -0.6172 1003.0 -409.72 -0.3319 -0.6711 -0.9577 429 BSPBio_001112 NCCc1c[nH]c2ccc(O)cc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H15 compound treatment 1153.0 -303.61 -0.2619 2787.0 1374.3 1.1133 0.6021 0.5264 609 BSPBio_001113 NC(=N)NCCNS(=O)(=O)c1cccc2cnccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H16 compound treatment 19.0 -1437.6 -1.2399 8.0 -1404.7 -1.138 -1.6814 -0.9991 2269 BSPBio_001114 Oc1ccc(/C=C/c2cc(O)cc(O)c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H17 compound treatment 760.0 -696.61 -0.6008 451.0 -961.72 -0.7791 -0.9757 -0.9918 611 BSPBio_001115 COCc1cc(O)c(O)c(O)c1c2c(O)c(O)c(O)cc2COC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H18 compound treatment 1016.0 -440.61 -0.38 1395.0 -17.719 -0.0144 -0.2789 -0.7333 2301 BSPBio_001116 O=C1CCc2c(O1)ccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H19 compound treatment 1461.0 4.3906 0.0038 1524.0 111.28 0.0902 0.0664 0.7362 465 BSPBio_001117 NCCc1c[nH]cn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H20 compound treatment 269.0 -1187.6 -1.0243 198.0 -1214.7 -0.9841 -1.4201 -0.9998 650 BSPBio_001118 CC(C)(C)n1nc(c2ccc(Cl)cc2)c3c(N)ncnc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H21 compound treatment 290.0 -1166.6 -1.0062 261.0 -1151.7 -0.933 -1.3712 -0.9993 239 BSPBio_001119 CC(=O)OCOC(c1ccc2ccccc2c1)P(=O)(OCOC(=O)C)OCOC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H22 compound treatment 81.0 -1375.6 -1.1864 21.0 -1391.7 -1.1275 -1.6361 -0.9997 648 BSPBio_001120 Oc1cc(O)cc(/C=C/c2ccc(O)c(O)c2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H23 mock treatment 1247.0 -209.61 -0.1808 1433.0 20.281 0.0164 -0.1162 -0.6402 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 H24 mock treatment 903.0 -553.61 -0.4775 678.0 -734.72 -0.5952 -0.7585 -0.994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I01 mock treatment 2855.0 1398.4 1.2061 1928.0 515.28 0.4174 1.148 0.8995 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I02 mock treatment 1720.0 263.39 0.2272 2123.0 710.28 0.5754 0.5675 0.9174 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I03 compound treatment 2541.0 1084.4 0.9352 2188.0 775.28 0.6281 1.1054 0.9812 3069781 BSPBio_001121 CC(=O)OCC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I04 compound treatment 2031.0 574.39 0.4954 998.0 -414.72 -0.336 0.1127 0.1883 3002368 BSPBio_001122 CC(C)NC[C@H](O)COc1cccc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I05 compound treatment 1941.0 484.39 0.4178 1346.0 -66.719 -0.054 0.2572 0.6105 3177333 BSPBio_001123 CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I06 compound treatment 424.0 -1032.6 -0.8906 37.0 -1375.7 -1.1145 -1.4178 -0.9938 3616871 BSPBio_001124 CN1CC[C@]2(C)[C@@H]1N(C)c3ccc(O)cc32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I07 compound treatment 2138.0 681.39 0.5877 1443.0 30.281 0.0245 0.4329 0.736 1053328 BSPBio_001125 CCCC1C(=O)N2N(C1=O)c3cc(C)ccc3N=C2N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I08 compound treatment 2131.0 674.39 0.5816 919.0 -493.72 -0.4 0.1285 0.182 3616872 BSPBio_001126 CCN1C[C@]2(COC)CC[C@H](O)[C@]3([C@@H]4C[C@H]5[C@H](OC(=O)C)[C@@H]4[C@](O)(C[C@@H]5OC)[C@H]6C[C@@H]32)C61 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I09 compound treatment 2047.0 590.39 0.5092 1950.0 537.28 0.4353 0.6678 0.997 3188033 BSPBio_001127 CCC1(CCCCN(C)C1)c2cccc(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I10 compound treatment 1746.0 289.39 0.2496 1388.0 -24.719 -0.02 0.1623 0.6483 2060476 BSPBio_001128 C[C@H]1[C@@H]2CCC(=C3[C@@H]([C@H]2OC1=O)C(=CC3=O)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I11 compound treatment 2242.0 785.39 0.6774 1701.0 288.28 0.2335 0.6441 0.899 3616858 BSPBio_001129 CN[C@H]1[C@@H](O)C2O[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]2OC1O[C@H]4O[C@H](CO)[C@@H](N)[C@H](O)[C@H]4O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I12 compound treatment 1222.0 -234.61 -0.2023 1457.0 44.281 0.0359 -0.1177 -0.5728 1336284 BSPBio_001130 COc1c2CC(Oc2nc3ccccc13)C(C)(O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I13 compound treatment 695.0 -761.61 -0.6569 603.0 -809.72 -0.656 -0.9283 -1.0 3069782 BSPBio_001131 C[C@@]12CC[C@H]3[C@@H](CC[C@H]4CC5SC5C[C@@]43C)[C@@H]2CC[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I14 compound treatment 1478.0 21.391 0.0184 1779.0 366.28 0.2967 0.2229 0.7496 3176921 BSPBio_001132 N[C@H]1CONC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I15 compound treatment 1909.0 452.39 0.3902 3116.0 1703.3 1.3799 1.2516 0.8728 3188035 BSPBio_001133 C/C(=C(/CCO)\SSCC1CCCO1)/N(Cc2cnc(C)nc2N)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I16 compound treatment 904.0 -552.61 -0.4766 1349.0 -63.719 -0.0516 -0.3735 -0.7791 3069855 BSPBio_001134 Clc1cnccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I17 compound treatment 2120.0 663.39 0.5721 1677.0 264.28 0.2141 0.556 0.9101 2080 BSPBio_001135 CCOC(=O)c1ccc(OC(=O)CCCCCNC(=N)N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I18 compound treatment 1272.0 -184.61 -0.1592 1311.0 -101.72 -0.0824 -0.1709 -0.953 1076620 BSPBio_001136 CNCC(O)c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I19 compound treatment 1720.0 263.39 0.2272 1183.0 -229.72 -0.1861 0.029 0.0989 3188145 BSPBio_001137 CC(C)(C)C(=O)OCOC(=O)[C@@H]1N2[C@H](SC1(C)C)[C@H](NC(=O)[C@H](N)c3ccccc3)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I20 compound treatment 1172.0 -284.61 -0.2455 1227.0 -185.72 -0.1505 -0.28 -0.9724 760 BSPBio_001138 N[C@@H]1CONC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I21 compound treatment 1036.0 -420.61 -0.3628 1205.0 -207.72 -0.1683 -0.3755 -0.939 3188146 BSPBio_001139 CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)OC4OC(=O)c5ccccc45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I22 compound treatment 513.0 -943.61 -0.8138 238.0 -1174.7 -0.9517 -1.2484 -0.997 1076027 BSPBio_001140 CC1CC(CC(C)(C)C1)OC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I23 mock treatment 1423.0 -33.609 -0.029 1228.0 -184.72 -0.1496 -0.1263 -0.8287 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 I24 mock treatment 823.0 -633.61 -0.5465 5.0 -1407.7 -1.1404 -1.1928 -0.9432 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J01 mock treatment 1735.0 278.39 0.2401 2283.0 870.28 0.705 0.6683 0.8973 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J02 mock treatment 1783.0 326.39 0.2815 1627.0 214.28 0.1736 0.3218 0.973 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J03 compound treatment 2.0 -1454.6 -1.2545 0.0 -1412.7 -1.1445 -1.6964 -0.9989 369 BSPBio_001141 CCOc1ccc(cc1)c2nc3cc(ccc3[nH]2)c4nc5cc(ccc5[nH]4)N6CCN(C)CC6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J04 compound treatment 1775.0 318.39 0.2746 2785.0 1372.3 1.1117 0.9803 0.856 837968 BSPBio_001142 Nc1ncnc2n(cnc12)C3CCCO3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J05 compound treatment 2118.0 661.39 0.5704 1976.0 563.28 0.4563 0.726 0.9939 1001953 BSPBio_001143 C/C=C/1\C2Cc3[nH]c(=O)ccc3C1(N)CC(=C2)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J06 compound treatment 1988.0 531.39 0.4583 1649.0 236.28 0.1914 0.4594 0.925 790507 BSPBio_001144 OC(=O)CN1C(=O)c2cccc3cccc(C1=O)c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J07 compound treatment 2328.0 871.39 0.7515 2018.0 605.28 0.4903 0.8781 0.9786 3650135 BSPBio_001145 CC(C)[C@H](O)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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J08 compound treatment 0.0 -1456.6 -1.2563 1.0 -1411.7 -1.1437 -1.697 -0.9989 254 BSPBio_001146 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n3c4ccccc4c5c6CNC(=O)c6c7c8ccccc8n2c7c35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J09 compound treatment 985.0 -471.61 -0.4067 222.0 -1190.7 -0.9646 -0.9697 -0.9263 3002553 BSPBio_001147 C[C@@H]([C@@H](C)N1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J10 compound treatment 1752.0 295.39 0.2548 1609.0 196.28 0.159 0.2926 0.9743 197 BSPBio_001148 O[C@@H]1CN2CCC[C@@H](O)[C@@H]2[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J11 compound treatment 1615.0 158.39 0.1366 1835.0 422.28 0.3421 0.3385 0.9189 2797 BSPBio_001149 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)O)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J12 compound treatment 157.0 -1299.6 -1.1209 7.0 -1405.7 -1.1388 -1.5978 -1.0 368 BSPBio_001150 CC/C(=C(\c1ccccc1)/c2ccc(OCCN(C)C)cc2)/c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J13 compound treatment 24.0 -1432.6 -1.2356 9.0 -1403.7 -1.1372 -1.6778 -0.9991 3650136 BSPBio_001151 CCC[C@@H](C)C[C@H](C)C[C@H](C)C(=O)/C=C(\O)/[C@H](C)C[C@H](C)C/C=C/[C@@H](C)[C@@H](O)[C@@H](C)[C@@H](O)C[C@@H]1CC[C@](C)(O1)[C@H]2CC[C@](C)(O2)[C@@H](C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J14 compound treatment 643.0 -813.61 -0.7017 412.0 -1000.7 -0.8107 -1.0694 -0.9974 1000045 BSPBio_001152 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J15 compound treatment 2330.0 873.39 0.7533 2947.0 1534.3 1.2429 1.4115 0.9712 1505 BSPBio_001153 CC(C)Cn1c(=O)n(C)c(=O)c2[nH]cnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J16 compound treatment 747.0 -709.61 -0.612 251.0 -1161.7 -0.9411 -1.0982 -0.9783 658 BSPBio_001154 Clc1cc(Cl)cc(/C=C(\C#N)/c2cccnc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J17 compound treatment 96.0 -1360.6 -1.1735 69.0 -1343.7 -1.0886 -1.5995 -0.9993 1054783 BSPBio_001155 OCCSC1=C(SCCO)C(=O)c2ccccc2C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J18 compound treatment 1411.0 -45.609 -0.0393 1410.0 -2.7188 -0.0022 -0.0294 -0.7455 370 BSPBio_001156 O=C1N(C2CCC(=O)NC2=O)C(=O)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J19 compound treatment 966.0 -490.61 -0.4231 633.0 -779.72 -0.6317 -0.7458 -0.981 422 BSPBio_001157 Oc1cccc2C(=O)C=CC(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J20 compound treatment 1396.0 -60.609 -0.0523 1170.0 -242.72 -0.1966 -0.176 -0.865 358 BSPBio_001158 N[C@@H](CCCNC(=S)N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J21 compound treatment 157.0 -1299.6 -1.1209 56.0 -1356.7 -1.0991 -1.5697 -1.0 1907777 BSPBio_001159 COC(=O)[C@@]1(O)C[C@@H]2O[C@@]1(C)n3c4ccccc4c5c6CNC(=O)c6c7c8ccccc8n2c7c35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J22 compound treatment 523.0 -933.61 -0.8052 32.0 -1380.7 -1.1185 -1.3603 -0.987 572 BSPBio_001160 CN(C)CCCn1cc(C2=C(C(=O)NC2=O)c3c[nH]c4ccccc34)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J23 mock treatment 1612.0 155.39 0.134 1655.0 242.28 0.1963 0.2336 0.9827 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 J24 mock treatment 1905.0 448.39 0.3867 897.0 -515.72 -0.4178 -0.022 -0.0386 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K01 mock treatment 2304.0 847.39 0.7308 2658.0 1245.3 1.0088 1.2301 0.9875 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K02 mock treatment 1869.0 412.39 0.3557 2775.0 1362.3 1.1036 1.0319 0.8899 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K03 compound treatment 2877.0 1420.4 1.225 1897.0 484.28 0.3923 1.1436 0.8891 3188147 BSPBio_001161 Cc1onc(c1C(=O)N[C@H]2[C@H]3SC(C)(C)C(N3C2=O)C(=O)O)c4c(F)cccc4Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K04 compound treatment 978.0 -478.61 -0.4128 1252.0 -160.72 -0.1302 -0.3839 -0.8871 3616874 BSPBio_001162 CC(=O)N[C@@H](CC(=O)N[C@H](CCC(=O)O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K05 compound treatment 2079.0 622.39 0.5368 1475.0 62.281 0.0505 0.4152 0.7702 2920 BSPBio_001163 CCN(CC)c1cc(C)nc2ncnn12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K06 compound treatment 2679.0 1222.4 1.0543 1709.0 296.28 0.24 0.9152 0.8464 3616879 BSPBio_001164 Nc1ncnc2n(cnc12)[C@@H]3O[C@@H]4COP(=O)(O)OC4C3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K07 compound treatment 1160.0 -296.61 -0.2558 431.0 -981.72 -0.7953 -0.7433 -0.8897 3616859 BSPBio_001165 CN(C)[C@@H]1CCCCC(C1)OC2c3ccccc3CCc4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K08 compound treatment 1814.0 357.39 0.3082 51.0 -1361.7 -1.1031 -0.5621 -0.4907 907479 BSPBio_001166 CCCN1CCC[C@@H]2Cc3n[nH]cc3C[C@H]21 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K09 compound treatment 93.0 -1363.6 -1.1761 5.0 -1407.7 -1.1404 -1.638 -0.9999 3078457 BSPBio_001167 CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K10 compound treatment 1123.0 -333.61 -0.2877 788.0 -624.72 -0.5061 -0.5613 -0.9642 3188280 BSPBio_001168 COc1ncnc(NS(=O)(=O)c2ccc(N)cc2)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K11 compound treatment 1688.0 231.39 0.1996 1931.0 518.28 0.4199 0.438 0.9422 1022844 BSPBio_001169 Oc1ccc(O)c(c1)S(=O)(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K12 compound treatment 1291.0 -165.61 -0.1428 1595.0 182.28 0.1477 0.0034 0.0166 1221 BSPBio_001170 CN(C)CCOC(=O)C(c1ccccc1)C2(O)CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K13 compound treatment 62.0 -1394.6 -1.2028 1147.0 -265.72 -0.2153 -1.0027 -0.8206 1779 BSPBio_001171 COc1nc(C)nc(Cl)c1NC2=NCCN2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K14 compound treatment 80.0 -1376.6 -1.1873 99.0 -1313.7 -1.0643 -1.5921 -0.9985 3188281 BSPBio_001172 C[C@@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]2C[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K15 compound treatment 2045.0 588.39 0.5075 2489.0 1076.3 0.8719 0.9754 0.9668 1326779 BSPBio_001173 CCNCC(O)c1cccc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K16 compound treatment 1389.0 -67.609 -0.0583 1048.0 -364.72 -0.2955 -0.2502 -0.8306 1000336 BSPBio_001174 CC(C)NC[C@H](O)c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K17 compound treatment 1851.0 394.39 0.3401 1126.0 -286.72 -0.2323 0.0763 0.1852 220 BSPBio_001175 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K18 compound treatment 2330.0 873.39 0.7533 1871.0 458.28 0.3713 0.7952 0.9469 2121 BSPBio_001176 Oc1ccc(cc1)c2oc3cc(O)cc(O)c3c(=O)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K19 compound treatment 864.0 -592.61 -0.5111 504.0 -908.72 -0.7362 -0.882 -0.9841 3616862 BSPBio_001177 CCOC1O[C@H]([C@@H](COCc2ccccc2)OCc3ccccc3)[C@H](OCc4ccccc4)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K20 compound treatment 1016.0 -440.61 -0.38 1084.0 -328.72 -0.2663 -0.457 -0.9849 865102 BSPBio_001178 O=C(CCNNC(=O)c1ccncc1)NCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K21 compound treatment 390.0 -1066.6 -0.9199 391.0 -1021.7 -0.8277 -1.2358 -0.9986 3188150 BSPBio_001179 CCC(=O)[C@@]1(C)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K22 compound treatment 46.0 -1410.6 -1.2166 6.0 -1406.7 -1.1396 -1.6661 -0.9995 3616885 BSPBio_001180 CC(=CCC/C(=C/CC1=C(C)C(=O)c2ccccc2C1=O)/C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K23 mock treatment 1183.0 -273.61 -0.236 1049.0 -363.72 -0.2947 -0.3752 -0.9939 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 K24 mock treatment 1321.0 -135.61 -0.117 3.0 -1409.7 -1.142 -0.8902 -0.7755 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L01 mock treatment 717.0 -739.61 -0.6379 827.0 -585.72 -0.4745 -0.7866 -0.9894 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L02 mock treatment 2067.0 610.39 0.5264 1588.0 175.28 0.142 0.4727 0.8669 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L03 compound treatment 6.0 -1450.6 -1.2511 213.0 -1199.7 -0.9719 -1.5719 -0.9922 3419827 BSPBio_001181 CN(C(Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N4CCN(CC4)c5ccccc5)S(=O)(=O)c6cccc7cnccc67 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L04 compound treatment 1872.0 415.39 0.3583 920.0 -492.72 -0.3992 -0.0289 -0.0539 566 BSPBio_001182 COc1cc(/C=C(\C#N)/C(=O)N)cc(CSc2nc3ccccc3s2)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L05 compound treatment 607.0 -849.61 -0.7328 31.0 -1381.7 -1.1193 -1.3096 -0.9789 3650138 BSPBio_001183 C[C@@]1(O)C[C@@H]2O[C@@]1(C)n3c4ccccc4c5c6CNC(=O)c6c7c8ccccc8n2c7c35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L06 compound treatment 1826.0 369.39 0.3186 1404.0 -8.7188 -0.0071 0.2203 0.6913 1907780 BSPBio_001184 COC1=CC(=O)OC(C1)/C=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L07 compound treatment 717.0 -739.61 -0.6379 342.0 -1070.7 -0.8674 -1.0644 -0.9886 3104897 BSPBio_001185 CCC(C)[C@@H](CO[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCS(=O)(=O)C)C(=O)OC(C)C)NC[C@@H](N)CS 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L08 compound treatment 1896.0 439.39 0.379 84.0 -1328.7 -1.0764 -0.4932 -0.4322 431 BSPBio_001186 C(CN(Cc1ccccn1)Cc2ccccn2)N(Cc3ccccn3)Cc4ccccn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L09 compound treatment 253.0 -1203.6 -1.0381 0.0 -1412.7 -1.1445 -1.5433 -0.9988 1908 BSPBio_001187 [O-][n+]1onc(c1C#N)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L10 compound treatment 8.0 -1448.6 -1.2494 35.0 -1377.7 -1.1161 -1.6726 -0.9984 199 BSPBio_001188 C[C@H](/C=C(\C)/C=C/C(=O)NO)C(=O)c1ccc(cc1)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L11 compound treatment 2.0 -1454.6 -1.2545 0.0 -1412.7 -1.1445 -1.6964 -0.9989 3001166 BSPBio_001189 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L12 compound treatment 0.0 -1456.6 -1.2563 0.0 -1412.7 -1.1445 -1.6976 -0.9989 437 BSPBio_001190 CN1CCN(CCCN2c3ccccc3Sc4ccc(cc24)C(F)(F)F)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L13 compound treatment 1987.0 530.39 0.4574 2350.0 937.28 0.7593 0.8604 0.9706 284 BSPBio_001191 OC(=O)c1cc(ccc1O)N(Cc2ccccc2O)Cc3cc(O)ccc3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L14 compound treatment 2.0 -1454.6 -1.2545 12.0 -1400.7 -1.1347 -1.6895 -0.9987 3650140 BSPBio_001192 CC(C)C/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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L15 compound treatment 1581.0 124.39 0.1073 2584.0 1171.3 0.9489 0.7468 0.7821 1907779 BSPBio_001193 CC(C)n1cnc2c(NCc3ccccc3)nc(NCCO)nc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L16 compound treatment 1252.0 -204.61 -0.1765 1532.0 119.28 0.0966 -0.0565 -0.2806 2648 BSPBio_001194 NC(=N)Nc1ccc(cc1)C(=O)Oc2ccc3cc(ccc3c2)C(=N)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L17 compound treatment 1848.0 391.39 0.3376 1623.0 210.28 0.1704 0.3591 0.9499 3104898 BSPBio_001195 CC(C)C[C@H](NC(=O)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L18 compound treatment 1058.0 -398.61 -0.3438 865.0 -547.72 -0.4437 -0.5568 -0.992 553 BSPBio_001196 Oc1cc(C=C(C#N)C#N)ccc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L19 compound treatment 0.0 -1456.6 -1.2563 0.0 -1412.7 -1.1445 -1.6976 -0.9989 1954 BSPBio_001197 Cc1ccc(cc1)S(=O)(=O)/C=C/C#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L20 compound treatment 1222.0 -234.61 -0.2023 1184.0 -228.72 -0.1853 -0.2741 -0.999 568 BSPBio_001198 COc1ccc(C=C(C#N)C#N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L21 compound treatment 1601.0 144.39 0.1245 243.0 -1169.7 -0.9476 -0.582 -0.6089 1002387 BSPBio_001199 Oc1ccc(C=C(C#N)C#N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L22 compound treatment 4.0 -1452.6 -1.2528 0.0 -1412.7 -1.1445 -1.6951 -0.999 5 BSPBio_001200 CC(C)(C)c1cc(C=C(C#N)C#N)cc(c1O)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L23 mock treatment 1454.0 -2.6094 -0.0023 1381.0 -31.719 -0.0257 -0.0198 -0.7661 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 L24 mock treatment 216.0 -1240.6 -1.07 488.0 -924.72 -0.7491 -1.2863 -0.9848 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M01 mock treatment 2405.0 948.39 0.8179 2499.0 1086.3 0.88 1.2006 0.9993 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M02 mock treatment 2295.0 838.39 0.7231 1903.0 490.28 0.3972 0.7921 0.9602 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M03 compound treatment 1007.0 -449.61 -0.3878 989.0 -423.72 -0.3433 -0.5169 -0.9982 3480040 BSPBio_001201 COC(=O)C1=C(C)NC(=C(C1c2cccc3nonc23)C(=O)OC(C)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M04 compound treatment 354.0 -1102.6 -0.951 1096.0 -316.72 -0.2566 -0.8539 -0.8669 2929 BSPBio_001202 CCN[C@@H]1C[C@H](N)[C@@H](O[C@H]2OC(=CC[C@H]2N)CN)[C@H](O)[C@H]1O[C@H]3OC[C@](C)(O)[C@H](NC)[C@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M05 compound treatment 2078.0 621.39 0.5359 2072.0 659.28 0.5341 0.7566 1.0 1077199 BSPBio_001203 CCNC1(CCCCC1=O)c2cccs2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M06 compound treatment 2057.0 600.39 0.5178 194.0 -1218.7 -0.9873 -0.332 -0.2978 3173761 BSPBio_001204 N[C@@H](C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)Cl)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M07 compound treatment 1942.0 485.39 0.4186 1870.0 457.28 0.3704 0.558 0.9981 3069807 BSPBio_001205 CNC(C)CCC=C(C)C.OC(C(O)C(O)C(=O)O)C(O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M08 compound treatment 1829.0 372.39 0.3212 1655.0 242.28 0.1963 0.3659 0.9721 3616891 BSPBio_001206 O[C@H]1C[C@](O)(C[C@H](O)[C@@H]1O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M09 compound treatment 1950.0 493.39 0.4255 1869.0 456.28 0.3696 0.5623 0.9975 3188151 BSPBio_001207 CC1CS(=O)(=O)CCN1/N=C/c2ccc(o2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M10 compound treatment 2027.0 570.39 0.4919 1940.0 527.28 0.4272 0.6499 0.9975 3616894 BSPBio_001208 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]4OC4\C=C\C(=O)O[C@H](C)C\C=C\C=C\C=C\C=C2)[C@@H](O)[C@@H](N)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M11 compound treatment 863.0 -593.61 -0.512 1025.0 -387.72 -0.3141 -0.5841 -0.9725 1698 BSPBio_001209 N#Cc1ccc(cc1)C(c2ccc(C#N)cc2)n3cncn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M12 compound treatment 1205.0 -251.61 -0.217 1728.0 315.28 0.2554 0.0272 0.081 3616896 BSPBio_001210 COC(=O)C1C(=CC=C2c3cc4[nH]c(cc5nc(cc6[nH]c(cc(n3)[C@]12C)c(C)c6CCC(=O)O)c(CCC(=O)O)c5C)c(C=C)c4C)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M13 compound treatment 1886.0 429.39 0.3703 1620.0 207.28 0.1679 0.3806 0.936 3174242 BSPBio_001211 OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M14 compound treatment 1533.0 76.391 0.0659 1375.0 -37.719 -0.0306 0.025 0.344 1000348 BSPBio_001212 C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(=C(N2C1=O)C(=O)O)S[C@@H]3CN[C@@H](C3)C(=O)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M15 compound treatment 2447.0 990.39 0.8542 2424.0 1011.3 0.8193 1.1833 0.9998 3188152 BSPBio_001213 CC(N)C(=O)Nc1c(C)cccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M16 compound treatment 2316.0 859.39 0.7412 2038.0 625.28 0.5065 0.8823 0.9828 3069861 BSPBio_001214 CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N2C(C[C@@H]3CCC[C@@H]32)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M17 compound treatment 166.0 -1290.6 -1.1131 143.0 -1269.7 -1.0286 -1.5144 -0.9992 3188153 BSPBio_001215 CC1(C)S[C@@H]2[C@H](NC(=O)COc3ccccc3)C(=O)N2C1C(=O)O.C(CNCc1ccccc1)NCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M18 compound treatment 1316.0 -140.61 -0.1213 1585.0 172.28 0.1396 0.0129 0.07 1517 BSPBio_001216 CCC1(NC(=O)N(C)C1=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M19 compound treatment 1018.0 -438.61 -0.3783 927.0 -485.72 -0.3935 -0.5457 -0.9998 1795 BSPBio_001217 Cc1nc2CCCCn2c(=O)c1CCN3CCC(CC3)c4noc5cc(F)ccc45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M20 compound treatment 963.0 -493.61 -0.4257 1102.0 -310.72 -0.2517 -0.479 -0.9686 3616904 BSPBio_001218 CCC(C)N1CCC2(CC1)NC3=C4NC(=O)/C(=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(=O)C)[C@H](C)[C@@H](OC)/C=C/O[C@@]5(C)Oc6c(C5=O)c(C3=N2)c(C4=O)c(O)c6C)/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M21 compound treatment 1098.0 -358.61 -0.3093 1452.0 39.281 0.0318 -0.1962 -0.631 1001638 BSPBio_001219 CC(C)NC(=O)NS(=O)(=O)c1cnccc1Nc2cccc(C)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M22 compound treatment 133.0 -1323.6 -1.1416 203.0 -1209.7 -0.98 -1.5002 -0.9971 3069862 BSPBio_001220 CCCCc1ccc2[nH]c(NC(=O)OC)nc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M23 mock treatment 1232.0 -224.61 -0.1937 1070.0 -342.72 -0.2776 -0.3333 -0.9845 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 M24 mock treatment 1052.0 -404.61 -0.349 0.0 -1412.7 -1.1445 -1.056 -0.8826 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N01 mock treatment 2355.0 898.39 0.7748 2072.0 659.28 0.5341 0.9255 0.9835 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N02 mock treatment 2375.0 918.39 0.7921 2640.0 1227.3 0.9942 1.2631 0.9937 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N03 compound treatment 1384.0 -72.609 -0.0626 1810.0 397.28 0.3218 0.1833 0.559 423 BSPBio_001221 COC(=O)[C@@H](N)CCCNC(=N)N[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N04 compound treatment 85.0 -1371.6 -1.183 22.0 -1390.7 -1.1266 -1.6331 -0.9997 348 BSPBio_001222 COc1ccc2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCc2c1)NCCCCCCN5C(=O)C=CC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N05 compound treatment 1355.0 -101.61 -0.0876 733.0 -679.72 -0.5506 -0.4513 -0.8095 321 BSPBio_001223 O=c1cc(oc2c(cccc12)c3ccccc3)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N06 compound treatment 264.0 -1192.6 -1.0286 143.0 -1269.7 -1.0286 -1.4547 -1.0 325 BSPBio_001224 N/C(=C(/C#N)\C(=C(/N)\Sc1ccccc1N)\C#N)/Sc2ccccc2N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N07 compound treatment 1.0 -1455.6 -1.2554 2.0 -1410.7 -1.1428 -1.6958 -0.9989 243 BSPBio_001225 O=C1C=C(Nc2ccccc2)C(=O)c3cccnc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N08 compound treatment 3.0 -1453.6 -1.2537 1.0 -1411.7 -1.1437 -1.6952 -0.9989 2430 BSPBio_001226 CC(C)C1NC(=O)C(C)OC(=O)C(NC(=O)C(OC(=O)C(NC(=O)C(C)OC(=O)C(NC(=O)C(OC(=O)C(NC(=O)C(C)OC(=O)C(NC(=O)C(OC1=O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N09 compound treatment 39.0 -1417.6 -1.2226 23.0 -1389.7 -1.1258 -1.6606 -0.9992 1059329 BSPBio_001227 Nc1ncnc2n(cc(I)c12)C3OC(CO)C(O)C3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N10 compound treatment 39.0 -1417.6 -1.2226 20.0 -1392.7 -1.1283 -1.6623 -0.9992 3650142 BSPBio_001228 CC[C@]1(O)C[C@@H]2CN(C1)CCc3c([nH]c4ccccc34)[C@@](C2)(C(=O)OC)c5cc6c(cc5OC)N(C)[C@@H]7[C@@]86CCN9CC=C[C@](CC)([C@H]98)[C@@H](OC(=O)C)[C@]7(O)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N11 compound treatment 59.0 -1397.6 -1.2054 45.0 -1367.7 -1.108 -1.6358 -0.9991 3104900 BSPBio_001229 C/C(=C\CCC1C=CC(OC1O)C2=CC(=O)OC2O)/CCC3=C(C)CCCC3(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N12 compound treatment 1381.0 -75.609 -0.0652 427.0 -985.72 -0.7985 -0.6108 -0.7623 382 BSPBio_001230 NCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N13 compound treatment 15.0 -1441.6 -1.2433 9.0 -1403.7 -1.1372 -1.6833 -0.999 1001972 BSPBio_001231 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N14 compound treatment 1056.0 -400.61 -0.3455 1245.0 -167.72 -0.1359 -0.3404 -0.9168 2080696 BSPBio_001232 COC[C@H]1OC(=O)c2coc3C(=O)C4=C([C@@H](C[C@@]5(C)[C@H]4CCC5=O)OC(=O)C)[C@]1(C)c23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N15 compound treatment 823.0 -633.61 -0.5465 1229.0 -183.72 -0.1488 -0.4916 -0.8681 BSPBio_001233 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N16 compound treatment 2045.0 588.39 0.5075 1876.0 463.28 0.3753 0.6242 0.989 677 BSPBio_001234 C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc2ccncc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N17 compound treatment 1581.0 124.39 0.1073 1425.0 12.281 0.0099 0.0829 0.7694 419 BSPBio_001235 CC1=NN(C(=O)C1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N18 compound treatment 1983.0 526.39 0.454 1691.0 278.28 0.2254 0.4804 0.9478 3000363 BSPBio_001236 COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N19 compound treatment 8.0 -1448.6 -1.2494 20.0 -1392.7 -1.1283 -1.6812 -0.9987 2082 BSPBio_001237 CN1C(=O)[C@@]23CC4=CC=C[C@H](O)[C@H]4N3C(=O)[C@@]1(CO)SS2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N20 compound treatment 19.0 -1437.6 -1.2399 0.0 -1412.7 -1.1445 -1.686 -0.9992 207 BSPBio_001238 CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)/C=C/S(=O)(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N21 compound treatment 1059.0 -397.61 -0.3429 1575.0 162.28 0.1315 -0.1495 -0.4071 638 BSPBio_001239 C/C(=C(\C#N)/C(=O)Nc1cc(Br)ccc1Br)/O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N22 compound treatment 1643.0 186.39 0.1608 1965.0 552.28 0.4474 0.43 0.9046 352 BSPBio_001240 CN(C)c1cccc(c1)C(=O)Nc2ccc(C)c(NC(=O)c3ccc(O)cc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N23 mock treatment 1259.0 -197.61 -0.1704 1169.0 -243.72 -0.1974 -0.2601 -0.9973 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 N24 mock treatment 725.0 -731.61 -0.631 734.0 -678.72 -0.5498 -0.835 -0.9976 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O01 mock treatment 2262.0 805.39 0.6946 2023.0 610.28 0.4944 0.8408 0.9861 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O02 mock treatment 1990.0 533.39 0.46 1453.0 40.281 0.0326 0.3484 0.7554 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O03 compound treatment 1795.0 338.39 0.2918 278.0 -1134.7 -0.9193 -0.4436 -0.46 2080909 BSPBio_001241 CCCCN(CCCC)CCC(O)c1cc2c(Cl)cc(Cl)cc2c3cc(ccc13)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O04 compound treatment 1261.0 -195.61 -0.1687 1116.0 -296.72 -0.2404 -0.2893 -0.985 3856 BSPBio_001242 CNC1(C)C2CCC(C2)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O05 compound treatment 1640.0 183.39 0.1582 1335.0 -77.719 -0.063 0.0673 0.3955 3069809 BSPBio_001243 CCCNC(C)C(=O)Nc1c(C)csc1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O06 compound treatment 287.0 -1169.6 -1.0087 450.0 -962.72 -0.7799 -1.2648 -0.9919 3199 BSPBio_001244 CNNCc1ccc(cc1)C(=O)NC(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O07 compound treatment 1774.0 317.39 0.2737 1187.0 -225.72 -0.1829 0.0643 0.1952 3616863 BSPBio_001245 CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O08 compound treatment 2150.0 693.39 0.598 1882.0 469.28 0.3802 0.6917 0.9761 3616911 BSPBio_001246 NCCC[C@H](N)CC(=O)N[C@H]1CNC(=O)[C@@H](NC(=O)/C(=C/NC(=O)N)/NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC1=O)[C@H]2C[C@H](O)N=C(N)N2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O09 compound treatment 3749.0 2292.4 1.9771 1673.0 260.28 0.2109 1.5471 0.7781 3177327 BSPBio_001247 CC(=O)O[C@H]1[C@H](C[C@H]2[C@@H]3CC[C@H]4C[C@H](OC(=O)C)[C@H](C[C@]4(C)[C@H]3CC[C@]12C)[N+]5(C)CCCCC5)[N+]6(C)CCCCC6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O10 compound treatment 1702.0 245.39 0.2116 1324.0 -88.719 -0.0719 0.0988 0.4422 3069863 BSPBio_001248 CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@@H](O)[C@H](Cc3ccccc3)NC(=O)[C@H](CC(=O)N)NC(=O)c4ccc5ccccc5n4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O11 compound treatment 1750.0 293.39 0.253 1274.0 -138.72 -0.1124 0.0995 0.3592 1511611 BSPBio_001249 CCc1c(C)[nH]c2CCC(CN3CCOCC3)C(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O12 compound treatment 1314.0 -142.61 -0.123 1827.0 414.28 0.3356 0.1503 0.4206 1509 BSPBio_001250 Cn1c(COC(=O)N)ncc1[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O13 compound treatment 1540.0 83.391 0.0719 1584.0 171.28 0.1388 0.149 0.9532 3616868 BSPBio_001251 OC/C=C/1\C[N@+]2(CC=C)CC[C@]3([C@@H]2C[C@@H]1C4=CN5C6C(=CN7C43)[C@H]\8C[C@H]9[C@@]6(CC[N@@+]9(CC=C)C/C8=C\CO)c%10ccccc5%10)c%11ccccc7%11 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O14 compound treatment 1536.0 79.391 0.0685 1774.0 361.28 0.2927 0.2554 0.8496 1829 BSPBio_001252 CCN[C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O15 compound treatment 1276.0 -180.61 -0.1558 1804.0 391.28 0.317 0.114 0.3228 2747 BSPBio_001253 Nc1ccn([C@H]2CC[C@@H](CO)O2)c(=O)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O16 compound treatment 1195.0 -261.61 -0.2256 817.0 -595.72 -0.4826 -0.5008 -0.94 1078453 BSPBio_001254 Fc1ccc(cc1)C(=O)CCCN2CCN(CC2)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O17 compound treatment 793.0 -663.61 -0.5723 925.0 -487.72 -0.3951 -0.6841 -0.9836 3069810 BSPBio_001255 COc1ccc(C[C@](C)(N)C(=O)O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O18 compound treatment 1210.0 -246.61 -0.2127 1379.0 -33.719 -0.0273 -0.1697 -0.7914 3616914 BSPBio_001256 CO/N=C(\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)C[N+]3(C)CCCC3)/c4csc(N)n4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O19 compound treatment 1045.0 -411.61 -0.355 1319.0 -93.719 -0.0759 -0.3047 -0.8394 3069811 BSPBio_001257 C[C@@H]1CN(CC[C@]1(C(=O)O)c2ccccc2)[C@H]3CC[C@](CC3)(C#N)c4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O20 compound treatment 207.0 -1249.6 -1.0777 330.0 -1082.7 -0.8771 -1.3823 -0.9948 3188289 BSPBio_001258 C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@H]1C(=O)COC(=O)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O21 compound treatment 10.0 -1446.6 -1.2476 9.0 -1403.7 -1.1372 -1.6863 -0.9989 3188156 BSPBio_001259 CN(C)c1ccc2[n+](C)c(/C=C\c3cc(C)n(c3C)c4ccccc4)ccc2c1.OC(=O)c1cc2ccccc2c(Cc3c(O)c(cc4ccccc34)C(=O)O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O22 compound treatment 696.0 -760.61 -0.656 1601.0 188.28 0.1525 -0.356 -0.5286 2884 BSPBio_001260 CC1(C)S[C@@H]2[C@H](NC(=O)C3(N)CCCCC3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O23 mock treatment 1163.0 -293.61 -0.2532 1215.0 -197.72 -0.1602 -0.2923 -0.9756 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 O24 mock treatment 1305.0 -151.61 -0.1308 0.0 -1412.7 -1.1445 -0.9017 -0.7828 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P01 mock treatment 1677.0 220.39 0.1901 1758.0 345.28 0.2797 0.3322 0.9823 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P02 mock treatment 518.0 -938.61 -0.8095 660.0 -752.72 -0.6098 -1.0036 -0.9902 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P03 compound treatment 68.0 -1388.6 -1.1976 36.0 -1376.7 -1.1153 -1.6355 -0.9994 3650143 BSPBio_001261 CCCC(NC(=O)c1ccc(cc1)N(C)Cc2cnc3nc(N)nc(N)c3n2)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P04 compound treatment 1742.0 285.39 0.2461 1511.0 98.281 0.0796 0.2303 0.8904 201 BSPBio_001262 COC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)CF 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P05 compound treatment 722.0 -734.61 -0.6336 1383.0 -29.719 -0.0241 -0.465 -0.7334 1001921 BSPBio_001263 Clc1ccc(cn1)C2CC3CCC2N3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P06 compound treatment 1355.0 -101.61 -0.0876 1449.0 36.281 0.0294 -0.0412 -0.4456 2217 BSPBio_001264 CS(=O)(=O)Nc1ccc(cc1OC2CCCCC2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P07 compound treatment 148.0 -1308.6 -1.1286 38.0 -1374.7 -1.1137 -1.5855 -1.0 1607 BSPBio_001265 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P08 compound treatment 1.0 -1455.6 -1.2554 0.0 -1412.7 -1.1445 -1.697 -0.9989 1917 BSPBio_001266 CC1=C(C)C(=O)C(=C(C)C1=O)CCCCC#CCCCC#CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P09 compound treatment 24.0 -1432.6 -1.2356 6.0 -1406.7 -1.1396 -1.6795 -0.9992 1000019 BSPBio_001267 CO[C@@]12[C@H]3N[C@H]3CN2C4=C([C@H]1COC(=O)N)C(=O)C(=C(C)C4=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P10 compound treatment 2.0 -1454.6 -1.2545 0.0 -1412.7 -1.1445 -1.6964 -0.9989 3650144 BSPBio_001268 CCC/C(=C/Cc1c(O)c2C(=O)OCc2c(C)c1OC)/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P11 compound treatment 160.0 -1296.6 -1.1183 126.0 -1286.7 -1.0424 -1.5278 -0.9994 281 BSPBio_001269 Ic1cccc2c(cccc12)S(=O)(=O)N3CCCNCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P12 compound treatment 10.0 -1446.6 -1.2476 4.0 -1408.7 -1.1412 -1.6892 -0.999 3650146 BSPBio_001270 CC(=CC[C@@H](O)C1=CC(=O)c2c(O)ccc(O)c2C1=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P13 compound treatment 464.0 -992.61 -0.8561 286.0 -1126.7 -0.9128 -1.2508 -0.9995 428 BSPBio_001271 Clc1cccc2c(cccc12)S(=O)(=O)N3CCCNCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P14 compound treatment 1985.0 528.39 0.4557 1414.0 1.2813 0.001 0.323 0.7087 3104904 BSPBio_001272 C1C[C@H]2CCCCCC[C@H]3CCN4CCC[C@H](CCCCCC[C@H]5CCN(C1)[C@@H]2O5)[C@H]4O3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P15 compound treatment 857.0 -599.61 -0.5171 1820.0 407.28 0.3299 -0.1324 -0.2158 438 BSPBio_001273 CCOC(=O)C1=C(C)NC(=S)NC1c2cccc(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P16 compound treatment 541.0 -915.61 -0.7897 450.0 -962.72 -0.7799 -1.1099 -1.0 1907782 BSPBio_001274 Oc1ccc(/C=C(/C#N)\C(=O)OC\C=C\c2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P17 compound treatment 1060.0 -396.61 -0.3421 884.0 -528.72 -0.4283 -0.5447 -0.9938 656 BSPBio_001275 Oc1c(Br)cc(/C=C/2\C(=O)Nc3ccc(I)cc23)cc1Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P18 compound treatment 1.0 -1455.6 -1.2554 1.0 -1411.7 -1.1437 -1.6964 -0.9989 3104917 BSPBio_001276 C/C=C/C\C=C\CCC(=O)[C@H]1O[C@H]1C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P19 compound treatment 0.0 -1456.6 -1.2563 2.0 -1410.7 -1.1428 -1.6964 -0.9989 3650147 BSPBio_001277 CC[C@]1(CC[C@@H](O1)[C@]2(C)CCC3(C[C@H](O)[C@@H](C)[C@H](O3)[C@@H](C)[C@@H](OC)[C@H](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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P20 compound treatment 0.0 -1456.6 -1.2563 99.0 -1313.7 -1.0643 -1.6409 -0.9966 1395 BSPBio_001278 CC(COc1ccccc1)N(CCCl)Cc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P21 compound treatment 204.0 -1252.6 -1.0803 178.0 -1234.7 -1.0003 -1.4712 -0.9993 3173349 BSPBio_001279 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@H](C[C@H]4C)OC)[C@H](C[C@@H](C)C\C(=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]2C)\C)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P22 compound treatment 12.0 -1444.6 -1.2459 0.0 -1412.7 -1.1445 -1.6903 -0.9991 1303231 BSPBio_001280 CN(C)CC(O)Cn1c2ccc(Br)cc2c3cc(Br)ccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P23 mock treatment 900.0 -556.61 -0.4801 1210.0 -202.72 -0.1642 -0.4556 -0.8979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2456 P24 mock treatment 1319.0 -137.61 -0.1187 1350.0 -62.719 -0.0508 -0.1198 -0.9283 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A01 mock treatment 268.0 -1119.7 -0.9657 2157.0 1322.3 1.0712 0.0746 0.0517 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A02 mock treatment 1710.0 322.27 0.2779 1162.0 327.28 0.2651 0.384 0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A03 compound treatment 467.0 -920.73 -0.7941 274.0 -560.72 -0.4542 -0.8827 -0.9649 315 BSPBio_001281 CCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)/C=C/CCCCCCCCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A04 compound treatment 1237.0 -150.73 -0.13 715.0 -119.72 -0.097 -0.1605 -0.9896 85 BSPBio_001282 CCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)NC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A05 compound treatment 1322.0 -65.734 -0.0567 803.0 -31.719 -0.0257 -0.0583 -0.9359 29 BSPBio_001283 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)NCCCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A06 compound treatment 678.0 -709.73 -0.6121 1006.0 171.28 0.1388 -0.3347 -0.5333 302 BSPBio_001284 CCCCC[C@H](O)C/C=C/1\[C@@H](C/C=C\CCCC(=O)O)C=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A07 compound treatment 2091.0 703.27 0.6065 801.0 -33.719 -0.0273 0.4096 0.6746 10 BSPBio_001285 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N[C@H](C)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A08 compound treatment 991.0 -396.73 -0.3422 1236.0 401.28 0.3251 -0.0121 -0.0256 262 BSPBio_001286 CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A09 compound treatment 3.0 -1384.7 -1.1943 33.0 -801.72 -0.6495 -1.3037 -0.959 100 BSPBio_001287 C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)C[C@H](O)C3=C)/CCC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A10 compound treatment 3.0 -1384.7 -1.1943 113.0 -721.72 -0.5847 -1.2579 -0.946 1000034 BSPBio_001288 CCCCCCCCCCCCCCC[C@@H](O)[C@@H](N)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A11 compound treatment 1485.0 97.266 0.0839 865.0 30.281 0.0245 0.0767 0.8772 148 BSPBio_001289 CCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A12 compound treatment 1107.0 -280.73 -0.2421 1138.0 303.28 0.2457 0.0025 0.0073 122 BSPBio_001290 C(c1c[nH]c2ccccc12)c3c[nH]c4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A13 compound treatment 2128.0 740.27 0.6384 1096.0 261.28 0.2117 0.6011 0.8937 150 BSPBio_001291 CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A14 compound treatment 1635.0 247.27 0.2133 898.0 63.281 0.0513 0.187 0.8528 31 BSPBio_001292 CCCCCCCCCCCCCCC[C@H](O)[C@@H](N)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A15 compound treatment 1372.0 -15.734 -0.0136 856.0 21.281 0.0172 0.0026 0.1183 171 BSPBio_001293 CCCCCCCC/C=C\CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC/C=C\CCCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A16 compound treatment 976.0 -411.73 -0.3551 485.0 -349.72 -0.2833 -0.4514 -0.9937 33 BSPBio_001294 CCCCCCCCCC(=O)N[C@H](CN1CCOCC1)[C@H](O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A17 compound treatment 1328.0 -59.734 -0.0515 814.0 -20.719 -0.0168 -0.0483 -0.8914 141 BSPBio_001295 CCCCC/C=C\CC1OC1C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A18 compound treatment 1181.0 -206.73 -0.1783 662.0 -172.72 -0.1399 -0.225 -0.9928 34 BSPBio_001296 CCCCCCCCCCCCCCCC(=O)N[C@H](CN1CCOCC1)[C@H](O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A19 compound treatment 1693.0 305.27 0.2633 952.0 117.28 0.095 0.2533 0.9051 1000003 BSPBio_001297 CCCCC/C=C\C[C@@H](O)/C=C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A20 compound treatment 1183.0 -204.73 -0.1766 712.0 -122.72 -0.0994 -0.1952 -0.9631 223 BSPBio_001298 CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A21 compound treatment 1242.0 -145.73 -0.1257 949.0 114.28 0.0926 -0.0234 -0.15 46 BSPBio_001299 CCCCC/C=C\C[C@H](O)/C=C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A22 compound treatment 1639.0 251.27 0.2167 890.0 55.281 0.0448 0.1849 0.8356 268 BSPBio_001300 CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A23 mock treatment 1467.0 79.266 0.0684 532.0 -302.72 -0.2452 -0.1251 -0.4913 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 A24 mock treatment 907.0 -480.73 -0.4146 545.0 -289.72 -0.2347 -0.4591 -0.9637 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B01 mock treatment 1195.0 -192.73 -0.1662 2179.0 1344.3 1.089 0.6525 0.5923 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B02 mock treatment 1481.0 93.266 0.0804 890.0 55.281 0.0448 0.0885 0.9618 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B03 compound treatment 1.0 -1386.7 -1.196 1.0 -833.72 -0.6754 -1.3233 -0.9634 1000048 BSPBio_001301 CC(C)COCC(CN(Cc1ccccc1)c2ccccc2)N3CCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B04 compound treatment 9.0 -1378.7 -1.1891 7.0 -827.72 -0.6705 -1.315 -0.9633 2139 BSPBio_001302 O[C@H]1C=C2CCN3Cc4cc5OCOc5cc4[C@@H]([C@H]32)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B05 compound treatment 362.0 -1025.7 -0.8847 118.0 -716.72 -0.5806 -1.0361 -0.9791 3650148 BSPBio_001303 C/C(=C/1\C(=O)[C@@H]2[C@@H]3[C@@H](Cc4cccc5[nH]cc3c45)C(C)(C)N2C1=O)/O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B06 compound treatment 7.0 -1380.7 -1.1908 0.0 -834.72 -0.6762 -1.3202 -0.9641 3000451 BSPBio_001304 CC[C@@]1(O)C(=O)OCc2c1cc3-c4nc5cccc(O)c5cc4Cn3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B07 compound treatment 39.0 -1348.7 -1.1632 102.0 -732.72 -0.5936 -1.2423 -0.9512 3000787 BSPBio_001305 [O-][N+](=O)c1ccc(cc1)c2ccc(/C=N/N3CC(=O)NC3=O)o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B08 compound treatment 11.0 -1376.7 -1.1874 0.0 -834.72 -0.6762 -1.3178 -0.9644 2127 BSPBio_001306 CC1(C)CCC2=C(O1)c3ccccc3C(=O)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B09 compound treatment 24.0 -1363.7 -1.1762 50.0 -784.72 -0.6357 -1.2812 -0.9583 35 BSPBio_001307 CC1=Nc2ccc(Cl)cc2S(=O)(=O)N1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B10 compound treatment 0.0 -1387.7 -1.1969 0.0 -834.72 -0.6762 -1.3245 -0.9635 3103826 BSPBio_001308 C/C/1=C\CC[C@@]2(C)O[C@@H]2[C@H]3OC(=O)C(=C)[C@@H]3CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B11 compound treatment 1785.0 397.27 0.3426 1269.0 434.28 0.3518 0.491 0.9999 3103827 BSPBio_001309 N/C(=N\C(=O)c1nc(Cl)c(N)nc1N)/NCc2ccc(Cl)cc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B12 compound treatment 3.0 -1384.7 -1.1943 0.0 -834.72 -0.6762 -1.3226 -0.9637 1907748 BSPBio_001310 CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B13 compound treatment 1590.0 202.27 0.1744 785.0 -49.719 -0.0403 0.0949 0.5299 355 BSPBio_001311 COc1ccc(cc1)[C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B14 compound treatment 538.0 -849.73 -0.7329 6.0 -828.72 -0.6714 -0.9929 -0.999 3090091 BSPBio_001312 C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](O)[C@@]3(C)[C@H]1C=CC3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B15 compound treatment 2089.0 701.27 0.6048 842.0 7.2813 0.0059 0.4318 0.714 357 BSPBio_001313 Cc1cccc(CCN2CCC(CC2)C(=O)c3ccc(NS(=O)(=O)C)cc3)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B16 compound treatment 1371.0 -16.734 -0.0144 865.0 30.281 0.0245 0.0071 0.2509 1000105 BSPBio_001314 CC(C)(Oc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B17 compound treatment 399.0 -988.73 -0.8527 162.0 -672.72 -0.545 -0.9883 -0.9766 39 BSPBio_001315 Nc1c(S(=O)C(F)(F)F)c(C#N)nn1c2c(Cl)cc(cc2Cl)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B18 compound treatment 361.0 -1026.7 -0.8855 202.0 -632.72 -0.5126 -0.9886 -0.9662 1907749 BSPBio_001316 CCOC(=O)CN1C(=O)CC(C[C@@H](O)C2C[C@@H](C)C[C@H](C)C2=O)CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B19 compound treatment 1.0 -1386.7 -1.196 4.0 -830.72 -0.673 -1.3216 -0.963 359 BSPBio_001317 FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NCC2CCCCN2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B20 compound treatment 10.0 -1377.7 -1.1882 0.0 -834.72 -0.6762 -1.3184 -0.9643 1907750 BSPBio_001318 CC[C@@H]1/C=C(\C)/C[C@H](C)C[C@H](OC)[C@H]2O[C@](O)([C@H](C)C[C@@H]2OC)C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H]([C@H](C)[C@@H](O)CC1=O)\C(=C\[C@@H]4CC[C@@H](O)[C@@H](C4)OC)\C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B21 compound treatment 10.0 -1377.7 -1.1882 2.0 -832.72 -0.6746 -1.3172 -0.964 41 BSPBio_001319 OC(=O)c1ccccc1Nc2cccc(c2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B22 compound treatment 596.0 -791.73 -0.6828 113.0 -721.72 -0.5847 -0.8963 -0.997 2349 BSPBio_001320 CC12CC=C3C(CCC4=CC(=O)C=CC43C)C2CC[C@@H]1C(=O)CN5CCN(CC5)c6cc(nc(n6)N7CCCC7)N8CCCC8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B23 mock treatment 1516.0 128.27 0.1106 639.0 -195.72 -0.1586 -0.0339 -0.1753 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 B24 mock treatment 710.0 -677.73 -0.5845 678.0 -156.72 -0.127 -0.5031 -0.8411 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C01 mock treatment 2011.0 623.27 0.5375 1264.0 429.28 0.3478 0.626 0.9778 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C02 mock treatment 1305.0 -82.734 -0.0714 1264.0 429.28 0.3478 0.1955 0.5506 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C03 compound treatment 1706.0 318.27 0.2745 1357.0 522.28 0.4231 0.4933 0.9781 87 BSPBio_001321 CCCCC/C=C\C[C@H](OO)/C=C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C04 compound treatment 1622.0 234.27 0.202 1281.0 446.28 0.3615 0.3985 0.9622 264 BSPBio_001322 CC/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C05 compound treatment 1656.0 268.27 0.2314 828.0 -6.7188 -0.0054 0.1598 0.6903 301 BSPBio_001323 COCCCCCCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C06 compound treatment 1566.0 178.27 0.1537 1186.0 351.28 0.2846 0.3099 0.9582 233 BSPBio_001324 CCCCCCCCCCC/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C07 compound treatment 1878.0 490.27 0.4228 636.0 -198.72 -0.161 0.1852 0.4092 61 BSPBio_001325 CCCCC[C@H](O)/C=C/C=C\CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C08 compound treatment 1521.0 133.27 0.1149 1030.0 195.28 0.1582 0.1931 0.9877 256 BSPBio_001326 CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C09 compound treatment 1656.0 268.27 0.2314 1264.0 429.28 0.3478 0.4095 0.9804 90 BSPBio_001327 CCCCC[C@H](OO)/C=C/C=C\CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C10 compound treatment 1396.0 8.2656 0.0071 365.0 -469.72 -0.3805 -0.264 -0.6937 221 BSPBio_001328 CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C11 compound treatment 1692.0 304.27 0.2624 935.0 100.28 0.0812 0.243 0.8846 304 BSPBio_001329 CCCCC[C@H](O)CC[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C12 compound treatment 1439.0 51.266 0.0442 1857.0 1022.3 0.8282 0.6169 0.7438 260 BSPBio_001330 CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C13 compound treatment 1233.0 -154.73 -0.1335 631.0 -203.72 -0.165 -0.2111 -0.9944 1000009 BSPBio_001331 C/C(=C\C=C\C(=C/C(=O)O)\C)/C=C/C1=C(C)CCCC1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C14 compound treatment 887.0 -500.73 -0.4319 724.0 -110.72 -0.0897 -0.3688 -0.8361 1000007 BSPBio_001332 CCCCCCCCCCCCCCCCOC[C@@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C15 compound treatment 1345.0 -42.734 -0.0369 1064.0 229.28 0.1857 0.1053 0.556 3650149 BSPBio_001333 CCCCCC(=O)/C=C/C=C\CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C16 compound treatment 1080.0 -307.73 -0.2654 656.0 -178.72 -0.1448 -0.29 -0.9594 55 BSPBio_001334 CC(=CCC/C(=C/CC/C(=C/CSCC(=O)O)/C)/C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C17 compound treatment 1357.0 -30.734 -0.0265 1041.0 206.28 0.1671 0.0994 0.5876 143 BSPBio_001335 CCCCCC1OC1C/C=C\C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C18 compound treatment 1115.0 -272.73 -0.2352 738.0 -96.719 -0.0784 -0.2217 -0.8943 217 BSPBio_001336 O[C@@H](COc1cccc(c1)C(F)(F)F)/C=C/[C@H]2[C@H](O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C19 compound treatment 1439.0 51.266 0.0442 846.0 11.281 0.0091 0.0377 0.8356 50 BSPBio_001337 CCCCC[C@H](O)/C=C/C=C\C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C20 compound treatment 1012.0 -375.73 -0.3241 645.0 -189.72 -0.1537 -0.3378 -0.9419 231 BSPBio_001338 CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C21 compound treatment 1165.0 -222.73 -0.1921 589.0 -245.72 -0.1991 -0.2766 -0.9998 89 BSPBio_001339 CCCCC[C@H](OO)/C=C/C=C\C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C22 compound treatment 843.0 -544.73 -0.4698 588.0 -246.72 -0.1999 -0.4735 -0.9275 92 BSPBio_001340 CCCCC/C=C\CC1OC1CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C23 mock treatment 1010.0 -377.73 -0.3258 1917.0 1082.3 0.8768 0.3896 0.4165 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 C24 mock treatment 773.0 -614.73 -0.5302 381.0 -453.72 -0.3676 -0.6348 -0.984 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D01 mock treatment 2283.0 895.27 0.7721 1476.0 641.28 0.5195 0.9133 0.9814 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D02 mock treatment 1711.0 323.27 0.2788 1460.0 625.28 0.5065 0.5553 0.9604 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D03 compound treatment 14.0 -1373.7 -1.1848 0.0 -834.72 -0.6762 -1.3159 -0.9646 43 BSPBio_001341 Fc1ccc(cc1)C(N2CCN(C/C=C/c3ccccc3)CC2)c4ccc(F)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D04 compound treatment 0.0 -1387.7 -1.1969 0.0 -834.72 -0.6762 -1.3245 -0.9635 1531 BSPBio_001342 O=c1n([se]c2ccccc12)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D05 compound treatment 1561.0 173.27 0.1494 967.0 132.28 0.1072 0.1814 0.9867 23081 BSPBio_001343 Fc1ccc(cc1)C(CCCN2CCC3(CC2)N(CNC3=O)c4ccccc4)c5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D06 compound treatment 1605.0 217.27 0.1874 1990.0 1155.3 0.9359 0.7943 0.8322 1875 BSPBio_001344 FC(F)(F)c1ccccc1n2ccnc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D07 compound treatment 1097.0 -290.73 -0.2507 708.0 -126.72 -0.1027 -0.2499 -0.9223 907317 BSPBio_001345 COC(=O)c1c(C)[nH]c(C)c1C(=O)c2ccccc2Cc3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D08 compound treatment 1764.0 376.27 0.3245 1494.0 659.28 0.5341 0.6071 0.9715 2372 BSPBio_001346 COc1cc(ccc1OC(F)F)c2ccc(=O)[nH]n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D09 compound treatment 17.0 -1370.7 -1.1822 28.0 -806.72 -0.6535 -1.2981 -0.9609 70 BSPBio_001347 CCCCC[C@H](O)CC(=O)CCc1ccc(O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D10 compound treatment 1451.0 63.266 0.0546 1265.0 430.28 0.3486 0.2851 0.808 1196 BSPBio_001348 CCCOc1ccccc1c2nc3[nH]nnc3c(=O)[nH]2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D11 compound treatment 1288.0 -99.734 -0.086 1307.0 472.28 0.3826 0.2097 0.5348 72 BSPBio_001349 Cc1cnc(cn1)C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC3CCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D12 compound treatment 280.0 -1107.7 -0.9554 137.0 -697.72 -0.5652 -1.0752 -0.9686 3650151 BSPBio_001350 CC[C@]1(CCCN2CCc3c4C21)C=C(C)n4c5ccccc35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D13 compound treatment 13.0 -1374.7 -1.1857 1337.0 502.28 0.4069 -0.5507 -0.4393 74 BSPBio_001351 COc1ccc(Cl)cc1C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)NC3CCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D14 compound treatment 181.0 -1206.7 -1.0408 338.0 -496.72 -0.4024 -1.0205 -0.9145 3177531 BSPBio_001352 COc1cc2CCn3c(c/c(=N\c4c(C)cc(C)cc4C)/n(C)c3=O)-c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D15 compound treatment 44.0 -1343.7 -1.1589 49.0 -785.72 -0.6365 -1.2696 -0.9602 76 BSPBio_001353 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D16 compound treatment 323.0 -1064.7 -0.9183 1051.0 216.28 0.1752 -0.5254 -0.562 1907751 BSPBio_001354 CN/C(=N\c1ccc(cc1)C2=NNC(=O)CC2C)/NC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D17 compound treatment 1773.0 385.27 0.3323 1240.0 405.28 0.3283 0.4671 1.0 78 BSPBio_001355 C[C@]1(Cc2cc(OCC(=O)O)c(Cl)c(Cl)c2C1=O)C3CCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D18 compound treatment 884.0 -503.73 -0.4345 15.0 -819.72 -0.6641 -0.7768 -0.9788 1000092 BSPBio_001356 COc1ccc(cc1OC2CCCC2)C3CNC(=O)C3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D19 compound treatment 1713.0 325.27 0.2805 1278.0 443.28 0.3591 0.4523 0.9925 1719 BSPBio_001357 COc1ccc(cc1)[C@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@H]2OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D20 compound treatment 937.0 -450.73 -0.3887 944.0 109.28 0.0885 -0.2123 -0.5324 2270 BSPBio_001358 CCCCOc1cc(CC2CNC(=O)N2)ccc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D21 compound treatment 6.0 -1381.7 -1.1917 111.0 -723.72 -0.5863 -1.2572 -0.9466 362 BSPBio_001359 CCN(CC)CC(=O)Nc1c(C)cccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D22 compound treatment 1.0 -1386.7 -1.196 907.0 72.281 0.0586 -0.8043 -0.6717 1865 BSPBio_001360 Clc1cccc(Nc2nnc(c3ccccc3)c4ccccc24)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D23 mock treatment 1245.0 -142.73 -0.1231 871.0 36.281 0.0294 -0.0663 -0.5236 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 D24 mock treatment 937.0 -450.73 -0.3887 554.0 -280.72 -0.2274 -0.4357 -0.9674 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E01 mock treatment 2121.0 733.27 0.6324 1.0 -833.72 -0.6754 -0.0304 -0.0329 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E02 mock treatment 1731.0 343.27 0.2961 1179.0 344.28 0.2789 0.4066 0.9996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E03 compound treatment 1329.0 -58.734 -0.0507 147.0 -687.72 -0.5571 -0.4298 -0.7682 308 BSPBio_001361 CCCCC/C=C/C=C/1\[C@@H](C/C=C\CCCC(=O)O)C=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E04 compound treatment 1472.0 84.266 0.0727 1079.0 244.28 0.1979 0.1913 0.9075 94 BSPBio_001362 CCCCCC1OC1C/C=C\CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E05 compound treatment 2598.0 1210.3 1.0438 1841.0 1006.3 0.8152 1.3145 0.9925 147 BSPBio_001363 CCCCCC(=O)/C=C/C=C\C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E06 compound treatment 1743.0 355.27 0.3064 1235.0 400.28 0.3243 0.446 0.9996 1000018 BSPBio_001364 CCCCC/C=C\C[C@@H](O)/C=C/C=C/C=C\[C@@H](O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E07 compound treatment 2236.0 848.27 0.7316 1782.0 947.28 0.7674 1.06 0.9997 259 BSPBio_001365 CCCCC(C)(C)[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E08 compound treatment 288.0 -1099.7 -0.9485 1405.0 570.28 0.462 -0.344 -0.3261 3650153 BSPBio_001366 CCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)O)[C@@H](O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E09 compound treatment 1971.0 583.27 0.503 1247.0 412.28 0.334 0.5919 0.9802 272 BSPBio_001367 OC(=O)CCCCCCCCCCCCCCCC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E10 compound treatment 1524.0 136.27 0.1175 1390.0 555.28 0.4498 0.4012 0.8629 3650154 BSPBio_001368 CCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SC[C@H](N)C(=O)NCC(=O)O)[C@@H](O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E11 compound treatment 521.0 -866.73 -0.7475 469.0 -365.72 -0.2963 -0.7381 -0.9179 300 BSPBio_001369 O[C@@H](CCc1ccccc1)/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E12 compound treatment 584.0 -803.73 -0.6932 422.0 -412.72 -0.3343 -0.7266 -0.9441 3650155 BSPBio_001370 CCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SC[C@H](N)C(=O)O)[C@@H](O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E13 compound treatment 1586.0 198.27 0.171 1357.0 522.28 0.4231 0.4201 0.9205 109 BSPBio_001371 CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E14 compound treatment 1018.0 -369.73 -0.3189 1173.0 338.28 0.274 -0.0317 -0.0754 22 BSPBio_001372 CCCCC/C=C\C/C=C\CCCCCCCC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E15 compound treatment 1638.0 250.27 0.2158 1165.0 330.28 0.2676 0.3418 0.9943 179 BSPBio_001373 CCCCCCCCCCCCCCCCOC[C@H](CO)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E16 compound treatment 1712.0 324.27 0.2797 1158.0 323.28 0.2619 0.3829 0.9995 270 BSPBio_001374 CCCCC/C=C\C/C=C\CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E17 compound treatment 1746.0 358.27 0.309 1377.0 542.28 0.4393 0.5291 0.9852 81 BSPBio_001375 CCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E18 compound treatment 1218.0 -169.73 -0.1464 975.0 140.28 0.1136 -0.0232 -0.1249 229 BSPBio_001376 CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E19 compound treatment 1667.0 279.27 0.2409 877.0 42.281 0.0343 0.1945 0.7996 183 BSPBio_001377 CCCCCCCCCCCCCCCCOCC(CO)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E20 compound treatment 1116.0 -271.73 -0.2344 917.0 82.281 0.0667 -0.1186 -0.4867 186 BSPBio_001378 CCCCC[C@H](O)/C=C/C=C\C=C\C=C\[C@@H](O)[C@@H](O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E21 compound treatment 1247.0 -140.73 -0.1214 942.0 107.28 0.0869 -0.0244 -0.1633 181 BSPBio_001379 CCCCCCCCCCCCCCCCOCC(CO)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E22 compound treatment 954.0 -433.73 -0.3741 643.0 -191.72 -0.1553 -0.3743 -0.9242 113 BSPBio_001380 CCCCCCCCCCCCCCCC(=O)N[C@@H](COP(=O)(O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E23 mock treatment 1331.0 -56.734 -0.0489 1639.0 804.28 0.6516 0.4261 0.6522 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 E24 mock treatment 617.0 -770.73 -0.6647 318.0 -516.72 -0.4186 -0.766 -0.9751 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F01 mock treatment 2562.0 1174.3 1.0128 154.0 -680.72 -0.5515 0.3262 0.2829 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F02 mock treatment 1796.0 408.27 0.3521 1811.0 976.28 0.7909 0.8082 0.9336 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F03 compound treatment 422.0 -965.73 -0.8329 151.0 -683.72 -0.5539 -0.9806 -0.9804 80 BSPBio_001381 CN(C)C(=O)C(CCN1CCC(O)(CC1)c2ccc(Cl)cc2)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F04 compound treatment 657.0 -730.73 -0.6302 826.0 -8.7188 -0.0071 -0.4506 -0.715 327 BSPBio_001382 NCCNS(=O)(=O)c1cccc2c(Cl)cccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F05 compound treatment 2281.0 893.27 0.7704 1186.0 351.28 0.2846 0.746 0.9083 372 BSPBio_001383 COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2cc(OC)c(OC)c(OC)c2)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F06 compound treatment 702.0 -685.73 -0.5914 872.0 37.281 0.0302 -0.3968 -0.6701 47 BSPBio_001384 CC(=CCC/C(=C/CC/C(=C/CSC[C@H](NC(=O)C)C(=O)O)/C)/C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F07 compound treatment 1928.0 540.27 0.466 1405.0 570.28 0.462 0.6562 1.0 82 BSPBio_001385 Nc1cc(nc(N)[n+]1[O-])N2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F08 compound treatment 18.0 -1369.7 -1.1813 16.0 -818.72 -0.6633 -1.3043 -0.9627 3650156 BSPBio_001386 Cc1ccc(C(=O)C2CCCCO2)c3nc4c(C(=O)C5CCCCO5)c(N)c(=O)c(C)c4oc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F09 compound treatment 516.0 -871.73 -0.7518 286.0 -548.72 -0.4445 -0.846 -0.9686 84 BSPBio_001387 Nc1cc(nc(N)[n+]1OS(=O)(=O)O)N2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F10 compound treatment 20.0 -1367.7 -1.1796 13.0 -821.72 -0.6657 -1.3048 -0.9633 1907752 BSPBio_001388 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCc1ccc(O)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F11 compound treatment 325.0 -1062.7 -0.9166 285.0 -549.72 -0.4453 -0.963 -0.945 86 BSPBio_001389 COC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCN(C)Cc3ccccc3)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F12 compound treatment 18.0 -1369.7 -1.1813 16.0 -818.72 -0.6633 -1.3043 -0.9627 331 BSPBio_001390 COc1cc2ncnc(Nc3cccc(Cl)c3)c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F13 compound treatment 424.0 -963.73 -0.8312 210.0 -624.72 -0.5061 -0.9456 -0.9717 110 BSPBio_001391 COC(=O)C1=C(C)NC(=C(C1c2ccccc2[N+](=O)[O-])C(=O)OC)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F14 compound treatment 253.0 -1134.7 -0.9787 182.0 -652.72 -0.5288 -1.0659 -0.9582 333 BSPBio_001392 NC(=S)/C(=C/c1ccc(O)c(O)c1)/C#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F15 compound treatment 1377.0 -10.734 -0.0093 1357.0 522.28 0.4231 0.2926 0.6915 112 BSPBio_001393 OC(=O)c1cccnc1Nc2cccc(c2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F16 compound treatment 1037.0 -350.73 -0.3025 431.0 -403.72 -0.3271 -0.4452 -0.9992 203 BSPBio_001394 NC(=C(C#N)C#N)/C(=C/c1ccc2[nH]ccc2c1)/C#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F17 compound treatment 2205.0 817.27 0.7049 1997.0 1162.3 0.9416 1.1642 0.9898 907431 BSPBio_001395 COC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OCCCN3CCC(CC3)(c4ccccc4)c5ccccc5)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F18 compound treatment 154.0 -1233.7 -1.064 256.0 -578.72 -0.4688 -1.0839 -0.9322 3 BSPBio_001396 Oc1ccc(/C=C(\C#N)/C(=O)NCc2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F19 compound treatment 47.0 -1340.7 -1.1563 25.0 -809.72 -0.656 -1.2815 -0.9639 115 BSPBio_001397 COCCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC(C)C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F20 compound treatment 7.0 -1380.7 -1.1908 10.0 -824.72 -0.6681 -1.3145 -0.9627 208 BSPBio_001398 CC(C)(C)c1cc(/C=C(\C#N)/C(=S)N)cc(c1O)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F21 compound treatment 6.0 -1381.7 -1.1917 46.0 -788.72 -0.639 -1.2945 -0.9573 117 BSPBio_001399 CCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F22 compound treatment 0.0 -1387.7 -1.1969 0.0 -834.72 -0.6762 -1.3245 -0.9635 BSPBio_001400 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F23 mock treatment 1652.0 264.27 0.2279 1793.0 958.28 0.7763 0.7101 0.8777 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 F24 mock treatment 1059.0 -328.73 -0.2835 3.0 -831.72 -0.6738 -0.6769 -0.926 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G01 mock treatment 2182.0 794.27 0.685 3.0 -831.72 -0.6738 0.0079 0.0083 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G02 mock treatment 1535.0 147.27 0.127 2.0 -832.72 -0.6746 -0.3872 -0.5641 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G03 compound treatment 2379.0 991.27 0.8549 8.0 -826.72 -0.6697 0.1309 0.1206 83 BSPBio_001401 CCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G04 compound treatment 1455.0 67.266 0.058 5.0 -829.72 -0.6722 -0.4343 -0.6437 191 BSPBio_001402 CCCc1c(O)c(ccc1OCCCCc2nnn[nH]2)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G05 compound treatment 2241.0 853.27 0.7359 360.0 -474.72 -0.3846 0.2484 0.2992 173 BSPBio_001403 CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G06 compound treatment 1827.0 439.27 0.3788 3.0 -831.72 -0.6738 -0.2086 -0.2698 42 BSPBio_001404 CCCCCCCCCCCCCCCCOC[C@@H](O)COP(=O)(O)OCC[N+](C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G07 compound treatment 1566.0 178.27 0.1537 10.0 -824.72 -0.6681 -0.3637 -0.5305 177 BSPBio_001405 CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G08 compound treatment 1482.0 94.266 0.0813 9.0 -825.72 -0.6689 -0.4155 -0.6166 111 BSPBio_001406 CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G09 compound treatment 2406.0 1018.3 0.8782 54.0 -780.72 -0.6325 0.1738 0.1606 175 BSPBio_001407 CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G10 compound treatment 1426.0 38.266 0.033 10.0 -824.72 -0.6681 -0.4491 -0.6714 36 BSPBio_001408 CCCCCCCCCCCCCC(=O)N[C@H](C)[C@@H](O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G11 compound treatment 1537.0 149.27 0.1287 45.0 -789.72 -0.6398 -0.3614 -0.5537 102 BSPBio_001409 C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)CCC3=C)/CCC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G12 compound treatment 1395.0 7.2656 0.0063 12.0 -822.72 -0.6665 -0.4669 -0.7004 1000002 BSPBio_001410 CCCCCCCCCCCCCC(=O)N[C@@H](C)[C@H](O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G13 compound treatment 1904.0 516.27 0.4453 80.0 -754.72 -0.6114 -0.1175 -0.1553 98 BSPBio_001411 C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@@H](O)CCC3=C)/CCC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G14 compound treatment 1266.0 -121.73 -0.105 18.0 -816.72 -0.6616 -0.5421 -0.8092 227 BSPBio_001412 CCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G15 compound treatment 596.0 -791.73 -0.6828 43.0 -791.72 -0.6414 -0.9364 -0.9995 118 BSPBio_001413 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC(CO)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G16 compound treatment 1227.0 -160.73 -0.1386 79.0 -755.72 -0.6122 -0.5309 -0.8458 8 BSPBio_001414 CCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)NCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G17 compound treatment 1682.0 294.27 0.2538 222.0 -612.72 -0.4964 -0.1715 -0.3077 276 BSPBio_001415 CCCCCCCCCCCCCCC(F)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G18 compound treatment 1015.0 -372.73 -0.3215 3.0 -831.72 -0.6738 -0.7038 -0.9427 136 BSPBio_001416 COC(C)(C)CCCC(C)C/C=C/C(=C/C(=O)O)/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G19 compound treatment 686.0 -701.73 -0.6052 12.0 -822.72 -0.6665 -0.8992 -0.9988 274 BSPBio_001417 CCCCCCCCCCCCC(O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G20 compound treatment 942.0 -445.73 -0.3844 83.0 -751.72 -0.609 -0.7024 -0.9754 310 BSPBio_001418 CCCCC(C)(O)C/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G21 compound treatment 1034.0 -353.73 -0.3051 36.0 -798.72 -0.6471 -0.6733 -0.9411 130 BSPBio_001419 C/C(=C\C=C\C(=C\C(=O)Nc1ccc(O)cc1)\C)/C=C/C2=C(C)CCCC2(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G22 compound treatment 103.0 -1284.7 -1.108 406.0 -428.72 -0.3473 -1.0291 -0.8862 309 BSPBio_001420 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G23 mock treatment 1035.0 -352.73 -0.3042 100.0 -734.72 -0.5952 -0.636 -0.9514 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 G24 mock treatment 852.0 -535.73 -0.462 17.0 -817.72 -0.6624 -0.7951 -0.9845 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H01 mock treatment 2013.0 625.27 0.5393 124.0 -710.72 -0.5758 -0.0258 -0.0327 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H02 mock treatment 1306.0 -81.734 -0.0705 1167.0 332.28 0.2692 0.1405 0.5049 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H03 compound treatment 0.0 -1387.7 -1.1969 1.0 -833.72 -0.6754 -1.3239 -0.9633 119 BSPBio_001421 OC(=O)c1ccccc1Nc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H04 compound treatment 1374.0 -13.734 -0.0118 931.0 96.281 0.078 0.0468 0.5929 556 BSPBio_001422 COc1cc2ncc(nc2cc1OC)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H05 compound treatment 70.0 -1317.7 -1.1365 19.0 -815.72 -0.6608 -1.2709 -0.9667 121 BSPBio_001423 OC(=O)c1cc(ccc1NCCCc2ccccc2)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H06 compound treatment 1558.0 170.27 0.1468 1467.0 632.28 0.5122 0.466 0.8746 3001878 BSPBio_001424 Cc1[nH]c(=O)c([N+]#[C-])cc1c2ccncc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H07 compound treatment 0.0 -1387.7 -1.1969 0.0 -834.72 -0.6762 -1.3245 -0.9635 2450 BSPBio_001425 Oc1ccc(cc1n2c(=O)[nH]c3cc(ccc23)C(F)(F)F)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H08 compound treatment 1.0 -1386.7 -1.196 1.0 -833.72 -0.6754 -1.3233 -0.9634 2080829 BSPBio_001426 OCC1(CO)N2CCC(CC2)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H09 compound treatment 2147.0 759.27 0.6548 1789.0 954.28 0.7731 1.0097 0.9966 124 BSPBio_001427 CC(C)(O)[C@H]1O[C@H]2CC[C@]3(C)[C@]4(C)[C@H](Cc5c4[nH]c6ccccc56)CC[C@@]3(O)C2=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H10 compound treatment 21.0 -1366.7 -1.1788 2.0 -832.72 -0.6746 -1.3105 -0.9649 1907753 BSPBio_001428 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H11 compound treatment 1911.0 523.27 0.4513 1729.0 894.28 0.7245 0.8314 0.9741 126 BSPBio_001429 CC1(C)Oc2ccc(C#N)cc2[C@@H](OC3=CC(=O)CC3)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H12 compound treatment 2672.0 1284.3 1.1076 1865.0 1030.3 0.8346 1.3734 0.9903 354 BSPBio_001430 Nc1ccc2C(=O)NC(=O)c3cccc1c32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H13 compound treatment 1204.0 -183.73 -0.1585 569.0 -265.72 -0.2153 -0.2643 -0.9886 128 BSPBio_001431 CC(=C)[C@H]1O[C@H]2CC[C@]3(C)[C@]4(C)[C@@H](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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H14 compound treatment 1584.0 196.27 0.1693 1372.0 537.28 0.4353 0.4275 0.9153 445 BSPBio_001432 NC(=O)c1cccc(N)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H15 compound treatment 845.0 -542.73 -0.4681 729.0 -105.72 -0.0856 -0.3915 -0.8228 2474 BSPBio_001433 Nc1nc(N)c(nc1Cl)C(=O)NC(=N)Nc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H16 compound treatment 12.0 -1375.7 -1.1865 3.0 -831.72 -0.6738 -1.3154 -0.9641 1907754 BSPBio_001434 CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H17 compound treatment 3.0 -1384.7 -1.1943 57.0 -777.72 -0.63 -1.29 -0.9554 3046406 BSPBio_001435 Cc1ccc(cc1)N(CC2=NCCN2)c3cccc(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H18 compound treatment 4.0 -1383.7 -1.1934 3.0 -831.72 -0.6738 -1.3203 -0.9634 336 BSPBio_001436 COc1ccc(C[C@H]2NC[C@H](O)[C@H]2OC(=O)C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H19 compound treatment 1782.0 394.27 0.34 1187.0 352.28 0.2854 0.4422 0.9962 1126 BSPBio_001437 O=C1NC(=O)C(N1)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H20 compound treatment 13.0 -1374.7 -1.1857 1.0 -833.72 -0.6754 -1.316 -0.9644 154 BSPBio_001438 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H21 compound treatment 890.0 -497.73 -0.4293 494.0 -340.72 -0.276 -0.4987 -0.9772 2117626 BSPBio_001439 Fc1ccc(cc1)C(CCCN2CCC(CC2)n3c(=O)[nH]c4ccccc34)c5ccc(F)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H22 compound treatment 649.0 -738.73 -0.6371 460.0 -374.72 -0.3036 -0.6652 -0.9425 401 BSPBio_001440 COc1cccc2c1cc([N+](=O)[O-])c3c(cc4OCOc4c23)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H23 mock treatment 1008.0 -379.73 -0.3275 954.0 119.28 0.0966 -0.1633 -0.4781 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 H24 mock treatment 818.0 -569.73 -0.4914 663.0 -171.72 -0.1391 -0.4458 -0.873 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I01 mock treatment 826.0 -561.73 -0.4845 1478.0 643.28 0.5211 0.0259 0.0364 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I02 mock treatment 1580.0 192.27 0.1658 1789.0 954.28 0.7731 0.6639 0.8397 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I03 compound treatment 1400.0 12.266 0.0106 1980.0 1145.3 0.9278 0.6635 0.7151 299 BSPBio_001441 CCCCCCCCCCOCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I04 compound treatment 1773.0 385.27 0.3323 1172.0 337.28 0.2732 0.4282 0.9953 184 BSPBio_001442 CCCCC/C=C\C/C=C\C=C\C=C\[C@@H](SCC(NC(=O)C)C(=O)O)[C@@H](O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I05 compound treatment 1731.0 343.27 0.2961 1611.0 776.28 0.6289 0.654 0.9409 13 BSPBio_001443 CCCCC/C=C\C/C=C\C/C=C\C=C\[C@@H](O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I06 compound treatment 1671.0 283.27 0.2443 2170.0 1335.3 1.0817 0.9376 0.8455 14 BSPBio_001444 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I07 compound treatment 14.0 -1373.7 -1.1848 331.0 -503.72 -0.4081 -1.1263 -0.8988 64 BSPBio_001445 CCCCC/C=C\C/C=C\C/C=C\C=C\[C@H](CCCC(=O)O)OO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I08 compound treatment 13.0 -1374.7 -1.1857 20.0 -814.72 -0.66 -1.3051 -0.9618 123 BSPBio_001446 CCCCC/C=C\C/C=C\CCCCCCCC(=O)NCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I09 compound treatment 2198.0 810.27 0.6988 1734.0 899.28 0.7285 1.0093 0.9998 137 BSPBio_001447 CCCCC/C=C\C/C=C\C/C=C\CC1OC1CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I10 compound treatment 1187.0 -200.73 -0.1731 1565.0 730.28 0.5916 0.2959 0.4801 40 BSPBio_001448 CCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I11 compound treatment 2199.0 811.27 0.6997 1694.0 859.28 0.6961 0.987 1.0 146 BSPBio_001449 CCCCCC#CCC#CCC#CCC#CCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I12 compound treatment 1830.0 442.27 0.3814 1464.0 629.28 0.5098 0.6302 0.9898 66 BSPBio_001450 CCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I13 compound treatment 887.0 -500.73 -0.4319 833.0 -1.7188 -0.0014 -0.3064 -0.7094 144 BSPBio_001451 CCCCCCCCC#CCC#CCC#CCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I14 compound treatment 648.0 -739.73 -0.638 530.0 -304.72 -0.2469 -0.6257 -0.9146 69 BSPBio_001452 CCCCCCCC/C=C\CCCCCCCCOC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I15 compound treatment 2045.0 657.27 0.5669 1482.0 647.28 0.5244 0.7716 0.9992 145 BSPBio_001453 CCCCC/C=C\C/C=C\C/C=C\C=C\C(=O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I16 compound treatment 1294.0 -93.734 -0.0808 1042.0 207.28 0.1679 0.0616 0.3304 318 BSPBio_001454 CCCCCCCCCCCCCCCC(=O)NCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I17 compound treatment 2413.0 1025.3 0.8842 2068.0 1233.3 0.9991 1.3317 0.9981 120 BSPBio_001455 O=Cc1c2[nH]c3ccccc3c2cc4[nH]c5ccccc5c14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I18 compound treatment 1558.0 170.27 0.1468 1008.0 173.28 0.1404 0.2031 0.9997 114 BSPBio_001456 CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I19 compound treatment 2078.0 690.27 0.5953 1652.0 817.28 0.6621 0.8891 0.9986 257 BSPBio_001457 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1CC(=O)CCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I20 compound treatment 1087.0 -300.73 -0.2594 772.0 -62.719 -0.0508 -0.2193 -0.8299 190 BSPBio_001458 CCCCC[C@H](O)/C=C/[C@H]1C=CC(=O)[C@@H]1CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I21 compound treatment 1373.0 -14.734 -0.0127 1236.0 401.28 0.3251 0.2209 0.6789 258 BSPBio_001459 CCCCCCCCCCC/C=C\C(C)(C)/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I22 compound treatment 964.0 -423.73 -0.3655 647.0 -187.72 -0.1521 -0.3659 -0.9245 212 BSPBio_001460 CCCCC[C@H](O)/C=C/[C@H]1C=CC(=O)[C@@H]1C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I23 mock treatment 1056.0 -331.73 -0.2861 1049.0 214.28 0.1736 -0.0796 -0.2377 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 I24 mock treatment 642.0 -745.73 -0.6432 1216.0 381.28 0.3089 -0.2364 -0.3313 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J01 mock treatment 1290.0 -97.734 -0.0843 1116.0 281.28 0.2279 0.1015 0.4179 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J02 mock treatment 1261.0 -126.73 -0.1093 1119.0 284.28 0.2303 0.0856 0.3356 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J03 compound treatment 0.0 -1387.7 -1.1969 0.0 -834.72 -0.6762 -1.3245 -0.9635 3104408 BSPBio_001461 CC(N/C(=N\C#N)/Nc1ccncc1)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J04 compound treatment 950.0 -437.73 -0.3775 693.0 -141.72 -0.1148 -0.3481 -0.8822 1907755 BSPBio_001462 COCc1nc2n(CC(C)C)c(=O)n(C)c(=O)c2[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J05 compound treatment 1194.0 -193.73 -0.1671 851.0 16.281 0.0132 -0.1088 -0.6493 2431 BSPBio_001463 CCN(CC)CCNC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J06 compound treatment 4.0 -1383.7 -1.1934 75.0 -759.72 -0.6155 -1.2791 -0.9526 1907756 BSPBio_001464 Clc1ccc2ncnc(NCc3ccc4OCOc4c3)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J07 compound treatment 277.0 -1110.7 -0.958 435.0 -399.72 -0.3238 -0.9064 -0.8963 1489 BSPBio_001465 CCCNCC(O)COc1ccccc1C(=O)CCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J08 compound treatment 676.0 -711.73 -0.6138 657.0 -177.72 -0.144 -0.5359 -0.8499 155 BSPBio_001466 CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC[C@@H](NC[C@@H](N)CS)C(C)C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J09 compound treatment 5.0 -1382.7 -1.1926 1.0 -833.72 -0.6754 -1.3208 -0.9637 3177396 BSPBio_001467 COc1ccc2nccc([C@H](O)[C@H]3CC4CCN3C[C@@H]4C=C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J10 compound treatment 1.0 -1386.7 -1.196 0.0 -834.72 -0.6762 -1.3239 -0.9636 361 BSPBio_001468 CC(C)(c1ccc(OCC2CO2)cc1)c3ccc(OCC4CO4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J11 compound treatment 2.0 -1385.7 -1.1951 7.0 -827.72 -0.6705 -1.3192 -0.9627 3650157 BSPBio_001469 COc1ccc2nccc([C@H](O)[C@@H]3CC4CCN3CC4C=C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J12 compound treatment 2.0 -1385.7 -1.1951 1.0 -833.72 -0.6754 -1.3227 -0.9635 3554511 BSPBio_001470 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@@]2(O)C[C@@H](O)[C@H](C)[C@H](O2)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J13 compound treatment 2387.0 999.27 0.8618 1791.0 956.28 0.7747 1.1572 0.9986 907369 BSPBio_001471 CC[N+](CC)(CC)CC(=O)Nc1c(C)cccc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J14 compound treatment 858.0 -529.73 -0.4569 644.0 -190.72 -0.1545 -0.4323 -0.8964 365 BSPBio_001472 CC(=O)OCOC(=O)CN(CC(=O)OCOC(=O)C)c1ccccc1OCCOc2ccccc2N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J15 compound treatment 745.0 -642.73 -0.5543 562.0 -272.72 -0.2209 -0.5482 -0.9187 3103964 BSPBio_001473 CC(C)[C@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@]3(O)[C@]4(O)[C@]1(C)[C@]5(O)C[C@@]3(C)[C@@]6(O)CC[C@H](C)[C@@H](O)[C@]46O5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J16 compound treatment 300.0 -1087.7 -0.9381 127.0 -707.72 -0.5733 -1.0688 -0.9721 3103618 BSPBio_001474 Cc1ccc2N=C3N(CCC3(O)C(=O)c2c1)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J17 compound treatment 870.0 -517.73 -0.4465 791.0 -43.719 -0.0354 -0.3408 -0.7608 165 BSPBio_001475 OC(COc1cccc2[nH]c(C#N)cc12)CN3CCN(CC3)C(c4ccccc4)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J18 compound treatment 1585.0 197.27 0.1701 1139.0 304.28 0.2465 0.2946 0.9836 3650158 BSPBio_001476 COC(C/C=C/C=C/CC\C=C/CC(C)\C=C/C(=C\C(=O)O)/CC(=O)O)/C(=C\C=C(/C)\C(=O)O)/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J19 compound treatment 1877.0 489.27 0.422 1381.0 546.28 0.4425 0.6113 0.9997 390 BSPBio_001477 COc1ccc(CCCOC(Cn2ccnc2)c3ccc(OC)cc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J20 compound treatment 1177.0 -210.73 -0.1817 230.0 -604.72 -0.4899 -0.4749 -0.9089 3348 BSPBio_001478 CNC(=O)[C@H]1O[C@H](C(O)[C@H]1O)n2cnc3c(NCc4cccc(I)c4)ncnc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J21 compound treatment 1713.0 325.27 0.2805 1315.0 480.28 0.3891 0.4735 0.9871 193 BSPBio_001479 COc1cc2CCN(C)[C@H]3Cc4ccc(OC)c(Oc5ccc(C[C@@H]6N(C)CCc7cc(OC)c(Oc(c1OC)c32)cc67)cc5)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J22 compound treatment 0.0 -1387.7 -1.1969 3.0 -831.72 -0.6738 -1.3227 -0.9631 3104702 BSPBio_001480 C[C@H]1CCC/C=C/C2C[C@H](O)C[C@H]2[C@H](O)/C=C/C(=O)O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J23 mock treatment 1403.0 15.266 0.0132 1377.0 542.28 0.4393 0.3199 0.728 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 J24 mock treatment 1280.0 -107.73 -0.0929 709.0 -125.72 -0.1018 -0.1377 -0.999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K01 mock treatment 2083.0 695.27 0.5996 212.0 -622.72 -0.5045 0.0673 0.0859 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K02 mock treatment 1093.0 -294.73 -0.2542 739.0 -95.719 -0.0775 -0.2346 -0.8827 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K03 compound treatment 2005.0 617.27 0.5324 1157.0 322.28 0.2611 0.5611 0.9462 139 BSPBio_001481 CCCCC/C=C\C/C=C\CC1OC1C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K04 compound treatment 1007.0 -380.73 -0.3284 1085.0 250.28 0.2028 -0.0888 -0.2302 214 BSPBio_001482 CCCCC[C@H](O)/C=C/C1=C(CCCCCCC(=O)O)C(=O)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K05 compound treatment 1450.0 62.266 0.0537 1129.0 294.28 0.2384 0.2065 0.8452 1000033 BSPBio_001483 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@H]1C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K06 compound treatment 1396.0 8.2656 0.0071 1597.0 762.28 0.6175 0.4417 0.7152 216 BSPBio_001484 CCCCC[C@H](O)/C=C/C1=C(C/C=C\CCCC(=O)O)C(=O)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K07 compound treatment 1756.0 368.27 0.3176 1350.0 515.28 0.4174 0.5198 0.9909 3650159 BSPBio_001485 CCCCC/C=C\C=C\[C@H](O)CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K08 compound treatment 1669.0 281.27 0.2426 1219.0 384.28 0.3113 0.3917 0.9924 218 BSPBio_001486 CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K09 compound treatment 4.0 -1383.7 -1.1934 7.0 -827.72 -0.6705 -1.318 -0.9628 88 BSPBio_001487 CCCCC/C=C\C=C\[C@H](CCCCCCCC(=O)O)OO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K10 compound treatment 31.0 -1356.7 -1.1701 42.0 -792.72 -0.6422 -1.2815 -0.9601 220 BSPBio_001488 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K11 compound treatment 1488.0 100.27 0.0865 1433.0 598.28 0.4847 0.4039 0.8203 45 BSPBio_001489 CCCCCCCC/C=C\CCCCCCCC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K12 compound treatment 1564.0 176.27 0.152 1134.0 299.28 0.2425 0.2789 0.9747 222 BSPBio_001490 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K13 compound treatment 159.0 -1228.7 -1.0597 257.0 -577.72 -0.468 -1.0803 -0.9325 1000028 BSPBio_001491 CCCCC[C@H](O)/C=C/[C@H]1[C@@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K14 compound treatment 633.0 -754.73 -0.6509 969.0 134.28 0.1088 -0.3834 -0.5809 226 BSPBio_001492 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K15 compound treatment 2699.0 1311.3 1.1309 1112.0 277.28 0.2246 0.9585 0.8313 1000027 BSPBio_001493 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@@H](O)[C@@H]1C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K16 compound treatment 1488.0 100.27 0.0865 793.0 -41.719 -0.0338 0.0372 0.4012 224 BSPBio_001494 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K17 compound treatment 200.0 -1187.7 -1.0244 861.0 26.281 0.0213 -0.7093 -0.6923 1000008 BSPBio_001495 C/C(=C/C=C/C(=C/C(=O)O)/C)/C=C/C1=C(C)CCCC1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K18 compound treatment 1463.0 75.266 0.0649 956.0 121.28 0.0983 0.1154 0.9798 3184 BSPBio_001496 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K19 compound treatment 1667.0 279.27 0.2409 1064.0 229.28 0.1857 0.3017 0.9918 3614749 BSPBio_001497 COC(=O)CNC(=O)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K20 compound treatment 965.0 -422.73 -0.3646 522.0 -312.72 -0.2533 -0.4369 -0.9842 267 BSPBio_001498 CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)C=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K21 compound treatment 582.0 -805.73 -0.6949 227.0 -607.72 -0.4923 -0.8395 -0.9858 266 BSPBio_001499 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K22 compound treatment 583.0 -804.73 -0.6941 484.0 -350.72 -0.2841 -0.6917 -0.9223 104 BSPBio_001500 C/C(=C\C=C\C(=C\C(=O)O)\C)/C=C/C1=C(C)CCCC1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K23 mock treatment 970.0 -417.73 -0.3603 925.0 90.281 0.0731 -0.203 -0.5523 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 K24 mock treatment 975.0 -412.73 -0.356 426.0 -408.72 -0.3311 -0.4858 -0.9993 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L01 mock treatment 1785.0 397.27 0.3426 27.0 -807.72 -0.6543 -0.2204 -0.2984 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L02 mock treatment 1905.0 517.27 0.4461 38.0 -796.72 -0.6454 -0.1409 -0.1796 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L03 compound treatment 442.0 -945.73 -0.8157 4.0 -830.72 -0.673 -1.0526 -0.9954 194 BSPBio_001501 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)CCC)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L04 compound treatment 696.0 -691.73 -0.5966 12.0 -822.72 -0.6665 -0.8931 -0.9985 407 BSPBio_001502 [O-][N+](=O)c1cccc2c(Br)n[nH]c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L05 compound treatment 420.0 -967.73 -0.8346 17.0 -817.72 -0.6624 -1.0586 -0.9935 907521 BSPBio_001503 CCN(CC)CCCCCCCCOC(=O)c1cc(OC)c(OC)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L06 compound treatment 408.0 -979.73 -0.845 139.0 -695.72 -0.5636 -0.996 -0.9806 3103965 BSPBio_001504 Nc1ncnc2n(C3O[C@H]4COP(=O)(O)O[C@@H]4[C@@H]3O)c(Br)nc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L07 compound treatment 1.0 -1386.7 -1.196 0.0 -834.72 -0.6762 -1.3239 -0.9636 196 BSPBio_001505 Cc1ccc(cc1)S(=O)(=O)NC(=O)NN2CCCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L08 compound treatment 840.0 -547.73 -0.4724 37.0 -797.72 -0.6462 -0.791 -0.9881 3103966 BSPBio_001506 NC1=NC2C(N=C(Br)N2C3O[C@H]4COP(=O)(O)O[C@@H]4[C@@H]3O)C(=O)N1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L09 compound treatment 2026.0 638.27 0.5505 564.0 -270.72 -0.2193 0.2342 0.3952 198 BSPBio_001507 CCCCNC(=O)NS(=O)(=O)c1ccc(C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L10 compound treatment 43.0 -1344.7 -1.1598 364.0 -470.72 -0.3813 -1.0897 -0.8926 404 BSPBio_001508 CCCCNc1cc(cc(c1Oc2ccccc2)S(=O)(=O)N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L11 compound treatment 6.0 -1381.7 -1.1917 4.0 -830.72 -0.673 -1.3185 -0.9634 3103746 BSPBio_001509 C1CCC(CC1)/N=C(\NC2C3CC4CC(C3)CC2C4)/N5CCOCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L12 compound treatment 1222.0 -165.73 -0.1429 148.0 -686.72 -0.5563 -0.4945 -0.8608 1001848 BSPBio_001510 CCNC(=O)[C@H]1O[C@H](C(O)[C@H]1O)n2cnc3c(N)ncnc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L13 compound treatment 10.0 -1377.7 -1.1882 42.0 -792.72 -0.6422 -1.2943 -0.9583 396 BSPBio_001511 CN([C@H]1CCCC[C@@H]1N2CCCC2)C(=O)Cc3ccc(Cl)c(Cl)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L14 compound treatment 110.0 -1277.7 -1.102 7.0 -827.72 -0.6705 -1.2534 -0.9716 373 BSPBio_001512 CC(/C=C/c1cccc(Oc2ccc(F)cc2)c1)N(O)C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L15 compound treatment 2057.0 669.27 0.5772 325.0 -509.72 -0.4129 0.1162 0.1637 1000056 BSPBio_001513 COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L16 compound treatment 126.0 -1261.7 -1.0882 3.0 -831.72 -0.6738 -1.2459 -0.9734 3650160 BSPBio_001514 CCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@@H](C(C)CC)C(=O)N2CCC[C@H]2C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L17 compound treatment 1834.0 446.27 0.3849 100.0 -734.72 -0.5952 -0.1487 -0.2098 2117248 BSPBio_001515 COc1ccc(cc1OC)C(=O)O[C@H]2CC[C@@]3(C)[C@@H]4CC[C@@H]5[C@@]3(C[C@@]6(O)[C@@H]7CN8C[C@@H](C)CC[C@H]8[C@@](C)(O)[C@@]7(O)[C@@H](O)C[C@@]56O)O[C@@]42O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L18 compound treatment 679.0 -708.73 -0.6113 32.0 -802.72 -0.6503 -0.892 -0.9995 1907757 BSPBio_001516 Oc1ccc(NC2=C(C(=O)NC2=O)c3ccccc3[N+](=O)[O-])cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L19 compound treatment 564.0 -823.73 -0.7104 50.0 -784.72 -0.6357 -0.9519 -0.9985 202 BSPBio_001517 COc1ccc(CCN(C)CCc2ccc(OC)c(OC)c2)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L20 compound treatment 34.0 -1353.7 -1.1675 2.0 -832.72 -0.6746 -1.3026 -0.966 3103968 BSPBio_001518 CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L21 compound treatment 0.0 -1387.7 -1.1969 622.0 -212.72 -0.1723 -0.9682 -0.8007 3650161 BSPBio_001519 CC(O)(C(=O)Nc1ccc(cc1)S(=O)(=O)c2ccccc2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L22 compound treatment 5.0 -1382.7 -1.1926 6.0 -828.72 -0.6714 -1.318 -0.9631 3650162 BSPBio_001520 COc1cc(O)c2c(=O)c(OC)c(C[C@@H](C)OC(=O)Oc3ccc(O)cc3)c4c5c(C[C@@H](C)OC(=O)c6ccccc6)c(OC)c(=O)c7c(O)cc(OC)c(c1c24)c75 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L23 mock treatment 1250.0 -137.73 -0.1188 398.0 -436.72 -0.3538 -0.3342 -0.8954 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 L24 mock treatment 803.0 -584.73 -0.5043 237.0 -597.72 -0.4842 -0.699 -0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M01 mock treatment 2350.0 962.27 0.8299 1435.0 600.28 0.4863 0.9307 0.9676 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M02 mock treatment 1973.0 585.27 0.5048 1322.0 487.28 0.3948 0.6361 0.9926 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M03 compound treatment 791.0 -596.73 -0.5147 405.0 -429.72 -0.3481 -0.6101 -0.9819 53 BSPBio_001521 CC(=CCC/C(=C/CSC[C@H](NC(=O)C)C(=O)O)/C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M04 compound treatment 1382.0 -5.7344 -0.0049 1645.0 810.28 0.6564 0.4607 0.7018 189 BSPBio_001522 CCCCCC(O)c1cccc(OCc2ccc3ccccc3n2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M05 compound treatment 2010.0 622.27 0.5367 832.0 -2.7188 -0.0022 0.3779 0.7042 51 BSPBio_001523 CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CSC[C@H](NC(=O)C)C(=O)O)/C)/C)/C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M06 compound treatment 1752.0 364.27 0.3142 1489.0 654.28 0.53 0.5969 0.9688 49 BSPBio_001524 COC(=O)[C@@H](N)CSC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M07 compound treatment 2.0 -1385.7 -1.1951 6.0 -828.72 -0.6714 -1.3198 -0.9628 116 BSPBio_001525 Cc1c(nn(c1c2ccc(I)cc2)c3ccc(Cl)cc3Cl)C(=O)NN4CCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M08 compound treatment 0.0 -1387.7 -1.1969 4.0 -830.72 -0.673 -1.3222 -0.9629 1000032 BSPBio_001526 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M09 compound treatment 261.0 -1126.7 -0.9718 176.0 -658.72 -0.5336 -1.0645 -0.9602 132 BSPBio_001527 CC1(C)CCC(C)(C)c2cc(ccc21)C(=O)Nc3ccc(cc3)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M10 compound treatment 262.0 -1125.7 -0.9709 278.0 -556.72 -0.451 -1.0054 -0.9392 3103969 BSPBio_001528 OC(=O)CCC/C=C\CC1C(CNNC(=O)Nc2ccccc2)C3CCC1O3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M11 compound treatment 1318.0 -69.734 -0.0601 1809.0 974.28 0.7893 0.5156 0.6513 2 BSPBio_001529 CCCCC/C=C\C/C=C\CCCCCCCC(=O)NCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M12 compound treatment 2273.0 885.27 0.7635 1684.0 849.28 0.688 1.0264 0.9987 3001885 BSPBio_001530 CCCCCc1cc(O)c2C3C=C(CC[C@H]3C(C)(C)Oc2c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M13 compound treatment 1621.0 233.27 0.2012 1834.0 999.28 0.8095 0.7147 0.8568 4 BSPBio_001531 CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)NCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M14 compound treatment 976.0 -411.73 -0.3551 998.0 163.28 0.1323 -0.1576 -0.4158 134 BSPBio_001532 C/C(=C\c1ccc(cc1)C(=O)O)/c2ccc3c(c2)C(C)(C)CCC3(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M15 compound treatment 1980.0 592.27 0.5108 1516.0 681.28 0.5519 0.7515 0.9993 316 BSPBio_001533 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M16 compound treatment 1918.0 530.27 0.4573 1571.0 736.28 0.5965 0.7452 0.9914 261 BSPBio_001534 CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@H]2CO[C@@H]1C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M17 compound treatment 1367.0 -20.734 -0.0179 1072.0 237.28 0.1922 0.1233 0.6386 6 BSPBio_001535 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)NCCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M18 compound treatment 1619.0 231.27 0.1995 753.0 -81.719 -0.0662 0.0942 0.4484 3103970 BSPBio_001536 CCCCC/C=C\CC(O)/C=C/c1cccc(CC(O)CCCCO)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M19 compound treatment 1241.0 -146.73 -0.1266 1184.0 349.28 0.283 0.1106 0.3568 20 BSPBio_001537 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M20 compound treatment 795.0 -592.73 -0.5112 579.0 -255.72 -0.2072 -0.508 -0.9209 3177605 BSPBio_001538 Cc1c(C(=O)c2cccc3ccccc23)c4cccc5OC[C@@H](CN6CCOCC6)n1c54 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M21 compound treatment 1286.0 -101.73 -0.0877 899.0 64.281 0.0521 -0.0252 -0.2472 225 BSPBio_001539 CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M22 compound treatment 1518.0 130.27 0.1123 832.0 -2.7188 -0.0022 0.0779 0.6931 138 BSPBio_001540 Cc1cccc(Nc2cc(Cl)nc(SCC(=O)O)n2)c1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M23 mock treatment 1135.0 -252.73 -0.218 1168.0 333.28 0.27 0.0368 0.106 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 M24 mock treatment 1039.0 -348.73 -0.3008 721.0 -113.72 -0.0921 -0.2778 -0.8832 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N01 mock treatment 2821.0 1433.3 1.2361 54.0 -780.72 -0.6325 0.4269 0.3074 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N02 mock treatment 1724.0 336.27 0.29 808.0 -26.719 -0.0216 0.1898 0.6525 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N03 compound treatment 1821.0 433.27 0.3737 925.0 90.281 0.0731 0.3159 0.8298 1002014 BSPBio_001541 Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)CCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N04 compound treatment 0.0 -1387.7 -1.1969 0.0 -834.72 -0.6762 -1.3245 -0.9635 3103971 BSPBio_001542 COC[C@H]([C@@H](O)[C@@H](O)C(=O)NCC[C@@H](C)c1nc(/C=C/C[C@H]2OC3(C[C@H](O)[C@H]2C)OC([C@@H](C[C@@H](O)[C@@H](C)[C@@H](O)[C@@H](C)/C=C(\C)/C(=C/C=C/C(=C\C#N)/C)/C)OC)[C@@H](OP(=O)(O)O)C3(C)C)co1)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N05 compound treatment 2364.0 976.27 0.842 731.0 -103.72 -0.084 0.536 0.6334 2041 BSPBio_001543 OC(=O)CNC(=O)C(CS)Cc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N06 compound treatment 99.0 -1288.7 -1.1115 0.0 -834.72 -0.6762 -1.2641 -0.9716 3001887 BSPBio_001544 CC[C@@]1(O)C(=O)OCc2c1cc3Cc4nc5ccccc5cc4-n3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N07 compound treatment 5.0 -1382.7 -1.1926 21.0 -813.72 -0.6592 -1.3094 -0.9609 831924 BSPBio_001545 O=C[C@@H]1CCCN1C(=O)[C@@H]2CCCN2C(=O)OCc3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N08 compound treatment 0.0 -1387.7 -1.1969 0.0 -834.72 -0.6762 -1.3245 -0.9635 363 BSPBio_001546 CC12C3CCC(O3)C2(C)C(=O)OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N09 compound treatment 607.0 -780.73 -0.6734 465.0 -369.72 -0.2995 -0.6879 -0.9335 1907758 BSPBio_001547 CCC(C)[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N10 compound treatment 5.0 -1382.7 -1.1926 15.0 -819.72 -0.6641 -1.3128 -0.9618 446 BSPBio_001548 COc1cc(CNC(=O)CCCC/C=C/C(C)C)ccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N11 compound treatment 2361.0 973.27 0.8394 1731.0 896.28 0.7261 1.107 0.9974 1891 BSPBio_001549 Clc1oc(=O)c2ccccc2c1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N12 compound treatment 25.0 -1362.7 -1.1753 0.0 -834.72 -0.6762 -1.3092 -0.9655 377 BSPBio_001550 Oc1cc2CCCN(Cc2cc1O)C(=S)NCCc3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N13 compound treatment 1763.0 375.27 0.3237 1661.0 826.28 0.6694 0.7022 0.9444 1907759 BSPBio_001551 CC(C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)OC(C)(C)C)C(C)C)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N14 compound treatment 1776.0 388.27 0.3349 1486.0 651.28 0.5276 0.6099 0.9759 379 BSPBio_001552 O[C@H]1CCN2C[C@H](O)[C@@H](O)[C@H](O)[C@@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N15 compound treatment 1218.0 -169.73 -0.1464 485.0 -349.72 -0.2833 -0.3038 -0.9528 2060 BSPBio_001553 CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N16 compound treatment 414.0 -973.73 -0.8398 381.0 -453.72 -0.3676 -0.8537 -0.9313 1301 BSPBio_001554 OCCN(CCO)c1nc(N2CCCCC2)c3nc(nc(N4CCCCC4)c3n1)N(CCO)CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N17 compound treatment 1037.0 -350.73 -0.3025 316.0 -518.72 -0.4202 -0.511 -0.987 1907760 BSPBio_001555 C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)CCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N18 compound treatment 1611.0 223.27 0.1926 1111.0 276.28 0.2238 0.2944 0.9972 391 BSPBio_001556 Clc1ccc2NC(=O)CSC(c3ccccc3Cl)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N19 compound treatment 2.0 -1385.7 -1.1951 5.0 -829.72 -0.6722 -1.3204 -0.9629 1907761 BSPBio_001557 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc2ccccc2)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N20 compound treatment 0.0 -1387.7 -1.1969 0.0 -834.72 -0.6762 -1.3245 -0.9635 822398 BSPBio_001558 COc1ccc2c(c[n+](C)c3c2ccc4cc5OCOc5cc43)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N21 compound treatment 25.0 -1362.7 -1.1753 16.0 -818.72 -0.6633 -1.3001 -0.9633 1907762 BSPBio_001559 CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N22 compound treatment 0.0 -1387.7 -1.1969 5.0 -829.72 -0.6722 -1.3216 -0.9628 1907763 BSPBio_001560 Oc1ccc(/C=C/C(=O)OCCc2ccccc2)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N23 mock treatment 1294.0 -93.734 -0.0808 670.0 -164.72 -0.1334 -0.1515 -0.9712 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 N24 mock treatment 1079.0 -308.73 -0.2663 398.0 -436.72 -0.3538 -0.4385 -0.9902 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O01 mock treatment 1911.0 523.27 0.4513 1328.0 493.28 0.3996 0.6017 0.9982 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O02 mock treatment 1457.0 69.266 0.0597 166.0 -668.72 -0.5417 -0.3408 -0.6253 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O03 compound treatment 1684.0 296.27 0.2555 196.0 -638.72 -0.5174 -0.1852 -0.3209 73 BSPBio_001561 CCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OCC[N+](C)(C)C)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O04 compound treatment 1612.0 224.27 0.1934 0.0 -834.72 -0.6762 -0.3414 -0.4854 338 BSPBio_001562 Nc1ccncc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O05 compound treatment 1831.0 443.27 0.3823 241.0 -593.72 -0.481 -0.0698 -0.1136 12 BSPBio_001563 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)N4CCOCC4)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O06 compound treatment 1542.0 154.27 0.133 137.0 -697.72 -0.5652 -0.3056 -0.5263 340 BSPBio_001564 CCCCCC(O)CCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O07 compound treatment 1952.0 564.27 0.4867 268.0 -566.72 -0.4591 0.0195 0.0291 305 BSPBio_001565 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)NC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O08 compound treatment 1772.0 384.27 0.3314 129.0 -705.72 -0.5717 -0.1699 -0.2571 3650163 BSPBio_001566 CCN1C[C@@]2(COC)[C@H]3[C@@H](OC)C4[C@@H]1[C@@]3([C@@H]5C[C@@]6(O)[C@H](OC(=O)c7ccccc7)[C@@H]5[C@]4(OC(=O)C)[C@@H](O)[C@@H]6OC)[C@H](C[C@H]2O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O09 compound treatment 283.0 -1104.7 -0.9528 228.0 -606.72 -0.4915 -1.0213 -0.9526 307 BSPBio_001567 CCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O10 compound treatment 1246.0 -141.73 -0.1222 91.0 -743.72 -0.6025 -0.5125 -0.8336 24 BSPBio_001568 CN(CCc1ccc(Cl)c(Cl)c1)CC(O)COc2ccc(NS(=O)(=O)C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O11 compound treatment 82.0 -1305.7 -1.1261 25.0 -809.72 -0.656 -1.2601 -0.9669 311 BSPBio_001569 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O12 compound treatment 1677.0 289.27 0.2495 312.0 -522.72 -0.4235 -0.123 -0.2503 1408 BSPBio_001570 NC1(CC2CC3CC(C2)C1)C3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O13 compound treatment 2752.0 1364.3 1.1766 372.0 -462.72 -0.3749 0.5669 0.4591 313 BSPBio_001571 CCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=O)CCCCCCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O14 compound treatment 1331.0 -56.734 -0.0489 32.0 -802.72 -0.6503 -0.4944 -0.7582 1000042 BSPBio_001572 NC(=N)NC(=O)c1nc(Cl)c(N)nc1N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O15 compound treatment 1802.0 414.27 0.3573 329.0 -505.72 -0.4097 -0.0371 -0.0682 271 BSPBio_001573 CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@@H]2C/C(=C\CCCC(=O)O)/C[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O16 compound treatment 0.0 -1387.7 -1.1969 1.0 -833.72 -0.6754 -1.3239 -0.9633 26 BSPBio_001574 CCCCc1oc2ccccc2c1C(=O)c3cc(I)c(OCCN(CC)CC)c(I)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O17 compound treatment 1458.0 70.266 0.0606 174.0 -660.72 -0.5353 -0.3356 -0.6231 140 BSPBio_001575 CC1(COc2ccc(CC3SC(=O)NC3=O)cc2)CCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O18 compound treatment 0.0 -1387.7 -1.1969 7.0 -827.72 -0.6705 -1.3205 -0.9625 28 BSPBio_001576 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O19 compound treatment 1341.0 -46.734 -0.0403 165.0 -669.72 -0.5425 -0.4121 -0.7576 142 BSPBio_001577 CCOC(=O)C(C)(C)Oc1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O20 compound treatment 61.0 -1326.7 -1.1443 5.0 -829.72 -0.6722 -1.2844 -0.9678 30 BSPBio_001578 COC(=O)C1=C(C)NC(=C(C1c2ccccc2C(F)(F)F)[N+](=O)[O-])C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O21 compound treatment 23.0 -1364.7 -1.177 19.0 -815.72 -0.6608 -1.2996 -0.9627 219 BSPBio_001579 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O22 compound treatment 431.0 -956.73 -0.8251 40.0 -794.72 -0.6438 -1.0387 -0.9925 3103678 BSPBio_001580 N/C(=N\C(=O)c1nc(Cl)c(N)nc1N)/NCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O23 mock treatment 904.0 -483.73 -0.4172 315.0 -519.72 -0.421 -0.5927 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 O24 mock treatment 1054.0 -333.73 -0.2878 186.0 -648.72 -0.5255 -0.5751 -0.9599 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P01 mock treatment 1642.0 254.27 0.2193 1385.0 550.28 0.4458 0.4703 0.9466 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P02 mock treatment 1462.0 74.266 0.0641 1113.0 278.28 0.2254 0.2047 0.8734 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P03 compound treatment 2123.0 735.27 0.6341 1032.0 197.28 0.1598 0.5614 0.8585 1907764 BSPBio_001581 CCCC[C@@H]1[C@@H](OC(=O)CC(C)C)[C@H](C)OC(=O)[C@@H](NC(=O)c2cccc(NC=O)c2OC)[C@@H](C)OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P04 compound treatment 1657.0 269.27 0.2322 1287.0 452.28 0.3664 0.4233 0.9758 393 BSPBio_001582 CC(C)NCC(O)c1ccc(N)c(C#N)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P05 compound treatment 917.0 -470.73 -0.406 683.0 -151.72 -0.1229 -0.374 -0.8817 2090 BSPBio_001583 CCOC(=O)C(C#N)C1C(=C(N)Oc2ccc(Br)cc12)C(=O)OCC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P06 compound treatment 601.0 -786.73 -0.6785 1282.0 447.28 0.3623 -0.2236 -0.2906 157 BSPBio_001584 COC(=O)CC[C@H](NC(=O)CNC(=O)c1ccc(/C=C/C(=O)OC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P07 compound treatment 12.0 -1375.7 -1.1865 15.0 -819.72 -0.6641 -1.3086 -0.9624 2020 BSPBio_001585 CCCCCCCCCCC1=C(C)C(=O)C(=C(OC)C1=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P08 compound treatment 388.0 -999.73 -0.8622 204.0 -630.72 -0.511 -0.971 -0.9688 395 BSPBio_001586 C(Oc1ccccc1C2CC2)C3=NCCN3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P09 compound treatment 1342.0 -45.734 -0.0394 1240.0 405.28 0.3283 0.2043 0.6177 1960 BSPBio_001587 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P10 compound treatment 1706.0 318.27 0.2745 912.0 77.281 0.0626 0.2384 0.8466 448 BSPBio_001588 Clc1cccc(Cl)c1N=C2NCCN2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P11 compound treatment 989.0 -398.73 -0.3439 737.0 -97.719 -0.0792 -0.2991 -0.8477 2284 BSPBio_001589 C[C@H](Cc1ccccc1)N(C)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P12 compound treatment 72.0 -1315.7 -1.1348 17.0 -817.72 -0.6624 -1.2708 -0.9672 417 BSPBio_001590 CN1CCN(CC1)C2=Nc3cc(Cl)ccc3Nc4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P13 compound treatment 9.0 -1378.7 -1.1891 11.0 -823.72 -0.6673 -1.3127 -0.9627 410 BSPBio_001591 CC(=N)NCc1cccc(CN)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P14 compound treatment 7.0 -1380.7 -1.1908 3.0 -831.72 -0.6738 -1.3185 -0.9636 3001893 BSPBio_001592 COc1ccc(/C=C/C(=O)CC(=O)\C=C\c2cccc(O)c2OC)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P15 compound treatment 919.0 -468.73 -0.4043 611.0 -223.72 -0.1812 -0.414 -0.9345 3650164 BSPBio_001593 CCCC[C@@H](C)[C@@H](OC(=O)C[C@@H](CC(=O)O)C(=O)O)[C@H](C[C@@H](C)C[C@H](O)CCCC[C@@H](O)C[C@H](O)[C@H](C)N)OC(=O)C[C@H](CC(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P16 compound treatment 0.0 -1387.7 -1.1969 6.0 -828.72 -0.6714 -1.321 -0.9626 3650165 BSPBio_001594 C[C@H]1C[C@H](C)C(=O)C(C1)[C@H](O)CC2CC(=O)NC(=O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P17 compound treatment 614.0 -773.73 -0.6673 403.0 -431.72 -0.3497 -0.7192 -0.9545 2340 BSPBio_001595 CC(C)[C@@]12O[C@H]2[C@@H]3O[C@]34[C@]5(O[C@H]5C[C@H]6C7=C(CC[C@@]64C)C(=O)OC7)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P18 compound treatment 207.0 -1180.7 -1.0183 116.0 -718.72 -0.5822 -1.1318 -0.9648 3172968 BSPBio_001596 CCC1NC(=O)C(C(O)C(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(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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P19 compound treatment 109.0 -1278.7 -1.1029 98.0 -736.72 -0.5968 -1.2019 -0.9584 1907765 BSPBio_001597 Cc1coc-2c1C(=O)C(=O)c3c4CCCC(C)(C)c4ccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P20 compound treatment 805.0 -582.73 -0.5026 577.0 -257.72 -0.2088 -0.503 -0.9243 397 BSPBio_001598 CC1(C)C(C=C(Cl)Cl)C1C(=O)OC(C#N)c2cccc(Oc3ccccc3)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P21 compound treatment 1.0 -1386.7 -1.196 1.0 -833.72 -0.6754 -1.3233 -0.9634 3650166 BSPBio_001599 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P22 compound treatment 34.0 -1353.7 -1.1675 61.0 -773.72 -0.6268 -1.2688 -0.9575 3103894 BSPBio_001600 C[C@H]1[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@@]42OC(=O)/C=C/[C@H](O)CCC[C@@H](C)C\C=C\[C@H]4[C@H](O)C1=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P23 mock treatment 1035.0 -352.73 -0.3042 838.0 3.2813 0.0027 -0.2132 -0.7009 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2457 P24 mock treatment 1586.0 198.27 0.171 763.0 -71.719 -0.0581 0.0798 0.442 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A01 mock treatment 375.0 -173.17 -0.1494 456.0 -228.72 -0.1853 -0.2366 -0.9943 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A02 mock treatment 195.0 -353.17 -0.3046 568.0 -116.72 -0.0946 -0.2822 -0.885 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A03 compound treatment 180.0 -368.17 -0.3175 124.0 -560.72 -0.4542 -0.5457 -0.9847 3650167 BSPBio_001601 CC(=O)O[C@@H]1C[C@@]2(C)[C@@H](OC(=O)[C@H]3O[C@]32[C@]4(C)[C@@H](CC5C(C)(C)[C@@H](C[C@H](OC(=O)C)[C@]5(C)C14)OC(=O)C)OC(=O)C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A04 compound treatment 540.0 -8.1746 -0.0071 616.0 -68.719 -0.0557 -0.0443 -0.7903 3173352 BSPBio_001602 CC(=O)O[C@@H]1CC2C(C)(C)C(=O)C=C[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]13C)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A05 compound treatment 101.0 -447.17 -0.3857 44.0 -640.72 -0.5191 -0.6397 -0.9893 3173997 BSPBio_001603 COC(=O)CC1C(C)(C)C(=O)C=CC1(C)C2CC[C@@]3(C)[C@@H](OC(=O)C4OC43C2=C)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A06 compound treatment 156.0 -392.17 -0.3382 505.0 -179.72 -0.1456 -0.3421 -0.9291 2060232 BSPBio_001604 CC(=O)O[C@@H]1CC2C(C)(C)C(=O)CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]13C)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A07 compound treatment 313.0 -235.17 -0.2028 0.0 -684.72 -0.5547 -0.5357 -0.9069 3054122 BSPBio_001605 CC(=O)O[C@@H]1C[C@@]2(C)[C@@H](C[C@H]3O[C@]32[C@@]4(C)C1[C@@]5(C)C=CC(=O)C(C)(C)C5=C(O)C4=O)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A08 compound treatment 976.0 427.83 0.369 522.0 -162.72 -0.1318 0.1677 0.428 2060233 BSPBio_001606 COC(=O)C[C@H]1C(C)(C)[C@H](O)[C@@H]2CC3=C4CC(O)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A09 compound treatment 20.0 -528.17 -0.4555 24.0 -660.72 -0.5353 -0.7006 -0.9968 2060028 BSPBio_001607 COC(=O)C[C@H]1C2(C)CC3(OC4(C)O[C@@]56[C@H](OC(=O)C)[C@@]3(O)C2OC(=O)C(C)C)[C@]1(C)[C@@]6(O4)[C@H](OC(=O)C)C(OC(=O)C)[C@@]7(C)[C@@H](OC(=O)/C(=C(\O)/C(C)C)/C57)c8ccoc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A10 compound treatment 940.0 391.83 0.3379 470.0 -214.72 -0.1739 0.116 0.3051 2060235 BSPBio_001608 CC(=O)O[C@@H]1CC2C(C)(C)C(=O)[C@@H]3O[C@@H]3[C@]2(C)C4CC[C@@]5(C)[C@@H](OC(=O)C=C5[C@]14C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A11 compound treatment 10.0 -538.17 -0.4642 367.0 -317.72 -0.2574 -0.5102 -0.9613 2060030 BSPBio_001609 COC(=O)C[C@H]1C(C)(C)C(=O)[C@@H]2CC3C(CC[C@@]4(C)[C@@H](OC(=O)C=C34)c5ccoc5)[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A12 compound treatment 831.0 282.83 0.2439 801.0 116.28 0.0942 0.2391 0.9144 2060237 BSPBio_001610 CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@@]2(C)C(CC(=O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C5OC543)C(=O)O)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A13 compound treatment 0.0 -548.17 -0.4728 1.0 -683.72 -0.5539 -0.726 -0.9969 2060031 BSPBio_001611 C[C@]12CCC3[C@@]4(C)C=CC(=O)C(C)(C)C4=C(O)C(=O)[C@@]3(C)[C@]25O[C@@H]5C[C@H]1c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A14 compound treatment 1092.0 543.83 0.469 400.0 -284.72 -0.2307 0.1686 0.3225 2060240 BSPBio_001612 CC1=C2C(O)C(=O)OC3CC4C(C)(C)C(=O)C=C[C@]4(C)C(CC1)[C@@]32C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A15 compound treatment 329.0 -219.17 -0.189 89.0 -595.72 -0.4826 -0.4749 -0.9163 2060035 BSPBio_001613 CC1(C)C2C[C@@H](O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]543)c6ccoc6)[C@@]2(C)C=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A16 compound treatment 276.0 -272.17 -0.2347 522.0 -162.72 -0.1318 -0.2592 -0.9628 2060241 BSPBio_001614 CC1(C)C2C[C@@H](O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C=C43)c5ccoc5)[C@@]2(C)CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A17 compound treatment 1045.0 496.83 0.4285 978.0 293.28 0.2376 0.471 0.9613 2060230 BSPBio_001615 CC(=O)O[C@H]1C[C@@H](O)C(C)(C)C2C[C@@H](OC(=O)C)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C5OC543)c6ccoc6)[C@@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A18 compound treatment 1041.0 492.83 0.425 655.0 -29.719 -0.0241 0.2835 0.666 2060026 BSPBio_001616 COC(=O)C[C@H]1C(C)(C)[C@@H](OC(=O)C)[C@@H]2CC3C(CC[C@@]4(C)[C@@H](OC(=O)CC34)c5ccoc5)[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A19 compound treatment 792.0 243.83 0.2103 226.0 -458.72 -0.3716 -0.1141 -0.2672 2060147 BSPBio_001617 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)[C@H]5O[C@]543)c6ccoc6)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A20 compound treatment 521.0 -27.175 -0.0234 645.0 -39.719 -0.0322 -0.0393 -0.9879 2060425 BSPBio_001618 COC(=O)[C@@H]1OC(=O)[C@H]2O[C@@]23[C@@]1(C)CCC4[C@@]5(C)CCC(=O)C(C)(C)C5C[C@@H](OC(=O)C)[C@]43C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A21 compound treatment 364.0 -184.17 -0.1588 311.0 -373.72 -0.3028 -0.3264 -0.9547 2060038 BSPBio_001619 COC(=O)C[C@H]1C(C)(C)C(=O)C=C[C@]1(C)C2CC[C@@]3(C)[C@@H](OC(=O)C=C3C2=C)c4ccoc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A22 compound treatment 194.0 -354.17 -0.3055 288.0 -396.72 -0.3214 -0.4432 -0.9997 2060027 BSPBio_001620 CC(=O)O[C@@H]1CC2C(C)(C)[C@@H](O)CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]54[C@]13C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A23 mock treatment 1066.0 517.83 0.4466 728.0 43.281 0.0351 0.3406 0.7603 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 A24 mock treatment 398.0 -150.17 -0.1295 380.0 -304.72 -0.2469 -0.2661 -0.9547 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B01 mock treatment 340.0 -208.17 -0.1795 664.0 -20.719 -0.0168 -0.1388 -0.7699 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B02 mock treatment 558.0 9.8254 0.0085 488.0 -196.72 -0.1594 -0.1067 -0.6686 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B03 compound treatment 744.0 195.83 0.1689 886.0 201.28 0.1631 0.2347 0.9998 812 BSPBio_001621 COC1=CC(=O)C[C@@H](C)[C@@]21Oc3c(C2=O)c(OC)cc(OC)c3Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B04 compound treatment 10.0 -538.17 -0.4642 9.0 -675.72 -0.5474 -0.7153 -0.9966 2060218 BSPBio_001622 COc1c(CC(=O)c2cc3CC(O)C(C)(C)Oc3cc2O)ccc4OC(C)(C)C=Cc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B05 compound treatment 826.0 277.83 0.2396 1139.0 454.28 0.368 0.4297 0.9784 1090422 BSPBio_001623 Cc1cc(O)cc(O)c1C(=O)Oc2cc(C)c(C(=O)O)c(O)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B06 compound treatment 739.0 190.83 0.1646 764.0 79.281 0.0642 0.1618 0.9158 1254 BSPBio_001624 O[C@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B07 compound treatment 734.0 185.83 0.1603 917.0 232.28 0.1882 0.2464 0.9968 3177315 BSPBio_001625 CC1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B08 compound treatment 1113.0 564.83 0.4871 719.0 34.281 0.0278 0.3641 0.7462 1001923 BSPBio_001626 O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B09 compound treatment 401.0 -147.17 -0.1269 1453.0 768.28 0.6224 0.3503 0.5515 2060433 BSPBio_001627 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B10 compound treatment 986.0 437.83 0.3776 1102.0 417.28 0.338 0.506 0.9985 1859 BSPBio_001628 Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c4cc(O)c(O)c(O)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B11 compound treatment 4.0 -544.17 -0.4693 11.0 -673.72 -0.5458 -0.7178 -0.9972 1057125 BSPBio_001629 CC(C)(C=C)c1c2OC(C)(C)C=Cc2c(O)c3c(=O)c4ccc(O)c(O)c4oc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B12 compound treatment 907.0 358.83 0.3095 886.0 201.28 0.1631 0.3341 0.9552 2060418 BSPBio_001630 COc1ccccc1c2cc(=O)c3cccc(OC)c3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B13 compound treatment 1123.0 574.83 0.4958 1258.0 573.28 0.4644 0.679 0.9995 2060242 BSPBio_001631 COc1ccc(cc1)c2cc(=O)c3c(O)c(OC)c(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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B14 compound treatment 11.0 -537.17 -0.4633 8.0 -676.72 -0.5482 -0.7152 -0.9965 2060224 BSPBio_001632 Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c4ccc(O)c(O)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B15 compound treatment 830.0 281.83 0.2431 456.0 -228.72 -0.1853 0.0409 0.1337 2060463 BSPBio_001633 COc1ccc(cc1)c2coc3c(OC)c(OC)cc(O)c3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B16 compound treatment 883.0 334.83 0.2888 1228.0 543.28 0.4401 0.5154 0.9791 2060223 BSPBio_001634 COc1cc(OC)c2C[C@H](O)[C@H](Oc2c1)c3ccc(OC)c(OC)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B17 compound treatment 392.0 -156.17 -0.1347 588.0 -96.719 -0.0784 -0.1506 -0.9668 2069243 BSPBio_001635 O/C(=C\C(=O)c1ccccc1O)/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B18 compound treatment 669.0 120.83 0.1042 372.0 -312.72 -0.2533 -0.1055 -0.385 907310 BSPBio_001636 O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B19 compound treatment 762.0 213.83 0.1844 666.0 -18.719 -0.0152 0.1197 0.6468 2060040 BSPBio_001637 CCOC(=O)C1(O)Oc2cc(OC)cc(OC)c2C(=O)C1c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B20 compound treatment 343.0 -205.17 -0.177 312.0 -372.72 -0.3019 -0.3386 -0.9676 2060221 BSPBio_001638 COc1ccc(cc1)[C@H]2Oc3cc(OC)cc(OC)c3C[C@H]2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B21 compound treatment 944.0 395.83 0.3414 948.0 263.28 0.2133 0.3922 0.9744 1050335 BSPBio_001639 COc1cc(OC)c(C=O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B22 compound treatment 318.0 -230.17 -0.1985 159.0 -525.72 -0.4259 -0.4415 -0.9396 1210108 BSPBio_001640 Oc1ccc2cccc(O)c(=O)c2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B23 mock treatment 2151.0 1602.8 1.3824 1143.0 458.28 0.3713 1.24 0.8663 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 B24 mock treatment 658.0 109.83 0.0947 1158.0 473.28 0.3834 0.3381 0.8561 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C01 mock treatment 84.0 -464.17 -0.4003 644.0 -40.719 -0.033 -0.3064 -0.7628 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C02 mock treatment 337.0 -211.17 -0.1821 537.0 -147.72 -0.1197 -0.2134 -0.9792 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C03 compound treatment 512.0 -36.175 -0.0312 930.0 245.28 0.1987 0.1184 0.5889 2060055 BSPBio_001641 CC(=O)O[C@@H]1CC2C(C)(C)C(=O)CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C5OC54[C@]13C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C04 compound treatment 330.0 -218.17 -0.1882 334.0 -350.72 -0.2841 -0.334 -0.98 2060029 BSPBio_001642 CC(=O)O[C@H]1CC[C@@]2(C)C(C[C@@H](OC(=O)C)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]543)c6ccoc6)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C05 compound treatment 456.0 -92.175 -0.0795 550.0 -134.72 -0.1091 -0.1334 -0.9879 1609 BSPBio_001643 CC(=O)O[C@@H]1CC2C(C)(C)C(=O)C=C[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]54[C@]13C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C06 compound treatment 459.0 -89.175 -0.0769 499.0 -185.72 -0.1505 -0.1608 -0.9515 2060036 BSPBio_001644 CC1=CCc2c(O)c3c(=O)cc(C)oc3cc2OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C07 compound treatment 289.0 -259.17 -0.2235 605.0 -79.719 -0.0646 -0.2037 -0.8756 2060059 BSPBio_001645 CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@@]2(C)C(C[C@@H](OC(=O)C)[C@]3(C)C2CC[C@@]4(C)[C@@H](C[C@H]5O[C@]543)c6ccoc6)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C08 compound treatment 912.0 363.83 0.3138 509.0 -175.72 -0.1424 0.1212 0.3518 2060086 BSPBio_001646 CCC(C)C(=O)O[C@@H]1C[C@@]2(C)[C@@H](OC(=O)CC32OC4(C)OC53[C@H](OC(=O)C(C)C)[C@@]6(O)[C@@H](OC(=O)C7(C)OC7C)[C@@]8(C)C[C@]6(O)[C@@](C)([C@H]8CC(=O)OC)C15O4)c9ccoc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C09 compound treatment 27.0 -521.17 -0.4495 7.0 -677.72 -0.549 -0.7061 -0.9951 2060374 BSPBio_001647 CCC(C)C(OC(=O)C)C(=O)O[C@H]1[C@H](O)C2[C@@]3(C)C=CC(=O)C(C)(C)C3C[C@@H](OC(=O)C(O)C(C)C)[C@@]2(C)[C@]45O[C@@H]5C[C@@H](c6ccoc6)[C@]14C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C10 compound treatment 634.0 85.825 0.074 613.0 -71.719 -0.0581 0.0113 0.1196 3173368 BSPBio_001648 O=C1CC[C@]2(/C=C/C(=O)NCCCCNCCCNC(=O)\C=C\c3ccc4O[C@@H]2C1)c4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C11 compound treatment 105.0 -443.17 -0.3822 102.0 -582.72 -0.4721 -0.6041 -0.9945 2060060 BSPBio_001649 CC1(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]543)c6ccoc6)[C@@]2(C)C=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C12 compound treatment 43.0 -505.17 -0.4357 69.0 -615.72 -0.4988 -0.6608 -0.9977 2060039 BSPBio_001650 CC(=CCc1c(O)cc2oc(C)cc(=O)c2c1O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C13 compound treatment 899.0 350.83 0.3026 1119.0 434.28 0.3518 0.4627 0.9972 2060062 BSPBio_001651 CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@@]2(C)C(CC(=O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]543)c6ccoc6)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C14 compound treatment 356.0 -192.17 -0.1657 553.0 -131.72 -0.1067 -0.1927 -0.9773 2060056 BSPBio_001652 COc1cc(O)c2c(=O)cc(C)oc2c1CC=C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C15 compound treatment 603.0 54.825 0.0473 777.0 92.281 0.0748 0.0863 0.9756 2060063 BSPBio_001653 CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@@]2(C)C(C[C@@H](OC(=O)C)[C@]3(C)C2CC[C@@]4(C)[C@@H](C(=O)[C@H]5O[C@]543)c6ccoc6)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C16 compound treatment 1049.0 500.83 0.4319 1344.0 659.28 0.5341 0.6831 0.9945 3054129 BSPBio_001654 CO[C@@H]1CC2N3CC(O)C2(C=C1)c4cc5OCOc5c(OC)c4C3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C17 compound treatment 818.0 269.83 0.2327 997.0 312.28 0.253 0.3434 0.9991 2060066 BSPBio_001655 COC(=O)CC1C(C)(C)C(=O)C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC(C3=C)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C18 compound treatment 1135.0 586.83 0.5061 663.0 -21.719 -0.0176 0.3454 0.6821 2060061 BSPBio_001656 Cc1cc(=O)c2c(O)c3CCC(C)(C)Oc3cc2o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C19 compound treatment 705.0 156.83 0.1353 1219.0 534.28 0.4328 0.4017 0.8858 3173867 BSPBio_001657 COC(=O)C[C@H]1C(C)(C)C(=O)[C@@H]2CC3=C4CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C20 compound treatment 568.0 19.825 0.0171 249.0 -435.72 -0.353 -0.2375 -0.6721 3058621 BSPBio_001658 C[C@H]1C2[C@H](C[C@H]3C4CC=C5C[C@@H](O)CC[C@]5(C)C4CC[C@]23C)O[C@@]61CC[C@@H](C)CN6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C21 compound treatment 566.0 17.825 0.0154 1246.0 561.28 0.4547 0.3324 0.7306 2060435 BSPBio_001659 COC(=O)C(OC(=O)C)[C@H]1C(C)(C)C(=O)C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC(C3=C)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C22 compound treatment 234.0 -314.17 -0.271 209.0 -475.72 -0.3854 -0.4641 -0.9851 2060161 BSPBio_001660 CC(=C)[C@H]1COc2cc3oc(=O)ccc3cc2O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C23 mock treatment 803.0 254.83 0.2198 880.0 195.28 0.1582 0.2673 0.987 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 C24 mock treatment 824.0 275.83 0.2379 385.0 -299.72 -0.2428 -0.0035 -0.0102 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D01 mock treatment 346.0 -202.17 -0.1744 657.0 -27.719 -0.0225 -0.1392 -0.7916 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D02 mock treatment 334.0 -214.17 -0.1847 550.0 -134.72 -0.1091 -0.2078 -0.9685 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D03 compound treatment 567.0 18.825 0.0162 941.0 256.28 0.2076 0.1583 0.7601 2060043 BSPBio_001661 COc1cc(OC)c(Cl)c2OC3(C(C)CC(=O)C=C3O)C(=O)c21 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D04 compound treatment 777.0 228.83 0.1974 885.0 200.28 0.1623 0.2543 0.9953 2060082 BSPBio_001662 COC(=O)c1cc(OC)c(=O)c2c(OC)c(OC)ccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D05 compound treatment 802.0 253.83 0.2189 1440.0 755.28 0.6119 0.5874 0.904 2060396 BSPBio_001663 OC[C@H]1O[C@@H](Oc2ccc(C(=O)/C=C/c3ccccc3)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D06 compound treatment 944.0 395.83 0.3414 798.0 113.28 0.0918 0.3063 0.8664 2060226 BSPBio_001664 O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c4c(=O)c(O)cc(cc34)[C@H]5Oc6cc(O)cc(O)c6C[C@H]5OC(=O)c7cc(O)c(O)c(O)c7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D07 compound treatment 1177.0 628.83 0.5423 1338.0 653.28 0.5292 0.7577 0.9999 3235 BSPBio_001665 OC(=O)c1ccccc1OC(=O)c2ccccc2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D08 compound treatment 1305.0 756.83 0.6527 325.0 -359.72 -0.2914 0.2555 0.3574 2060444 BSPBio_001666 O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c4c(=O)c(O)cccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D09 compound treatment 23.0 -525.17 -0.4529 536.0 -148.72 -0.1205 -0.4055 -0.8651 1032994 BSPBio_001667 O=C1CC(Oc2ccccc12)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D10 compound treatment 198.0 -350.17 -0.302 115.0 -569.72 -0.4615 -0.5399 -0.9789 1016781 BSPBio_001668 OC(=O)c1cc(O)c(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D11 compound treatment 43.0 -505.17 -0.4357 56.0 -628.72 -0.5093 -0.6682 -0.997 3177381 BSPBio_001669 Oc1ccc(cc1)C(=O)/C=C/c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D12 compound treatment 1056.0 507.83 0.438 1543.0 858.28 0.6953 0.8014 0.9752 1109169 BSPBio_001670 COc1ccc2c(=O)c(coc2c1)c3cc4OCOc4cc3OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D13 compound treatment 910.0 361.83 0.3121 1453.0 768.28 0.6224 0.6608 0.949 2060263 BSPBio_001671 COc1ccc(C(=O)c2ccc(O)cc2)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D14 compound treatment 741.0 192.83 0.1663 1395.0 710.28 0.5754 0.5245 0.8756 2060407 BSPBio_001672 COc1ccc(/C=C/C(=O)O)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D15 compound treatment 11.0 -537.17 -0.4633 9.0 -675.72 -0.5474 -0.7147 -0.9966 1019365 BSPBio_001673 COC1=CC(=O)C=C(OC)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D16 compound treatment 1287.0 738.83 0.6372 1133.0 448.28 0.3632 0.7074 0.9645 2060406 BSPBio_001674 COc1ccccc1/C=C\C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D17 compound treatment 1043.0 494.83 0.4268 1651.0 966.28 0.7828 0.8553 0.9593 2069258 BSPBio_001675 COc1ccc(c(OC)c1O)c2coc3cc(O)ccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D18 compound treatment 1207.0 658.83 0.5682 1899.0 1214.3 0.9837 1.0974 0.966 2060422 BSPBio_001676 CCOc1ccc(cc1)C(=O)c2cc(O)c(OC)c(OC)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D19 compound treatment 980.0 431.83 0.3724 1144.0 459.28 0.3721 0.5264 1.0 2060392 BSPBio_001677 CCOc1ccc(cc1)C(=O)c2ccc(O)c(O)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D20 compound treatment 502.0 -46.175 -0.0398 568.0 -116.72 -0.0946 -0.095 -0.9261 2069226 BSPBio_001678 COc1ccc2-c3oc4cc(OC)ccc4c3COc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D21 compound treatment 1196.0 647.83 0.5587 1153.0 468.28 0.3794 0.6633 0.9822 3058620 BSPBio_001679 O[C@@H](C(=O)O)[C@@](O)(Cc1ccc(O)cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D22 compound treatment 1341.0 792.83 0.6838 700.0 15.281 0.0124 0.4923 0.7198 1003514 BSPBio_001680 COc1cc(cc(OC)c1OC)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D23 mock treatment 1453.0 904.83 0.7804 1184.0 499.28 0.4045 0.8378 0.9532 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 D24 mock treatment 415.0 -133.17 -0.1149 478.0 -206.72 -0.1675 -0.1996 -0.9831 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E01 mock treatment 296.0 -252.17 -0.2175 625.0 -59.719 -0.0484 -0.188 -0.8438 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E02 mock treatment 390.0 -158.17 -0.1364 744.0 59.281 0.048 -0.0625 -0.4322 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E03 compound treatment 642.0 93.825 0.0809 1140.0 455.28 0.3688 0.318 0.8422 2060083 BSPBio_001681 COC(=O)C(O)[C@H]1C(C)(C)C(=O)C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC(C3=C)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E04 compound treatment 849.0 300.83 0.2594 1091.0 406.28 0.3291 0.4162 0.9931 1352641 BSPBio_001682 COc1c2ccoc2nc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E05 compound treatment 846.0 297.83 0.2569 1057.0 372.28 0.3016 0.3949 0.9968 2060085 BSPBio_001683 C[C@]12CCC3[C@@](C)([C@H](O)CC4[C@]3(C)C=CC(=O)OC4(C)C)C25OC5C(=O)O[C@H]1c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E06 compound treatment 742.0 193.83 0.1672 877.0 192.28 0.1558 0.2284 0.9994 2060295 BSPBio_001684 CC(C)C1COc2cc3oc(=O)ccc3cc2O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E07 compound treatment 14.0 -534.17 -0.4607 9.0 -675.72 -0.5474 -0.7128 -0.9963 3085328 BSPBio_001685 Oc1cccc(c1)c2cc(=O)c3cc(O)ccc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E08 compound treatment 1101.0 552.83 0.4768 1149.0 464.28 0.3761 0.6031 0.9931 2060058 BSPBio_001686 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E09 compound treatment 1190.0 641.83 0.5535 1240.0 555.28 0.4498 0.7095 0.9947 2069252 BSPBio_001687 CCC(C)C(OC(=O)C)C(=O)O[C@H]1[C@H](OC=O)C(C(=C)C2(O)C(=O)C[C@@H](c3ccoc3)[C@]12C)[C@]4(C)C(CC(=O)OC)[C@@](C)(COC(=O)C)OC(=O)C[C@@H]4OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E10 compound treatment 1419.0 870.83 0.7511 1267.0 582.28 0.4717 0.8646 0.9749 3173478 BSPBio_001688 C[C@H]1C(=O)CCC2[C@]1(C)CCC3[C@@]2(C)CC[C@@]4(C)C5CC(C)(C)CC[C@]5(C)CC[C@]34C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E11 compound treatment 984.0 435.83 0.3759 927.0 242.28 0.1963 0.4046 0.9541 2060087 BSPBio_001689 COC(=O)C(O)[C@H]1C(C)(C)C(OC(=O)/C(=C/C)/C)[C@@H]2C=C3C(CC[C@@]4(C)[C@@H](OC(=O)CC34)c5ccoc5)[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E12 compound treatment 810.0 261.83 0.2258 1421.0 736.28 0.5965 0.5814 0.9117 3054135 BSPBio_001690 CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2CC=C4C5CC(C)(C)CC[C@]5(C)CC[C@]43C)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E13 compound treatment 1411.0 862.83 0.7442 1758.0 1073.3 0.8695 1.141 0.997 2060090 BSPBio_001691 COC(=O)C[C@H]1C(C)(C)C(OC(=O)C)[C@]2(O)C=C3C(CC[C@@]4(C)[C@@H](OC(=O)CC34)c5ccoc5)[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E14 compound treatment 1518.0 969.83 0.8364 1154.0 469.28 0.3802 0.8603 0.9363 2060410 BSPBio_001692 CC1(C)[C@H](O)CC(=O)[C@@]2(C)C1C[C@@H](O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C5OC543)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E15 compound treatment 1235.0 686.83 0.5924 1472.0 787.28 0.6378 0.8698 0.9993 2060089 BSPBio_001693 CCC(C)C(=O)O[C@@H]1C[C@@]2(C)[C@@H](OC(=O)CC32OC4(C)O[C@]53[C@H](OC(=O)C)[C@@]6(O)C(OC(=O)C7(C)OC7C)C8(C)CC6(O)[C@@](C)([C@H]8CC(=O)OC)[C@@]15O4)c9ccoc9 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E16 compound treatment 1274.0 725.83 0.626 1628.0 943.28 0.7642 0.983 0.9951 2060065 BSPBio_001694 COC[C@@]12CN(C=O)C3[C@@H]4[C@H](OC)C2[C@]3(C5CC6(O)C(OC(=O)c7ccccc7)C5C4(OC(=O)C)C(O)C6OC)[C@H](C[C@H]1O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E17 compound treatment 2.0 -546.17 -0.4711 1.0 -683.72 -0.5539 -0.7247 -0.9967 2060091 BSPBio_001695 CC(CC(O)C1OC1(C)C)[C@@H]2CCC3(C)C4=CCC5C(C)(C)C(=O)CCC5(C)C4CC[C@@]23C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E18 compound treatment 7.0 -541.17 -0.4667 24.0 -660.72 -0.5353 -0.7085 -0.9977 3650168 BSPBio_001696 CC(=O)O[C@@H]1CC2C(C)(C)[C@H](O)CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]54[C@]13C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E19 compound treatment 557.0 8.8254 0.0076 1255.0 570.28 0.462 0.3321 0.7187 2060093 BSPBio_001697 CC([C@@H]1CC[C@]2(C)C3=CCC4C(C)(C)C(=O)CC[C@]4(C)C3CC[C@@]12C)C5OC(C)(C)C(O)C5O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E20 compound treatment 865.0 316.83 0.2732 1022.0 337.28 0.2732 0.3864 1.0 2060068 BSPBio_001698 COC1C(O)C(O[C@H]2CC[C@]3(C=O)C4[C@@H](C[C@]5(C)[C@H](CC[C@]5(O)C4CC[C@]3(O)C2)C6=CC(=O)OC6)OC(=O)C)OC(C)C1OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E21 compound treatment 379.0 -169.17 -0.1459 127.0 -557.72 -0.4518 -0.4227 -0.8902 2060094 BSPBio_001699 COC(=O)C(O)[C@H]1C(C)(C)[C@@H](OC(=O)C)[C@@H]2CC3=C4CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E22 compound treatment 965.0 416.83 0.3595 722.0 37.281 0.0302 0.2756 0.7638 3174249 BSPBio_001700 CC(CCC(=O)O)[C@H]1CCC2C3CC[C@@H]4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E23 mock treatment 1649.0 1100.8 0.9494 889.0 204.28 0.1655 0.7884 0.818 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 E24 mock treatment 975.0 426.83 0.3681 488.0 -196.72 -0.1594 0.1476 0.368 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F01 mock treatment 368.0 -180.17 -0.1554 891.0 206.28 0.1671 0.0083 0.0363 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F02 mock treatment 381.0 -167.17 -0.1442 534.0 -150.72 -0.1221 -0.1883 -0.9966 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F03 compound treatment 1542.0 993.83 0.8571 857.0 172.28 0.1396 0.7048 0.8116 1015281 BSPBio_001701 COc1cc(O)c(C(=O)C)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F04 compound treatment 821.0 272.83 0.2353 1054.0 369.28 0.2992 0.3779 0.9929 2060452 BSPBio_001702 CC1(C)O[C@@H]2C[C@](O)(C[C@@H](O)[C@@H]2O1)C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F05 compound treatment 853.0 304.83 0.2629 1142.0 457.28 0.3704 0.4478 0.9859 3174120 BSPBio_001703 CCCCCCCCCCCC[C@@H]([C@@H](C)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F06 compound treatment 579.0 30.825 0.0266 892.0 207.28 0.1679 0.1375 0.809 1009294 BSPBio_001704 Oc1ccc2C(=O)c3ccccc3C(=O)c2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F07 compound treatment 904.0 355.83 0.3069 1155.0 470.28 0.381 0.4864 0.9942 2060049 BSPBio_001705 Cc1cc(=O)c2c(O)c(C)c(O)cc2o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F08 compound treatment 1.0 -547.17 -0.4719 96.0 -588.72 -0.4769 -0.6709 -1.0 1112402 BSPBio_001706 COc1ccc2ccc(=O)oc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F09 compound treatment 1248.0 699.83 0.6036 1271.0 586.28 0.475 0.7626 0.993 2060259 BSPBio_001707 COc1ccc2c(=O)c(CC(=O)O)coc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F10 compound treatment 594.0 45.825 0.0395 551.0 -133.72 -0.1083 -0.0487 -0.4219 3077346 BSPBio_001708 COC(=O)c1c(C)cc(OC)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F11 compound treatment 143.0 -405.17 -0.3494 120.0 -564.72 -0.4575 -0.5706 -0.9912 2060294 BSPBio_001709 COc1ccc2C(=O)C(Cc3ccc(OC)c(O)c3)COc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F12 compound treatment 813.0 264.83 0.2284 953.0 268.28 0.2173 0.3152 0.9997 2069267 BSPBio_001710 Oc1cc(O)c(C(=O)/C=C/c2ccccc2)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F13 compound treatment 692.0 143.83 0.124 1128.0 443.28 0.3591 0.3416 0.8992 2060504 BSPBio_001711 Cc1cc(O)c(C)c(O)c1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F14 compound treatment 175.0 -373.17 -0.3218 340.0 -344.72 -0.2793 -0.425 -0.9975 3078463 BSPBio_001712 CCOC(=O)c1c(C)cc(OC)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F15 compound treatment 373.0 -175.17 -0.1511 342.0 -342.72 -0.2776 -0.3032 -0.9591 2120750 BSPBio_001713 CC(C)C(C)/C=C/C(C)C1CCC2C3=CC=C4CC(O)CCC4(C)C3CCC12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F16 compound treatment 1480.0 931.83 0.8037 2064.0 1379.3 1.1174 1.3584 0.9869 2060044 BSPBio_001714 CC(=O)Oc1cc(cc(OC(=O)C)c1OC(=O)C)c2coc3cc(OC(=O)C)c(OC(=O)C)c(OC(=O)C)c3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F17 compound treatment 937.0 388.83 0.3353 1810.0 1125.3 0.9116 0.8817 0.9078 3173626 BSPBio_001715 CC(C)C(C)/C=C/C(C)C1CCC2C3=CC=C4C(C)(C)C(CCC4(C)C3CCC12C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F18 compound treatment 1117.0 568.83 0.4906 1577.0 892.28 0.7228 0.858 0.9822 2060322 BSPBio_001716 COc1ccc2c(=O)c(OC)c(oc2c1)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F19 compound treatment 1052.0 503.83 0.4345 1935.0 1250.3 1.0129 1.0235 0.9286 2060070 BSPBio_001717 COc1c(O)cc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F20 compound treatment 1561.0 1012.8 0.8735 1025.0 340.28 0.2757 0.8126 0.8871 3173217 BSPBio_001718 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)[C@@H]6OC)C(C[C@H]2O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F21 compound treatment 253.0 -295.17 -0.2546 427.0 -257.72 -0.2088 -0.3276 -0.9952 2060069 BSPBio_001719 COc1cc(cc(O)c1OC)c2coc3cc(OCc4ccccc4)c(OC)c(O)c3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F22 compound treatment 835.0 286.83 0.2474 761.0 76.281 0.0618 0.2186 0.8574 3553784 BSPBio_001720 CC[C@@H]1[C@@H](O)N2[C@H]3C[C@@]45C(O)C3C1CC2[C@@H]5N(C)c6ccccc64 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F23 mock treatment 140.0 -408.17 -0.352 1617.0 932.28 0.7553 0.2851 0.3422 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 F24 mock treatment 985.0 436.83 0.3767 779.0 94.281 0.0764 0.3204 0.8335 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G01 mock treatment 326.0 -222.17 -0.1916 583.0 -101.72 -0.0824 -0.1938 -0.9289 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G02 mock treatment 518.0 -30.175 -0.026 1330.0 645.28 0.5228 0.3512 0.6711 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G03 compound treatment 746.0 197.83 0.1706 1173.0 488.28 0.3956 0.4003 0.9293 3079218 BSPBio_001721 COC(=O)C[C@H]1C(C)(C)[C@@H](O)C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CC[C@H](C3=C)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G04 compound treatment 1357.0 808.83 0.6976 1455.0 770.28 0.624 0.9345 0.9985 2060088 BSPBio_001722 COc1cc2ccc(=O)oc2c(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G05 compound treatment 752.0 203.83 0.1758 557.0 -127.72 -0.1035 0.0511 0.2507 2060097 BSPBio_001723 C[C@]12CCC3C([C@H](O)CC4C(C)(C)C(=O)C=C[C@]34C)[C@]25O[C@@H]5C[C@H]1c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G06 compound treatment 615.0 66.825 0.0576 1045.0 360.28 0.2919 0.2471 0.8307 1000946 BSPBio_001724 COc1ccc(CC2N(C)CCc3cc(OC)c(OC)cc23)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G07 compound treatment 612.0 63.825 0.055 1134.0 449.28 0.364 0.2963 0.8049 1065 BSPBio_001725 CN1C(CC(O)c2ccccc2)CCCC1CC(=O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G08 compound treatment 1345.0 796.83 0.6872 1150.0 465.28 0.3769 0.7525 0.96 1029487 BSPBio_001726 OCC(O)Cc1ccc2OCOc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G09 compound treatment 372.0 -176.17 -0.1519 145.0 -539.72 -0.4372 -0.4166 -0.9 2060115 BSPBio_001727 CC(=CCOc1cc2oc(=O)ccc2cc1O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G10 compound treatment 1092.0 543.83 0.469 963.0 278.28 0.2254 0.4911 0.9436 2060292 BSPBio_001728 CC1(C)[C@H](O)C[C@H](O)[C@@]2(C)C1C[C@@H](O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]543)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G11 compound treatment 1663.0 1114.8 0.9615 1661.0 976.28 0.7909 1.2391 0.9953 2060372 BSPBio_001729 COC(=O)C[C@H]1C(C)(C)C(=O)[C@@H]2CC3=C(CC[C@@]4(C)[C@@H](OC(=O)C=C34)c5ccoc5)[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G12 compound treatment 6.0 -542.17 -0.4676 3.0 -681.72 -0.5523 -0.7212 -0.9966 2060092 BSPBio_001730 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CCC3C4CC=C(C(=O)C)[C@@]4(C)C(=O)CC32)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G13 compound treatment 1619.0 1070.8 0.9235 1600.0 915.28 0.7415 1.1774 0.9941 2060371 BSPBio_001731 COC(=O)C[C@H]1C(C)(C)C2(O)OC34CC2C(=O)[C@]1(C)C4CC[C@@]5(C)[C@@H](OC(=O)C=C35)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G14 compound treatment 727.0 178.83 0.1542 1149.0 464.28 0.3761 0.375 0.9225 3557444 BSPBio_001732 C[C@@]12CCC3C(CC=C4C[C@@H](O)CC[C@]34C)C2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G15 compound treatment 800.0 251.83 0.2172 996.0 311.28 0.2522 0.3319 0.9972 2060118 BSPBio_001733 COC(=O)CC1C(C)(C)C(O)C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC(C3=C)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G16 compound treatment 1089.0 540.83 0.4664 1127.0 442.28 0.3583 0.5832 0.9915 3054130 BSPBio_001734 CC(CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)C4(C)CC[C@H](OC(=O)C)C(C)(C)C4CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G17 compound treatment 13.0 -535.17 -0.4616 20.0 -664.72 -0.5385 -0.7072 -0.9971 2069253 BSPBio_001735 CC(C)/C(=C/1\C2[C@@]34OC5(C)O[C@@]4([C@H](O)C(O)[C@@]2(C)[C@@H](OC1=O)c6ccoc6)[C@]7(C)[C@@H](CC(=O)O)C8(C)CC7(O5)[C@](O)(C8O)[C@H]3O)/O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G18 compound treatment 380.0 -168.17 -0.145 306.0 -378.72 -0.3068 -0.3195 -0.9415 3173612 BSPBio_001736 CC(=O)OC1CC2(O)C3CCC4CC(CC[C@]4(C)C3CC[C@]2(C)C1C5=CC(=O)OC5)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G19 compound treatment 248.0 -300.17 -0.2589 338.0 -346.72 -0.2809 -0.3817 -0.9992 2060121 BSPBio_001737 COC(=O)C[C@H]1C(C)(C)C2(Cl)O[C@]34CC2C(=O)[C@]1(C)C4CC[C@@]5(C)[C@@H](OC(=O)C=C35)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G20 compound treatment 925.0 376.83 0.325 495.0 -189.72 -0.1537 0.1211 0.3369 2060096 BSPBio_001738 CC(=O)O[C@@H]1CC(=O)[C@@]2(C)C(CC(=O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C5OC543)c6ccoc6)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G21 compound treatment 1190.0 641.83 0.5535 1074.0 389.28 0.3154 0.6144 0.9644 2060405 BSPBio_001739 CC1(C)[C@H](CC(=O)O)[C@@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]3(O)C[C@@H](C1=O)C2=O)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G22 compound treatment 72.0 -476.17 -0.4107 39.0 -645.72 -0.5231 -0.6603 -0.9928 2060098 BSPBio_001740 C[C@@]12CCC3C(CC[C@H]4C[C@@H](Cl)CC[C@@]43C)C2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G23 mock treatment 1346.0 797.83 0.6881 876.0 191.28 0.155 0.5961 0.8452 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 G24 mock treatment 718.0 169.83 0.1465 511.0 -173.72 -0.1407 0.0041 0.02 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H01 mock treatment 494.0 -54.175 -0.0467 629.0 -55.719 -0.0451 -0.065 -0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H02 mock treatment 716.0 167.83 0.1447 1289.0 604.28 0.4895 0.4485 0.8786 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H03 compound treatment 557.0 8.8254 0.0076 848.0 163.28 0.1323 0.0989 0.7466 592 BSPBio_001741 Oc1ccc(cc1)c2coc3cc(O)ccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H04 compound treatment 0.0 -548.17 -0.4728 0.0 -684.72 -0.5547 -0.7265 -0.9968 922 BSPBio_001742 CCCCC(CC)CN1CN(CC(CC)CCCC)CC(C)(N)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H05 compound treatment 837.0 288.83 0.2491 1204.0 519.28 0.4207 0.4736 0.9687 2060133 BSPBio_001743 COc1cc(cc(O)c1OC)c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c(O)c3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H06 compound treatment 878.0 329.83 0.2845 968.0 283.28 0.2295 0.3634 0.9943 780 BSPBio_001744 CC(C)NNC(=O)c1ccncc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H07 compound treatment 6.0 -542.17 -0.4676 31.0 -653.72 -0.5296 -0.7051 -0.9981 2060143 BSPBio_001745 COC1=CC(=O)C(=CC1=O)C(C=C)c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H08 compound treatment 1022.0 473.83 0.4087 1197.0 512.28 0.415 0.5824 1.0 736 BSPBio_001746 COC(=O)C(N)CS 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H09 compound treatment 918.0 369.83 0.319 805.0 120.28 0.0974 0.2944 0.8828 3054981 BSPBio_001747 COc1ccc(cc1)c2cc(=O)c3c(OC(=O)C)cc(OC(=O)C)cc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H10 compound treatment 4406.0 3857.8 3.3272 3834.0 3149.3 2.5513 4.1567 0.9914 1043 BSPBio_001748 O[Hg]c1c(O)c(Br)cc2c(c3ccccc3C(=O)O)c4cc(Br)c(=O)cc4oc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H11 compound treatment 13.0 -535.17 -0.4616 34.0 -650.72 -0.5272 -0.6991 -0.9978 2060078 BSPBio_001749 COc1cc2OC[C@H]3Oc4c(CC=C(C)C)c(O)ccc4C(=O)[C@H]3c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H12 compound treatment 1010.0 461.83 0.3983 1466.0 781.28 0.6329 0.7292 0.9751 893 BSPBio_001750 NCC(O)c1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H13 compound treatment 1369.0 820.83 0.7079 1331.0 646.28 0.5236 0.8708 0.989 2060106 BSPBio_001751 COc1cc(cc(OC)c1OC)c2coc3cc(OC)c(OC)c(OC)c3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H14 compound treatment 4.0 -544.17 -0.4693 1.0 -683.72 -0.5539 -0.7235 -0.9966 1020 BSPBio_001752 NC(=N)c1ccc(OCCCCCOc2ccc(cc2)C(=N)N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H15 compound treatment 282.0 -266.17 -0.2296 383.0 -301.72 -0.2444 -0.3352 -0.9995 3054030 BSPBio_001753 Oc1cc(O)cc(/C=C/c2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H16 compound treatment 420.0 -128.17 -0.1105 742.0 57.281 0.0464 -0.0454 -0.3783 1052 BSPBio_001754 CC[C@H]1CN2CCC1C[C@@H]2[C@@H](O)c3ccnc4ccc(OC)cc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H17 compound treatment 254.0 -294.17 -0.2537 364.0 -320.72 -0.2598 -0.3631 -0.9999 3055207 BSPBio_001755 COc1cc(O)cc(/C=C/c2ccccc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H18 compound treatment 879.0 330.83 0.2853 954.0 269.28 0.2181 0.356 0.9912 1150 BSPBio_001756 OC(=O)CCCCCCCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H19 compound treatment 21.0 -527.17 -0.4547 72.0 -612.72 -0.4964 -0.6725 -0.999 3054032 BSPBio_001757 COc1cc(C/C=C/c2ccccc2)c(OC)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H20 compound treatment 674.0 125.83 0.1085 728.0 43.281 0.0351 0.1015 0.8903 1222 BSPBio_001758 Cn1cnc2n(C)c(=O)[nH]c(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H21 compound treatment 409.0 -139.17 -0.12 654.0 -30.719 -0.0249 -0.1025 -0.8359 1059133 BSPBio_001759 COc1ccc(C(=O)c2ccccc2)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H22 compound treatment 449.0 -99.175 -0.0855 445.0 -239.72 -0.1942 -0.1978 -0.9321 1154 BSPBio_001760 O=C1CC2OCC=C3CN4CC[C@]56C4C[C@@H]3[C@@H]2C6N1c7ccccc75 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H23 mock treatment 492.0 -56.175 -0.0484 840.0 155.28 0.1258 0.0547 0.4057 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 H24 mock treatment 791.0 242.83 0.2094 461.0 -223.72 -0.1812 0.0199 0.072 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I01 mock treatment 262.0 -286.17 -0.2468 723.0 38.281 0.031 -0.1526 -0.6134 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I02 mock treatment 367.0 -181.17 -0.1563 963.0 278.28 0.2254 0.0489 0.1783 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I03 compound treatment 431.0 -117.17 -0.1011 795.0 110.28 0.0893 -0.0083 -0.0614 2060364 BSPBio_001761 CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@@]2(C)C(C[C@@H](OC(=O)C)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C=C43)c5ccoc5)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I04 compound treatment 407.0 -141.17 -0.1218 170.0 -514.72 -0.417 -0.3809 -0.877 1384788 BSPBio_001762 COc1c2OCOc2cc3CC[N+](=Cc13)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I05 compound treatment 184.0 -364.17 -0.3141 403.0 -281.72 -0.2282 -0.3835 -0.9877 2060145 BSPBio_001763 CC1(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C=C43)c5ccoc5)[C@@]2(C)C=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I06 compound treatment 0.0 -548.17 -0.4728 6.0 -678.72 -0.5498 -0.7231 -0.9972 1019607 BSPBio_001764 CN(C)Cc1c(C)[nH]c2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I07 compound treatment 10.0 -538.17 -0.4642 2.0 -682.72 -0.5531 -0.7193 -0.9962 2060215 BSPBio_001765 CC1(C)C2C=C[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C5OC543)c6ccoc6)[C@@]2(C)C=CC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I08 compound treatment 320.0 -228.17 -0.1968 334.0 -350.72 -0.2841 -0.3401 -0.9839 2060117 BSPBio_001766 Cc1ccc2c(CC[C@H]3CC(=O)CC[C@@]32C)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I09 compound treatment 1258.0 709.83 0.6122 1218.0 533.28 0.432 0.7384 0.9854 2060127 BSPBio_001767 COC1CC2=C3C[C@H]4C(=O)C(C)(C)[C@H](CC(=O)OC)[C@@](C)(C3CC[C@@]2(C)[C@@H](O1)c5ccoc5)C4=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I10 compound treatment 467.0 -81.175 -0.07 540.0 -144.72 -0.1172 -0.1324 -0.9696 2060122 BSPBio_001768 CC1(C)Oc2cc3oc(=O)ccc3cc2C=C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I11 compound treatment 16.0 -532.17 -0.459 4.0 -680.72 -0.5515 -0.7145 -0.9958 2060125 BSPBio_001769 COC(=O)C[C@H]1C(C)(C)C(=O)[C@@H]2C[C@]3(O)C(CC[C@@]4(C)[C@@H](OC(=O)C=C43)c5ccoc5)[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I12 compound treatment 16.0 -532.17 -0.459 4.0 -680.72 -0.5515 -0.7145 -0.9958 2060124 BSPBio_001770 COC(=O)[C@@]1(C)CCC[C@@]2(C)C1CCc3c(C(C)C)c(O)ccc32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I13 compound treatment 873.0 324.83 0.2801 1446.0 761.28 0.6167 0.6342 0.9362 2060129 BSPBio_001771 CC(=O)O[C@@H]1C[C@H](OC(=O)C)[C@@]2(C)C(C[C@@H](OC(=O)C)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]543)c6ccoc6)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I14 compound treatment 19.0 -529.17 -0.4564 13.0 -671.72 -0.5442 -0.7075 -0.9962 2060128 BSPBio_001772 CO[C@@H]1C(OC(=O)C(C)C)[C@@]2(C)[C@@H](OC(=O)/C(=C(\OC)/C(C)C)/C2[C@@]34OC5(C)O[C@]14[C@]6(C)[C@@H](CC(=O)OC)C7(C)CC6(O5)[C@](OC)(C7OC(=O)C)[C@H]3OC)c8ccoc8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I15 compound treatment 726.0 177.83 0.1534 993.0 308.28 0.2497 0.285 0.9726 2060365 BSPBio_001773 CC(=O)O[C@@H]1CC2C(C)(C)C(=O)C3OC3[C@]2(C)C4CC[C@@]5(C)[C@@H](OC(=O)C6OC65[C@]14C)c7ccoc7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I16 compound treatment 552.0 3.8254 0.0033 693.0 8.2813 0.0067 0.0071 0.9466 2060424 BSPBio_001774 C[C@@]12CC[C@@H](O)C[C@H]2CCc3ccccc31 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I17 compound treatment 839.0 290.83 0.2508 1224.0 539.28 0.4369 0.4863 0.9653 2060350 BSPBio_001775 CC(=O)O[C@@H]1CC2C(C)(C)[C@H](O)C=C[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]13C)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I18 compound treatment 670.0 121.83 0.1051 1026.0 341.28 0.2765 0.2698 0.9122 2060146 BSPBio_001776 C[C@@]12CCC(=O)C=C2CCc3ccc(O)cc31 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I19 compound treatment 740.0 191.83 0.1654 1366.0 681.28 0.5519 0.5072 0.8804 2060150 BSPBio_001777 CC1(C)[C@H](O)C=C[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]3(C)OC(=O)CC12)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I20 compound treatment 888.0 339.83 0.2931 899.0 214.28 0.1736 0.33 0.9687 2060410 BSPBio_001778 CC1(C)[C@H](O)CC(=O)[C@@]2(C)C1C[C@@H](O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C5OC543)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I21 compound treatment 229.0 -319.17 -0.2753 622.0 -62.719 -0.0508 -0.2306 -0.8237 2060158 BSPBio_001779 CC(=O)O[C@@H]1CC2C(C)(C)[C@H](OC(=O)C)C=C[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]13C)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I22 compound treatment 928.0 379.83 0.3276 651.0 -33.719 -0.0273 0.2123 0.6459 2060151 BSPBio_001780 COC(=O)[C@@H]1OC(=O)C2OC23[C@@]1(C)CCC4[C@@]5(C)[C@H](C[C@@H](OC(=O)C)C(C)(C)C5C[C@H](O)[C@]43C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I23 mock treatment 1160.0 611.83 0.5277 768.0 83.281 0.0675 0.4208 0.7911 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 I24 mock treatment 273.0 -275.17 -0.2373 364.0 -320.72 -0.2598 -0.3515 -0.999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J01 mock treatment 165.0 -383.17 -0.3305 383.0 -301.72 -0.2444 -0.4065 -0.989 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J02 mock treatment 392.0 -156.17 -0.1347 697.0 12.281 0.0099 -0.0882 -0.6531 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J03 compound treatment 1.0 -547.17 -0.4719 6.0 -678.72 -0.5498 -0.7225 -0.9971 1092958 BSPBio_001781 COC1=CC(=O)C(=CC1=O)C(C=C)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J04 compound treatment 667.0 118.83 0.1025 808.0 123.28 0.0999 0.1431 0.9999 883 BSPBio_001782 CC(Oc1ccccc1)C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J05 compound treatment 518.0 -30.175 -0.026 692.0 7.2813 0.0059 -0.0142 -0.5333 2060102 BSPBio_001783 COc1ccc2C(=O)c3cc(OC)c(OC)cc3CC(=O)COc2c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J06 compound treatment 50.0 -498.17 -0.4297 116.0 -568.72 -0.4607 -0.6296 -0.9994 811 BSPBio_001784 CC(=O)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J07 compound treatment 4.0 -544.17 -0.4693 2.0 -682.72 -0.5531 -0.723 -0.9967 2060397 BSPBio_001785 COc1ccc2C(=O)/C(=C/c3ccc(OC)c(O)c3)/COc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J08 compound treatment 341.0 -207.17 -0.1787 940.0 255.28 0.2068 0.0199 0.0728 1267 BSPBio_001786 CC(=O)Nc1ccc(O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J09 compound treatment 8.0 -540.17 -0.4659 0.0 -684.72 -0.5547 -0.7217 -0.9962 2069309 BSPBio_001787 COc1cc2OC[C@H]3Oc4c5CCC(C)(C)Oc5ccc4C(=O)[C@H]3c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J10 compound treatment 548.0 -0.1746 -2.0E-4 515.0 -169.72 -0.1375 -0.0973 -0.7079 692 BSPBio_001788 CC(=O)Nc1nnc(s1)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J11 compound treatment 730.0 181.83 0.1568 642.0 -42.719 -0.0346 0.0864 0.5381 3198310 BSPBio_001789 COc1ccc([C@H]2COc3c(OC)c(O)ccc3C2)c(OC)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J12 compound treatment 947.0 398.83 0.344 1042.0 357.28 0.2894 0.4479 0.9963 1414 BSPBio_001790 CC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J13 compound treatment 75.0 -473.17 -0.4081 183.0 -501.72 -0.4064 -0.576 -1.0 2069276 BSPBio_001791 COc1cc(cc(OCc2ccccc2)c1OC)c3coc4cc(OCc5ccccc5)c(OC)c(O)c4c3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J14 compound treatment 889.0 340.83 0.2939 836.0 151.28 0.1226 0.2945 0.9248 1293 BSPBio_001792 CC(=O)OCC[N+](C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J15 compound treatment 118.0 -430.17 -0.371 162.0 -522.72 -0.4235 -0.5618 -0.9978 2069255 BSPBio_001793 Oc1cc(cc(O)c1O)c2coc3cc(O)c(O)c(O)c3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J16 compound treatment 671.0 122.83 0.1059 1098.0 413.28 0.3348 0.3116 0.8875 1001897 BSPBio_001794 CC(=O)N[C@@H](CS)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J17 compound treatment 1040.0 491.83 0.4242 1580.0 895.28 0.7253 0.8128 0.9674 2060249 BSPBio_001795 COc1ccc(cc1)c2coc3c(OC)c(O)ccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J18 compound treatment 1010.0 461.83 0.3983 947.0 262.28 0.2125 0.4319 0.9567 418 BSPBio_001796 Nc1ncnc2n(cnc12)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J19 compound treatment 558.0 9.8254 0.0085 634.0 -50.719 -0.0411 -0.0231 -0.5497 1050602 BSPBio_001797 COc1ccc(CC(=O)c2ccc(O)cc2O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J20 compound treatment 788.0 239.83 0.2068 781.0 96.281 0.078 0.2014 0.9111 1292 BSPBio_001798 O=c1[nH]cnc2[nH]ncc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J21 compound treatment 3.0 -545.17 -0.4702 30.0 -654.72 -0.5304 -0.7075 -0.9982 3055248 BSPBio_001799 C=CC(C1=CC(=O)C=CC1=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J22 compound treatment 201.0 -347.17 -0.2994 187.0 -497.72 -0.4032 -0.4968 -0.9893 3256 BSPBio_001800 CCN(CCCc1ccccc1)CCCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J23 mock treatment 478.0 -70.175 -0.0605 1105.0 420.28 0.3405 0.198 0.5724 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 J24 mock treatment 306.0 -242.17 -0.2089 722.0 37.281 0.0302 -0.1263 -0.5986 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K01 mock treatment 608.0 59.825 0.0516 654.0 -30.719 -0.0249 0.0189 0.3297 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K02 mock treatment 438.0 -110.17 -0.095 871.0 186.28 0.1509 0.0395 0.2216 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K03 compound treatment 259.0 -289.17 -0.2494 373.0 -311.72 -0.2525 -0.3549 -1.0 2060154 BSPBio_001801 CC(=O)O[C@H]1CC[C@@]2(C)C(C[C@@H](OC(=O)C)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C=C43)c5ccoc5)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K04 compound treatment 223.0 -325.17 -0.2804 1213.0 528.28 0.428 0.1043 0.2039 2060402 BSPBio_001802 COc1ccc2CC[C@H]3CC(=O)CC[C@]3(C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K05 compound treatment 69.0 -479.17 -0.4133 134.0 -550.72 -0.4461 -0.6077 -0.9993 2060037 BSPBio_001803 CC(=O)O[C@@H]1CC[C@@]2(C)C(C[C@@H](OC(=O)C)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C=C43)c5ccoc5)C1(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K06 compound treatment 95.0 -453.17 -0.3908 289.0 -395.72 -0.3206 -0.5031 -0.9952 2060153 BSPBio_001804 COc1cccc2c1CCC3=CC(=O)CC[C@@]32C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K07 compound treatment 29.0 -519.17 -0.4478 8.0 -676.72 -0.5482 -0.7043 -0.995 2060160 BSPBio_001805 CC(=O)O[C@@H]1CC2C(C)(C)CCC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4[C@]13C)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K08 compound treatment 0.0 -548.17 -0.4728 0.0 -684.72 -0.5547 -0.7265 -0.9968 2060408 BSPBio_001806 COC(=O)C[C@H]1C(C)(C)[C@H](C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CCC(C3=C)[C@]12C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K09 compound treatment 883.0 334.83 0.2888 918.0 233.28 0.189 0.3378 0.9789 2060162 BSPBio_001807 COC(=O)C[C@H]1C(C)(C)[C@@H](O)[C@@H]2CC3=C4C=C(OC)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K10 compound treatment 866.0 317.83 0.2741 828.0 143.28 0.1161 0.2759 0.9269 2060157 BSPBio_001808 CC(=O)C1CCC2C3CCC4C[C@H](O)CCC4(C)C3C[C@H](O)C12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K11 compound treatment 431.0 -117.17 -0.1011 246.0 -438.72 -0.3554 -0.3228 -0.8735 2060177 BSPBio_001809 CC1(C)C2C[C@@H](O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)C5OC543)c6ccoc6)[C@@]2(C)[C@H]7O[C@H]7C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K12 compound treatment 667.0 118.83 0.1025 696.0 11.281 0.0091 0.0789 0.7671 2060159 BSPBio_001810 COC(=O)[C@@H]1OC(=O)C2OC23[C@@]1(C)CCC4[C@@]5(C)CCC(=O)C(C)(C)C5C[C@@H](OC(=O)C)[C@]43C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K13 compound treatment 106.0 -442.17 -0.3814 153.0 -531.72 -0.4308 -0.5742 -0.9982 2060179 BSPBio_001811 COc1cccc2c1CCC3CC(=O)CC[C@@]32C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K14 compound treatment 504.0 -44.175 -0.0381 398.0 -286.72 -0.2323 -0.1912 -0.8122 3078271 BSPBio_001812 COC(=O)C[C@H]1C(C)(C)[C@H](O)C[C@@H]2O[C@@]34CC(=O)O[C@@H](c5ccoc5)[C@]4(C)CC[C@H](C3=C)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K15 compound treatment 574.0 25.825 0.0223 279.0 -405.72 -0.3287 -0.2167 -0.6577 2060320 BSPBio_001813 COc1ccc2CC[C@@H]3CC(=O)CC[C@]3(C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K16 compound treatment 1870.0 1321.8 1.14 27.0 -657.72 -0.5328 0.4294 0.3412 2060429 BSPBio_001814 COC1CC(O[C@H]2CC[C@]3(C=O)C4CC[C@]5(C)C(CC[C@]5(O)C4CC[C@]3(O)C2)C6=CC(=O)OC6)OC(C)C1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K17 compound treatment 816.0 267.83 0.231 15.0 -669.72 -0.5425 -0.2203 -0.3736 3173369 BSPBio_001815 CC(C)c1c(OC(=O)C)ccc2c1CCC3C(C)(C)CCC[C@@]32C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K18 compound treatment 297.0 -251.17 -0.2166 62.0 -622.72 -0.5045 -0.5099 -0.9287 2060184 BSPBio_001816 CC1CCc2c(O)c3c(=O)cc(C)oc3cc2OC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K19 compound treatment 7.0 -541.17 -0.4667 2.0 -682.72 -0.5531 -0.7211 -0.9964 3172856 BSPBio_001817 O[C@H]1C=C2CCN3Cc4cc5OCOc5cc4C(C32)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K20 compound treatment 74.0 -474.17 -0.409 10.0 -674.72 -0.5466 -0.6757 -0.9898 2060185 BSPBio_001818 COc1ccc2[C@@H]3COc4cc(OC)ccc4[C@@H]3Oc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K21 compound treatment 46.0 -502.17 -0.4331 94.0 -590.72 -0.4785 -0.6446 -0.9988 2060034 BSPBio_001819 CC(C)c1c(O)ccc2c1CCC3[C@](C)(CCC[C@@]32C)C=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K22 compound treatment 607.0 58.825 0.0507 84.0 -600.72 -0.4867 -0.3082 -0.63 2060186 BSPBio_001820 CC(=O)OC1CCC2(C3CCC4(C)C(CCC54OC2=O)C6=CC(=O)OC6)C(O)(CCC35)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K23 mock treatment 639.0 90.825 0.0783 71.0 -613.72 -0.4972 -0.2962 -0.5884 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 K24 mock treatment 710.0 161.83 0.1396 32.0 -652.72 -0.5288 -0.2752 -0.5032 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L01 mock treatment 298.0 -250.17 -0.2158 478.0 -206.72 -0.1675 -0.271 -0.9922 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L02 mock treatment 307.0 -241.17 -0.208 781.0 96.281 0.078 -0.0919 -0.4138 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L03 compound treatment 29.0 -519.17 -0.4478 19.0 -665.72 -0.5393 -0.698 -0.9957 2060494 BSPBio_001821 COc1ccc2C(=O)C(Cc3ccc(OC)c(OC)c3)COc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L04 compound treatment 837.0 288.83 0.2491 895.0 210.28 0.1704 0.2966 0.9828 1408 BSPBio_001822 NC1(CC2CC3CC(C2)C1)C3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L05 compound treatment 76.0 -472.17 -0.4072 678.0 -6.7188 -0.0054 -0.2918 -0.7165 2060110 BSPBio_001823 COc1ccc(c(OC)c1)c2coc3cc(O)ccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L06 compound treatment 797.0 248.83 0.2146 544.0 -140.72 -0.114 0.0711 0.2927 3173722 BSPBio_001824 NCC[C@@H](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]2O)[C@H](O)[C@H]1O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)C3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L07 compound treatment 107.0 -441.17 -0.3805 102.0 -582.72 -0.4721 -0.6029 -0.9943 1004 BSPBio_001825 Oc1ccc2c(=O)cc(oc2c1O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L08 compound treatment 458.0 -90.175 -0.0778 526.0 -158.72 -0.1286 -0.1459 -0.971 1000042 BSPBio_001826 NC(=N)NC(=O)c1nc(Cl)c(N)nc1N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L09 compound treatment 160.0 -388.17 -0.3348 163.0 -521.72 -0.4227 -0.5356 -0.9933 3054809 BSPBio_001827 COc1ccc2C(=O)C(Cc3ccc(OC)c(OC(=O)C)c3)COc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L10 compound treatment 613.0 64.825 0.0559 889.0 204.28 0.1655 0.1566 0.8962 1381 BSPBio_001828 Nc1ccc(cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L11 compound treatment 465.0 -83.175 -0.0717 98.0 -586.72 -0.4753 -0.3868 -0.8047 2060139 BSPBio_001829 COc1ccc([C@@H]2COc3c(OC)c(OC)ccc3C2)c(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L12 compound treatment 243.0 -305.17 -0.2632 197.0 -487.72 -0.3951 -0.4655 -0.9805 1503 BSPBio_001830 Cc1c(CS(=O)c2nc3ccccc3[nH]2)nccc1OCC(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L13 compound treatment 6.0 -542.17 -0.4676 5.0 -679.72 -0.5506 -0.72 -0.9967 3173749 BSPBio_001831 COc1cc2OC[C@H]3Oc4c5CC(Oc5ccc4C(=O)[C@H]3c2cc1OC)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L14 compound treatment 148.0 -400.17 -0.3451 142.0 -542.72 -0.4397 -0.5549 -0.9928 1469 BSPBio_001832 CCC1(CCC(=O)NC1=O)c2ccc(N)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L15 compound treatment 366.0 -182.17 -0.1571 136.0 -548.72 -0.4445 -0.4254 -0.9023 1008719 BSPBio_001833 COC(=O)C(O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L16 compound treatment 869.0 320.83 0.2767 960.0 275.28 0.223 0.3533 0.9943 985 BSPBio_001834 Nc1ccc(C(=O)O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L17 compound treatment 2.0 -546.17 -0.4711 1.0 -683.72 -0.5539 -0.7247 -0.9967 2060163 BSPBio_001835 COc1ccc2C(=O)[C@@H]3[C@@H](COc4cc(OC)c(OC)cc34)Oc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L18 compound treatment 2.0 -546.17 -0.4711 0.0 -684.72 -0.5547 -0.7253 -0.9967 1365 BSPBio_001836 CN(C)CCC=C1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L19 compound treatment 46.0 -502.17 -0.4331 83.0 -601.72 -0.4875 -0.6509 -0.9983 2060165 BSPBio_001837 COc1cc2OCc3oc4c5CC(Oc5ccc4c(=O)c3-c2cc1OC)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L20 compound treatment 75.0 -473.17 -0.4081 63.0 -621.72 -0.5037 -0.6447 -0.9946 1294 BSPBio_001838 CCN(CC)Cc1ccc(Nc2ccnc3cc(Cl)ccc23)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L21 compound treatment 621.0 72.825 0.0628 653.0 -31.719 -0.0257 0.0262 0.3867 2069225 BSPBio_001839 Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c4cc(O)c(O)c5c(=O)c(O)cc(cc45)[C@H]6Oc7cc(O)cc(O)c7C[C@H]6OC(=O)c8cc(O)c(O)c(O)c8 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L22 compound treatment 847.0 298.83 0.2577 551.0 -133.72 -0.1083 0.1056 0.3779 3045196 BSPBio_001840 CC1(C)S[C@@H]2[C@H](NC(=O)[C@@H](N)c3ccc(O)cc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L23 mock treatment 399.0 -149.17 -0.1287 748.0 63.281 0.0513 -0.0547 -0.3951 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 L24 mock treatment 1084.0 535.83 0.4621 340.0 -344.72 -0.2793 0.1293 0.2395 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M01 mock treatment 795.0 246.83 0.2129 680.0 -4.7188 -0.0038 0.1478 0.6943 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M02 mock treatment 313.0 -235.17 -0.2028 985.0 300.28 0.2433 0.0286 0.0903 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M03 compound treatment 0.0 -548.17 -0.4728 0.0 -684.72 -0.5547 -0.7265 -0.9968 2060126 BSPBio_001841 CC(C)c1c(O)ccc2c1CCC3[C@@](C)(CO)CCC[C@@]32C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M04 compound treatment 419.0 -129.17 -0.1114 722.0 37.281 0.0302 -0.0574 -0.4975 2060446 BSPBio_001842 CC1(C)[C@@H](O)C=C[C@@]2(C)C1CC(=O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]543)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M05 compound treatment 7.0 -541.17 -0.4667 7.0 -677.72 -0.549 -0.7183 -0.9967 3053987 BSPBio_001843 CC(=O)C1CC[C@H]2C3CC[C@H]4C[C@H](O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M06 compound treatment 204.0 -344.17 -0.2968 136.0 -548.72 -0.4445 -0.5242 -0.9807 2060370 BSPBio_001844 COc1cc2OCOc2cc1c3coc4c5C=CC(C)(C)Oc5c(OC)cc4c3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M07 compound treatment 0.0 -548.17 -0.4728 0.0 -684.72 -0.5547 -0.7265 -0.9968 3173992 BSPBio_001845 CC(C)c1c(O)ccc2c1CCC3C(C)(C)CCC[C@@]32C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M08 compound treatment 115.0 -433.17 -0.3736 396.0 -288.72 -0.2339 -0.4296 -0.9746 907 BSPBio_001846 OC(=O)c1cc(O)c2cccc(O)c2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M09 compound treatment 358.0 -190.17 -0.164 598.0 -86.719 -0.0703 -0.1657 -0.9284 2060357 BSPBio_001847 CC(=O)O[C@@H]1CC2C(C)(C)CCC(=O)[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C5OC54[C@]13C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M10 compound treatment 298.0 -250.17 -0.2158 498.0 -186.72 -0.1513 -0.2595 -0.9849 2060420 BSPBio_001848 CC(=O)O[C@@H]1CC2C(C)(C)[C@@H](O)CCC2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C=C4C13C)c5ccoc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M11 compound treatment 673.0 124.83 0.1077 664.0 -20.719 -0.0168 0.0643 0.5897 2060280 BSPBio_001849 C[C@H]1C2C(CC3C4CC[C@H]5C[C@H](CC[C@]5(C)C4CC[C@]23C)OC(=O)C)O[C@]61CCC(C)CO6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M12 compound treatment 425.0 -123.17 -0.1062 399.0 -285.72 -0.2315 -0.2388 -0.9376 1111461 BSPBio_001850 CC(=CCOc1c2occc2cc3ccc(=O)oc13)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M13 compound treatment 1162.0 613.83 0.5294 1673.0 988.28 0.8006 0.9405 0.9798 3174366 BSPBio_001851 C[C@H]1C2C(CC3C4CC[C@@H]5C[C@H](CC[C@]5(C)C4CC[C@]23C)OC(=O)C)O[C@]61CCC(C)CO6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M14 compound treatment 963.0 414.83 0.3578 1280.0 595.28 0.4822 0.594 0.9892 3174000 BSPBio_001852 C[C@H]1[C@H]2[C@H](CC3C4CC[C@@H]5C[C@@H](O)CC[C@]5(C)C4CC[C@]23C)O[C@@]61CCC(C)CO6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M15 compound treatment 830.0 281.83 0.2431 842.0 157.28 0.1274 0.262 0.9546 3173115 BSPBio_001853 C[C@H]1[C@H]2[C@H](CC3C4CC[C@H]5C[C@@H](O)CC[C@]5(C)C4CC[C@]23C)O[C@]61CCC(C)CN6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M16 compound treatment 1234.0 685.83 0.5915 1533.0 848.28 0.6872 0.9042 0.9972 3173615 BSPBio_001854 CCC(CCC(C)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M17 compound treatment 663.0 114.83 0.099 947.0 262.28 0.2125 0.2203 0.9396 2060351 BSPBio_001855 C[C@H]1[C@H]2[C@H](CC3C4CC[C@H]5C[C@H](CC[C@]5(C)C4=CC(=O)[C@]23C)OC(=O)C)OC61OCC(C)CC6Br 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M18 compound treatment 734.0 185.83 0.1603 250.0 -434.72 -0.3522 -0.1357 -0.3507 2060206 BSPBio_001856 CCC(CCC(C)C1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(=O)C)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M19 compound treatment 468.0 -80.175 -0.0691 755.0 70.281 0.0569 -0.0086 -0.0964 2060188 BSPBio_001857 C[C@H]1C2C(CC3C4CCC5C[C@@H](O)CCC5(C)C4=CCC23C)OC61CCC(C)CO6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M20 compound treatment 647.0 98.825 0.0852 801.0 116.28 0.0942 0.1269 0.9988 2069259 BSPBio_001858 C[C@@]12CCC3C(CC[C@H]4C[C@H](O)CC[C@@]43C)C2CC[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M21 compound treatment 186.0 -362.17 -0.3124 169.0 -515.72 -0.4178 -0.5163 -0.9897 3173999 BSPBio_001859 C[C@H]1C2C(CC3C4CC[C@H]5CC(CCC5(C)C4CC(=O)C23C)OC(=O)C)OC61CCC(C)CO6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M22 compound treatment 727.0 178.83 0.1542 533.0 -151.72 -0.1229 0.0221 0.1123 2069264 BSPBio_001860 C[C@@]12CCC3C(CC[C@H]4C[C@@H](O)CC[C@@]43C)C2CC[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M23 mock treatment 626.0 77.825 0.0671 896.0 211.28 0.1712 0.1685 0.9165 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 M24 mock treatment 218.0 -330.17 -0.2848 589.0 -95.719 -0.0775 -0.2562 -0.868 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N01 mock treatment 426.0 -122.17 -0.1054 639.0 -45.719 -0.037 -0.1007 -0.9016 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N02 mock treatment 462.0 -86.175 -0.0743 1026.0 341.28 0.2765 0.1429 0.4993 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N03 compound treatment 7.0 -541.17 -0.4667 21.0 -663.72 -0.5377 -0.7102 -0.9975 3173879 BSPBio_001861 CC(=CCc1c2OC(C)(C)C=Cc2c(OC(=O)C)c3c(=O)c(OC(=O)C)c(oc13)c4ccccc4)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N04 compound treatment 0.0 -548.17 -0.4728 2058.0 1373.3 1.1125 0.4524 0.3742 1092 BSPBio_001862 CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N05 compound treatment 455.0 -93.175 -0.0804 687.0 2.2813 0.0018 -0.0555 -0.6907 2060495 BSPBio_001863 O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3cc(O)c(O)c(O)c3c4c(O)c(O)c(O)cc4[C@H]5Oc6cc(O)cc(O)c6C[C@H]5OC(=O)c7cc(O)c(O)c(O)c7 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N06 compound treatment 570.0 21.825 0.0188 953.0 268.28 0.2173 0.167 0.7655 807 BSPBio_001864 CCCc1ncc(C[n+]2ccccc2C)c(N)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N07 compound treatment 838.0 289.83 0.25 471.0 -213.72 -0.1731 0.0543 0.1787 2060167 BSPBio_001865 COC(=O)c1cc(O)c(=O)c2c(O)c(O)ccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N08 compound treatment 400.0 -148.17 -0.1278 265.0 -419.72 -0.34 -0.3308 -0.9107 746 BSPBio_001866 C(N(Cc1ccccc1)c2ccccc2)C3=NCCN3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N09 compound treatment 664.0 115.83 0.0999 549.0 -135.72 -0.1099 -0.0071 -0.0479 3173852 BSPBio_001867 COc1ccc(CCC(=O)c2c(O)cc(O[C@@H]3O[C@H](CO)C(O)[C@H](O)C3O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)cc2O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N10 compound treatment 1133.0 584.83 0.5044 972.0 287.28 0.2327 0.5212 0.9383 696 BSPBio_001868 Oc1cccc2Cc3cccc(O)c3C(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N11 compound treatment 4.0 -544.17 -0.4693 4.0 -680.72 -0.5515 -0.7218 -0.9968 1017609 BSPBio_001869 CC(=CCc1c(O)c2c(=O)c(coc2c3C=CC(C)(C)Oc13)c4ccc(O)cc4)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N12 compound treatment 677.0 128.83 0.1111 1230.0 545.28 0.4417 0.3909 0.8582 1108 BSPBio_001870 Cc1cc(=O)n(c2ccccc2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N13 compound treatment 1155.0 606.83 0.5234 1163.0 478.28 0.3875 0.644 0.9891 2069293 BSPBio_001871 CCc1ccc2c(O)c3C(=O)c4c(O)ccc(O)c4C(=O)c3cc2c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N14 compound treatment 30.0 -518.17 -0.4469 20.0 -664.72 -0.5385 -0.6968 -0.9957 1011303 BSPBio_001872 CN1CCc2cccc-3c2C1Cc4ccc(O)c(O)c43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N15 compound treatment 311.0 -237.17 -0.2046 203.0 -481.72 -0.3902 -0.4206 -0.9546 2069330 BSPBio_001873 COc1cc(O)c(C(=O)/C=C/c2ccccc2)c(OC)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N16 compound treatment 662.0 113.83 0.0982 1335.0 650.28 0.5268 0.4419 0.8247 1000124 BSPBio_001874 CN1C2CCC1CC(C2)OC(=O)C(CO)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N17 compound treatment 871.0 322.83 0.2784 928.0 243.28 0.1971 0.3362 0.9857 3055218 BSPBio_001875 OCC(O)[C@H]1OC(=O)C(=C1O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N18 compound treatment 789.0 240.83 0.2077 895.0 210.28 0.1704 0.2673 0.9952 1198 BSPBio_001876 Cn1cnc([N+](=O)[O-])c1Sc2[nH]cnc3ncnc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N19 compound treatment 8.0 -540.17 -0.4659 23.0 -661.72 -0.5361 -0.7085 -0.9976 3177523 BSPBio_001877 CC[C@@]1(O)C[C@H](O[C@H]2C[C@@H]([C@H](O)[C@H](C)O2)N(C)C)c3c(O)c4C(=O)c5c(O)ccc(O)c5C(=O)c4cc3[C@H]1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N20 compound treatment 1350.0 801.83 0.6915 1032.0 347.28 0.2813 0.6879 0.9214 1368 BSPBio_001878 CCC(C)C(N)C1=NC(CS1)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)O)C(=O)NC(C(C)CC)C(=O)NCCCCC2NC(=O)C(CC(=O)N)NC(=O)C(CC(=O)O)NC(=O)C(Cc3c[nH]cn3)NC(=O)C(Cc4ccccc4)NC(=O)C(NC(=O)C(CCCN)NC2=O)C(C)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N21 compound treatment 775.0 226.83 0.1956 485.0 -199.72 -0.1618 0.0239 0.0942 2069308 BSPBio_001879 CC(=CCc1c(O)cc2occ(c3ccc4OCOc4c3)c(=O)c2c1O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N22 compound treatment 751.0 202.83 0.1749 717.0 32.281 0.0262 0.1422 0.8039 678 BSPBio_001880 NCC(CC(=O)O)c1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N23 mock treatment 475.0 -73.175 -0.0631 942.0 257.28 0.2084 0.1028 0.4718 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 N24 mock treatment 871.0 322.83 0.2784 509.0 -175.72 -0.1424 0.0962 0.3077 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O01 mock treatment 747.0 198.83 0.1715 737.0 52.281 0.0424 0.1512 0.856 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O02 mock treatment 240.0 -308.17 -0.2658 313.0 -371.72 -0.3011 -0.4009 -0.9981 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O03 compound treatment 683.0 134.83 0.1163 647.0 -37.719 -0.0306 0.0606 0.5042 3054097 BSPBio_001881 C[C@H]1[C@H]2[C@H](CC3C4CC[C@H]5C[C@@H](O)CC[C@]5(C)C4CC[C@]23C)O[C@@]61CC[C@@H](C)CO6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O04 compound treatment 171.0 -377.17 -0.3253 122.0 -562.72 -0.4559 -0.5524 -0.9863 2069265 BSPBio_001882 C[C@@]12CCC3C(CC[C@H]4CC(=O)CC[C@@]43C)C2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O05 compound treatment 3.0 -545.17 -0.4702 2.0 -682.72 -0.5531 -0.7236 -0.9967 BSPBio_001883 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O06 compound treatment 1.0 -547.17 -0.4719 0.0 -684.72 -0.5547 -0.7259 -0.9968 3058740 BSPBio_001884 CC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CCC3C4CCC(=O)[C@@]4(C)CCC32)C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O07 compound treatment 404.0 -144.17 -0.1243 520.0 -164.72 -0.1334 -0.1823 -0.9994 1355 BSPBio_001885 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O08 compound treatment 636.0 87.825 0.0757 632.0 -52.719 -0.0427 0.0234 0.2687 2060178 BSPBio_001886 CC12C[C@@H](O)C3C(CCC4CC(O)CCC43C)C2(O)CCC1C5=CC(=O)OC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O09 compound treatment 556.0 7.8254 0.0067 480.0 -204.72 -0.1658 -0.1125 -0.6778 2060207 BSPBio_001887 CC1(C)[C@H](O)C[C@H](O)[C@@]2(C)C1CC(=O)[C@]3(C)C2CC[C@@]4(C)[C@@H](OC(=O)C5OC543)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O10 compound treatment 354.0 -194.17 -0.1675 8.0 -676.72 -0.5482 -0.5061 -0.8828 1010376 BSPBio_001888 Oc1ccc2C3c4cc(O)c(O)cc4CC3(O)COc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O11 compound treatment 466.0 -82.175 -0.0709 416.0 -268.72 -0.2177 -0.204 -0.8913 724 BSPBio_001889 CCn1cc(C(=O)O)c(=O)c2ccc(C)nc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O12 compound treatment 0.0 -548.17 -0.4728 2.0 -682.72 -0.5531 -0.7254 -0.997 2060216 BSPBio_001890 COc1cc2OC[C@H]3Oc4c(ccc5oc(cc45)C(C)C)C(=O)[C@H]3c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O13 compound treatment 270.0 -278.17 -0.2399 472.0 -212.72 -0.1723 -0.2915 -0.9868 2060208 BSPBio_001891 COC(=O)C[C@H]1C(C)(C)[C@@H](O)[C@@H]2CC3=C4CC(O)O[C@@H](c5ccoc5)[C@]4(C)CCC3[C@@]1(C)C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O14 compound treatment 122.0 -426.17 -0.3676 0.0 -684.72 -0.5547 -0.6521 -0.98 1288 BSPBio_001892 CC[C@@]1(O)C[C@H](O[C@H]2C[C@@H]([C@H](O)[C@H](C)O2)N(C)C)c3c(O)c4C(=O)c5c(O)cccc5C(=O)c4cc3[C@H]1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O15 compound treatment 33.0 -515.17 -0.4443 40.0 -644.72 -0.5223 -0.6835 -0.9968 3054136 BSPBio_001893 CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C2C1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O16 compound treatment 763.0 214.83 0.1853 999.0 314.28 0.2546 0.311 0.9878 3173106 BSPBio_001894 COC(=O)c1c(C)c2Oc3c(Cl)c(O)c(Cl)c(C)c3C(=O)Oc2c(C)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O17 compound treatment 53.0 -495.17 -0.4271 107.0 -577.72 -0.468 -0.6329 -0.999 3650169 BSPBio_001895 CC1(C)C2CC(=O)[C@]3(C)C(CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]543)c6ccoc6)[C@@]2(C)[C@H]7O[C@H]7C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O18 compound treatment 3.0 -545.17 -0.4702 7.0 -677.72 -0.549 -0.7207 -0.997 1527 BSPBio_001896 COc1cc2OC[C@H]3Oc4c5C[C@@H](Oc5ccc4C(=O)[C@H]3c2cc1OC)C(=C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O19 compound treatment 1344.0 795.83 0.6864 443.0 -241.72 -0.1958 0.3469 0.486 2069251 BSPBio_001897 CC(=O)O[C@@H]1CC2C(C)(C)[C@H](O)C[C@H](O)[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)[C@H]5O[C@]54[C@]13C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O20 compound treatment 325.0 -223.17 -0.1925 449.0 -235.72 -0.191 -0.2711 -1.0 2060234 BSPBio_001898 COC(=O)c1c(C)c2Oc3c(Cl)c(O)c(Cl)c(C)c3C(=O)Oc2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O21 compound treatment 3.0 -545.17 -0.4702 14.0 -670.72 -0.5434 -0.7167 -0.9974 2060291 BSPBio_001899 CC(=O)O[C@@H]1CC2C(C)(C)[C@H](O)CC[C@]2(C)C3CC[C@@]4(C)[C@@H](OC(=O)C5OC54[C@]13C)c6ccoc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O22 compound treatment 729.0 180.83 0.156 1171.0 486.28 0.3939 0.3888 0.9177 1051460 BSPBio_001900 COc1cc(C(=O)O)c2Oc3c(C=O)c(O)cc(C)c3C(=O)Oc2c1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O23 mock treatment 664.0 115.83 0.0999 620.0 -64.719 -0.0524 0.0336 0.2975 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 O24 mock treatment 117.0 -431.17 -0.3719 337.0 -347.72 -0.2817 -0.4621 -0.9906 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P01 mock treatment 103.0 -445.17 -0.3839 288.0 -396.72 -0.3214 -0.4987 -0.9961 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P02 mock treatment 170.0 -378.17 -0.3262 601.0 -83.719 -0.0678 -0.2786 -0.8363 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P03 compound treatment 197.0 -351.17 -0.3029 183.0 -501.72 -0.4064 -0.5016 -0.9895 2060335 BSPBio_001901 Oc1ccc2C3Oc4cc5OCOc5cc4C3COc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P04 compound treatment 511.0 -37.175 -0.0321 617.0 -67.719 -0.0549 -0.0615 -0.9673 834 BSPBio_001902 CC(C[N+](C)(C)C)OC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P05 compound treatment 462.0 -86.175 -0.0743 645.0 -39.719 -0.0322 -0.0753 -0.9298 3173998 BSPBio_001903 CC(=O)O[C@@H]1C2CC[C@@H]3C1(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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P06 compound treatment 259.0 -289.17 -0.2494 247.0 -437.72 -0.3546 -0.4271 -0.9852 1095 BSPBio_001904 NC(CO)C(=O)NNCc1ccc(O)c(O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P07 compound treatment 0.0 -548.17 -0.4728 5.0 -679.72 -0.5506 -0.7237 -0.9971 2114344 BSPBio_001905 CC1=C(O)C(=O)C=C2C1=CC=C3[C@@]2(C)CC[C@@]4(C)[C@@H]5C[C@@](C)(CC[C@]5(C)CC[C@]34C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P08 compound treatment 0.0 -548.17 -0.4728 0.0 -684.72 -0.5547 -0.7265 -0.9968 1373 BSPBio_001906 CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P09 compound treatment 103.0 -445.17 -0.3839 88.0 -596.72 -0.4834 -0.6133 -0.9935 3054028 BSPBio_001907 CC(CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)C4(C)CC[C@H](O)C(C)(C)C4CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P10 compound treatment 230.0 -318.17 -0.2744 217.0 -467.72 -0.3789 -0.462 -0.9874 1513 BSPBio_001908 CCOC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P11 compound treatment 336.0 -212.17 -0.183 482.0 -202.72 -0.1642 -0.2455 -0.9985 2069246 BSPBio_001909 Cc1cc(O)c(C=O)c2Oc3c4C(O)OC(=O)c4c(O)c(C)c3OC(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P12 compound treatment 484.0 -64.175 -0.0553 408.0 -276.72 -0.2242 -0.1977 -0.856 1114 BSPBio_001910 NS(=O)(=O)c1cc2c(N=C(CSCc3ccccc3)NS2(=O)=O)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P13 compound treatment 226.0 -322.17 -0.2779 341.0 -343.72 -0.2785 -0.3934 -1.0 2060194 BSPBio_001911 COc1cc(O)c(C(=O)O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P14 compound treatment 63.0 -485.17 -0.4184 116.0 -568.72 -0.4607 -0.6217 -0.9988 1141 BSPBio_001912 CN1C2CCC1CC(C2)OC(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P15 compound treatment 21.0 -527.17 -0.4547 43.0 -641.72 -0.5199 -0.6891 -0.9978 2060411 BSPBio_001913 O[C@H]1Cc2ccc(O)cc2O[C@@H]1c3ccc(O)c(O)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P16 compound treatment 100.0 -448.17 -0.3865 120.0 -564.72 -0.4575 -0.5968 -0.9965 3177311 BSPBio_001914 C[C@H]1CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P17 compound treatment 28.0 -520.17 -0.4486 62.0 -622.72 -0.5045 -0.6739 -0.9983 3198309 BSPBio_001915 CC(=O)OCC(O)CC(O)CCCCCCCCCCCC=C.CC(=O)OCC(O)CC(O)CCCCCCCCCCCC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P18 compound treatment 512.0 -36.175 -0.0312 579.0 -105.72 -0.0856 -0.0826 -0.9064 982 BSPBio_001916 CC(=O)Oc1ccc(cc1)C(c2ccc(OC(=O)C)cc2)c3ccccn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P19 compound treatment 168.0 -380.17 -0.3279 209.0 -475.72 -0.3854 -0.5044 -0.9968 2060203 BSPBio_001917 CCOC(=O)c1c(C)cc(O)c(C)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P20 compound treatment 472.0 -76.175 -0.0657 519.0 -165.72 -0.1343 -0.1414 -0.9459 1247 BSPBio_001918 Oc1c(Cl)cc(Cl)cc1Sc2cc(Cl)cc(Cl)c2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P21 compound treatment 192.0 -356.17 -0.3072 345.0 -339.72 -0.2752 -0.4118 -0.9985 1253 BSPBio_001919 C[C@H]1OC=C2C(=C(C(=O)O)C(=O)C(=C2[C@@H]1C)C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P22 compound treatment 771.0 222.83 0.1922 780.0 95.281 0.0772 0.1905 0.9197 1437 BSPBio_001920 CS(=O)(=O)OCCCCOS(=O)(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P23 mock treatment 244.0 -304.17 -0.2623 627.0 -57.719 -0.0468 -0.2186 -0.8202 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2458 P24 mock treatment 1407.0 858.83 0.7407 347.0 -337.72 -0.2736 0.3303 0.4183 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A01 mock treatment 1969.0 179.25 0.1546 1673.0 231.72 0.1877 0.2421 0.9953 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A02 mock treatment 1702.0 -87.754 -0.0757 1579.0 137.72 0.1116 0.0254 0.1882 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A03 compound treatment 1650.0 -139.75 -0.1205 1952.0 510.72 0.4137 0.2073 0.4811 451 BSPBio_001921 Cn1cnc2n(C)c(=O)n(C)c(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A04 compound treatment 1308.0 -481.75 -0.4155 1150.0 -291.28 -0.236 -0.4607 -0.9641 1441 BSPBio_001922 CN1CCC(CC1)OC(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A05 compound treatment 2568.0 778.25 0.6712 2678.0 1236.7 1.0019 1.1831 0.981 1326 BSPBio_001923 CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A06 compound treatment 1635.0 -154.75 -0.1335 1988.0 546.72 0.4429 0.2188 0.473 1301 BSPBio_001924 OCCN(CCO)c1nc(N2CCCCC2)c3nc(nc(N4CCCCC4)c3n1)N(CCO)CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A07 compound treatment 1679.0 -110.75 -0.0955 2339.0 897.72 0.7273 0.4467 0.609 3177464 BSPBio_001925 NCCCC(N)CC(=O)NCC1NC(=O)C(CO)NC(=O)C(N)CNC(=O)C(NC(=O)/C(=C\NC(=O)N)/NC1=O)C2CCNC(=N)N2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A08 compound treatment 0.0 -1789.8 -1.5436 57.0 -1384.3 -1.1214 -1.8844 -0.9877 979 BSPBio_001926 S=C1CC=CC=N1O[Zn]On2ccccc2=S 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A09 compound treatment 2136.0 346.25 0.2986 2494.0 1052.7 0.8528 0.8142 0.9011 1327 BSPBio_001927 C[N+](C)(C)CCOC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A10 compound treatment 2247.0 457.25 0.3944 2331.0 889.72 0.7208 0.7885 0.9597 1112 BSPBio_001928 CC(C)N(CCC(C(=O)N)(c1ccccc1)c2ccccn2)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A11 compound treatment 1841.0 51.246 0.0442 1865.0 423.72 0.3433 0.274 0.7916 1019 BSPBio_001929 NC(=O)N1c2ccccc2C=Cc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A12 compound treatment 1.0 -1788.8 -1.5427 11.0 -1430.3 -1.1587 -1.9102 -0.99 2038 BSPBio_001930 CCN(CC)C(=S)SSC(=S)N(CC)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A13 compound treatment 259.0 -1530.8 -1.3202 2191.0 749.72 0.6074 -0.5041 -0.3469 1336 BSPBio_001931 CC1(C)S[C@@H]2[C@H](NC(=O)C(C(=O)O)c3ccccc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A14 compound treatment 717.0 -1072.8 -0.9252 1611.0 169.72 0.1375 -0.557 -0.5955 1378 BSPBio_001932 NCCc1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A15 compound treatment 1939.0 149.25 0.1287 863.0 -578.28 -0.4685 -0.2402 -0.4945 1412 BSPBio_001933 CN(C)CCOC(c1ccc(Cl)cc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A16 compound treatment 1233.0 -556.75 -0.4802 474.0 -967.28 -0.7836 -0.8936 -0.9724 1059 BSPBio_001934 CN(C)CC/C=C\1/c2ccccc2COc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A17 compound treatment 1411.0 -378.75 -0.3267 1570.0 128.72 0.1043 -0.1572 -0.4586 1409 BSPBio_001935 CCCC(C)(COC(=O)N)COC(=O)NC(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A18 compound treatment 685.0 -1104.8 -0.9528 669.0 -772.28 -0.6256 -1.1161 -0.9792 980 BSPBio_001936 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A19 compound treatment 1705.0 -84.754 -0.0731 1159.0 -282.28 -0.2287 -0.2134 -0.8888 3198549 BSPBio_001937 CC1=C(N2[C@H](SC1)[C@H](NC(=O)[C@@H](N)c3ccc(O)cc3)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A20 compound treatment 1190.0 -599.75 -0.5173 1022.0 -419.28 -0.3397 -0.6059 -0.9792 1432 BSPBio_001938 CN(C)CCOC(C)(c1ccccc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A21 compound treatment 1243.0 -546.75 -0.4716 1135.0 -306.28 -0.2481 -0.5089 -0.955 689 BSPBio_001939 Cc1nnc(SCC2=C(N3[C@H](SC2)[C@H](NC(=O)Cn4cnnn4)C3=O)C(=O)O)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A22 compound treatment 499.0 -1290.8 -1.1132 358.0 -1083.3 -0.8776 -1.4077 -0.9931 1240 BSPBio_001940 CCCCOc1ccc(cc1)C(=O)CCN2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A23 mock treatment 1180.0 -609.75 -0.5259 941.0 -500.28 -0.4053 -0.6584 -0.9917 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 A24 mock treatment 688.0 -1101.8 -0.9502 324.0 -1117.3 -0.9051 -1.3119 -0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B01 mock treatment 2250.0 460.25 0.3969 1944.0 502.72 0.4073 0.5687 0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B02 mock treatment 2300.0 510.25 0.4401 1252.0 -189.28 -0.1533 0.2027 0.4351 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B03 compound treatment 2654.0 864.25 0.7454 2130.0 688.72 0.5579 0.9216 0.9898 995 BSPBio_001941 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B04 compound treatment 2100.0 310.25 0.2676 1260.0 -181.28 -0.1469 0.0854 0.2797 1000060 BSPBio_001942 COC(=O)C1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B05 compound treatment 2059.0 269.25 0.2322 1836.0 394.72 0.3198 0.3903 0.9877 997 BSPBio_001943 NCc1ccc(cc1)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B06 compound treatment 1879.0 89.246 0.077 1146.0 -295.28 -0.2392 -0.1147 -0.4565 1218 BSPBio_001944 CCCCNc1ccc(cc1)C(=O)OCCN(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B07 compound treatment 659.0 -1130.8 -0.9752 553.0 -888.28 -0.7196 -1.1984 -0.9888 1476 BSPBio_001945 CNCCCC1(CCC2c3ccccc31)c4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B08 compound treatment 2045.0 255.25 0.2201 1755.0 313.72 0.2541 0.3354 0.9974 836 BSPBio_001946 CNC(C)C(O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B09 compound treatment 30.0 -1759.8 -1.5177 14.0 -1427.3 -1.1563 -1.8908 -0.991 1358 BSPBio_001947 CN(CCCl)CCCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B10 compound treatment 1673.0 -116.75 -0.1007 1337.0 -104.28 -0.0845 -0.1309 -0.9962 1447 BSPBio_001948 NC(=O)c1ccccc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B11 compound treatment 769.0 -1020.8 -0.8804 655.0 -786.28 -0.637 -1.0729 -0.9874 1035 BSPBio_001949 Cc1cccc(CN2CCN(CC2)C(c3ccccc3)c4ccc(Cl)cc4)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B12 compound treatment 1729.0 -60.754 -0.0524 653.0 -788.28 -0.6386 -0.4886 -0.7626 1418 BSPBio_001950 CN(C)[C@H]1[C@@H]2C[C@H]3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)C(=O)c4c(O)cccc4[C@@]3(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B13 compound treatment 1933.0 143.25 0.1235 1992.0 550.72 0.4461 0.4028 0.8702 1123 BSPBio_001951 Cc1ccc(Cl)c(Nc2ccccc2C(=O)O)c1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B14 compound treatment 53.0 -1736.8 -1.4979 40.0 -1401.3 -1.1352 -1.8619 -0.9906 1120 BSPBio_001952 Oc1ccc(cc1[N+](=O)[O-])[As](=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B15 compound treatment 829.0 -960.75 -0.8286 1304.0 -137.28 -0.1112 -0.6646 -0.7949 1110 BSPBio_001953 C[C@H]1CC2C3CC[C@](OC(=O)C)(C(=O)C)[C@@]3(C)CCC2[C@@]4(C)CCC(=O)C=C14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B16 compound treatment 1444.0 -345.75 -0.2982 1192.0 -249.28 -0.2019 -0.3537 -0.982 777 BSPBio_001954 Oc1ccc(cc1)[C@@H]2CC(=O)c3c(O)cc(O)cc3O2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B17 compound treatment 334.0 -1455.8 -1.2555 339.0 -1102.3 -0.893 -1.5192 -0.9861 984 BSPBio_001955 C[C@H]1CC2C3CC[C@H](C(=O)C)[C@@]3(C)C[C@H](O)C2[C@@]4(C)CCC(=O)C=C14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B18 compound treatment 1868.0 78.246 0.0675 983.0 -458.28 -0.3713 -0.2148 -0.5692 750 BSPBio_001956 CN[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@H]1OC2[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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B19 compound treatment 791.0 -998.75 -0.8614 816.0 -625.28 -0.5065 -0.9673 -0.968 3198429 BSPBio_001957 CC(=O)O[C@@]1(CCC2C3C=C(C)C4=CC(=O)CCC4(C)C3CCC21C)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B20 compound treatment 1383.0 -406.75 -0.3508 844.0 -597.28 -0.4839 -0.5902 -0.9875 1155 BSPBio_001958 Nc1ccc(cc1)S(=O)(=O)NC(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B21 compound treatment 1713.0 -76.754 -0.0662 1578.0 136.72 0.1108 0.0315 0.2442 1244 BSPBio_001959 C[N+]1(C)CCCC(C1)OC(=O)C(O)(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B22 compound treatment 1261.0 -528.75 -0.456 835.0 -606.28 -0.4912 -0.6698 -0.9993 799 BSPBio_001960 Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B23 mock treatment 1194.0 -595.75 -0.5138 927.0 -514.28 -0.4166 -0.6579 -0.9946 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 B24 mock treatment 832.0 -957.75 -0.826 668.0 -773.28 -0.6264 -1.027 -0.9907 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C01 mock treatment 2341.0 551.25 0.4754 368.0 -1073.3 -0.8695 -0.2786 -0.2812 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C02 mock treatment 2122.0 332.25 0.2865 1875.0 433.72 0.3514 0.4511 0.9949 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C03 compound treatment 2222.0 432.25 0.3728 1995.0 553.72 0.4486 0.5808 0.9958 3172713 BSPBio_001961 CO/N=C(/C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)COC(=O)C)\c3csc(N)n3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C04 compound treatment 3007.0 1217.2 1.0498 1546.0 104.72 0.0848 0.8023 0.7618 697 BSPBio_001962 Cn1c(=O)n(C)c2ncn(CC(O)CO)c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C05 compound treatment 1244.0 -545.75 -0.4707 2150.0 708.72 0.5741 0.0732 0.0985 759 BSPBio_001963 CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)Cc3cccs3)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C06 compound treatment 2267.0 477.25 0.4116 1556.0 114.72 0.0929 0.3568 0.8455 1001324 BSPBio_001964 OC(=O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C07 compound treatment 1922.0 132.25 0.1141 1868.0 426.72 0.3457 0.3251 0.8931 712 BSPBio_001965 CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)CSc3ccncc3)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C08 compound treatment 31.0 -1758.8 -1.5169 11.0 -1430.3 -1.1587 -1.8919 -0.9912 1000036 BSPBio_001966 CC[C@H]1CN2CCc3cc(OC)c(OC)cc3C2C[C@@H]1CC4NCCc5cc(OC)c(OC)cc45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C09 compound treatment 1150.0 -639.75 -0.5518 1387.0 -54.279 -0.044 -0.4212 -0.761 3177463 BSPBio_001967 CC1=C(N2C(SC1)[C@H](NC(=O)[C@H](N)C3=CCC=CC3)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C10 compound treatment 1614.0 -175.75 -0.1516 1364.0 -77.279 -0.0626 -0.1515 -0.9235 2069266 BSPBio_001968 CNC(C)[C@H](O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C11 compound treatment 9.0 -1780.8 -1.5358 0.0 -1441.3 -1.1676 -1.9116 -0.9909 981 BSPBio_001969 CCCCCCCCCCCCCCCC[n+]1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C12 compound treatment 1427.0 -362.75 -0.3129 977.0 -464.28 -0.3761 -0.4872 -0.9958 3174481 BSPBio_001970 CNC[C@@H](O)c1ccc(O)c(O)c1.OC(C(O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C13 compound treatment 559.0 -1230.8 -1.0615 364.0 -1077.3 -0.8727 -1.3677 -0.9953 1295 BSPBio_001971 OC(=O)CCCc1ccc(cc1)N(CCCl)CCCl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C14 compound treatment 853.0 -936.75 -0.8079 766.0 -675.28 -0.5471 -0.9581 -0.982 1000136 BSPBio_001972 CC12CCC3C(=CCc4cc(O)ccc34)C2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C15 compound treatment 1408.0 -381.75 -0.3292 624.0 -817.28 -0.6621 -0.701 -0.948 2550 BSPBio_001973 O[C@@H]([C@@H](COC(=O)CCC(=O)O)NC(=O)C(Cl)Cl)c1ccc(cc1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C16 compound treatment 1374.0 -415.75 -0.3586 736.0 -705.28 -0.5714 -0.6576 -0.9748 1400 BSPBio_001974 CC(C)[C@@H](C)/C=C/[C@@H](C)C1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C17 compound treatment 470.0 -1319.8 -1.1382 213.0 -1228.3 -0.995 -1.5085 -0.9978 3059437 BSPBio_001975 OC[C@H](NC(=O)C(Cl)Cl)[C@H](O)c1ccc(cc1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C18 compound treatment 1557.0 -232.75 -0.2007 905.0 -536.28 -0.4344 -0.4491 -0.9385 3058614 BSPBio_001976 C[C@@H](CO)NC(=O)C1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C19 compound treatment 14.0 -1775.8 -1.5315 10.0 -1431.3 -1.1595 -1.9028 -0.9906 1360 BSPBio_001977 Clc1ccc(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)Nc2ccc(Cl)cc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C20 compound treatment 1181.0 -608.75 -0.525 884.0 -557.28 -0.4515 -0.6905 -0.9972 1363 BSPBio_001978 CCOC(=O)CCC(=O)O[C@@H]1[C@H](C[C@@H](C)O[C@H]1O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)O)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C21 compound treatment 1227.0 -562.75 -0.4854 447.0 -994.28 -0.8055 -0.9128 -0.9706 2554 BSPBio_001979 C[C@H]1[C@H]2CCC3C4CC=C5C[C@H](CC[C@]5(C)C4CC[C@]23CN1C)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C22 compound treatment 339.0 -1450.8 -1.2512 282.0 -1159.3 -0.9391 -1.5488 -0.99 3173471 BSPBio_001980 C[C@@]12CCC3C(CCc4cc(O)ccc34)C2CC[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C23 mock treatment 1271.0 -518.75 -0.4474 579.0 -862.28 -0.6985 -0.8103 -0.9768 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 C24 mock treatment 849.0 -940.75 -0.8114 611.0 -830.28 -0.6726 -1.0493 -0.9957 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D01 mock treatment 2931.0 1141.2 0.9843 2770.0 1328.7 1.0764 1.4571 0.999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D02 mock treatment 2705.0 915.25 0.7894 2725.0 1283.7 1.04 1.2935 0.9907 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D03 compound treatment 1577.0 -212.75 -0.1835 1616.0 174.72 0.1415 -0.0297 -0.128 1116 BSPBio_001981 S=c1[nH]cnc2nc[nH]c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D04 compound treatment 185.0 -1604.8 -1.384 692.0 -749.28 -0.607 -1.4079 -0.9316 368 BSPBio_001982 CC/C(=C(\c1ccccc1)/c2ccc(OCCN(C)C)cc2)/c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D05 compound treatment 3272.0 1482.2 1.2784 2803.0 1361.7 1.1031 1.684 0.9973 1252 BSPBio_001983 CC(C)NCC(O)c1cc(O)cc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D06 compound treatment 1.0 -1788.8 -1.5427 0.0 -1441.3 -1.1676 -1.9165 -0.9906 1228 BSPBio_001984 CC[Hg]Sc1ccccc1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D07 compound treatment 678.0 -1111.8 -0.9588 2683.0 1241.7 1.0059 0.0333 0.024 1094620 BSPBio_001985 CC(C[N+](C)(C)C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D08 compound treatment 2007.0 217.25 0.1874 1884.0 442.72 0.3587 0.3861 0.9542 1223 BSPBio_001986 CCCC(=O)Nc1ccc(OCC(O)CNC(C)C)c(c1)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D09 compound treatment 2164.0 374.25 0.3228 2367.0 925.72 0.7499 0.7585 0.929 762 BSPBio_001987 COc1cccc(OC)c1C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D10 compound treatment 1941.0 151.25 0.1304 2230.0 788.72 0.639 0.544 0.8343 1044 BSPBio_001988 C[C@H](CCC(=O)O)[C@H]1CCC2C3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D11 compound treatment 2509.0 719.25 0.6203 2247.0 805.72 0.6527 0.9002 0.9997 842 BSPBio_001989 Cn1cc[nH]c1=S 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D12 compound treatment 919.0 -870.75 -0.751 1555.0 113.72 0.0921 -0.4659 -0.6157 1374 BSPBio_001990 Oc1c(Br)cc(Br)c2cccnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D13 compound treatment 2097.0 307.25 0.265 1753.0 311.72 0.2525 0.3659 0.9997 1062 BSPBio_001991 COc1ccccc1OCC(O)COC(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D14 compound treatment 2321.0 531.25 0.4582 1837.0 395.72 0.3206 0.5507 0.9847 1096 BSPBio_001992 C[N+](C)(C)CC(O)CC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D15 compound treatment 232.0 -1557.8 -1.3435 225.0 -1216.3 -0.9853 -1.6467 -0.9884 1000064 BSPBio_001993 CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)NC(CCC(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D16 compound treatment 210.0 -1579.8 -1.3625 20.0 -1421.3 -1.1514 -1.7776 -0.9965 1056 BSPBio_001994 Nc1nc2nc[nH]c2c(=S)[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D17 compound treatment 1935.0 145.25 0.1253 1846.0 404.72 0.3279 0.3204 0.9129 3058468 BSPBio_001995 COc1ccc(OC)c(c1)C(O)C(C)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D18 compound treatment 1703.0 -86.754 -0.0748 2007.0 565.72 0.4583 0.2712 0.5839 BSPBio_001996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D19 compound treatment 2379.0 589.25 0.5082 1596.0 154.72 0.1253 0.448 0.8559 1362 BSPBio_001997 COc1c2occc2cc3ccc(=O)oc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D20 compound treatment 1336.0 -453.75 -0.3913 1553.0 111.72 0.0905 -0.2127 -0.5296 1106 BSPBio_001998 CCC(=O)c1c(O)cc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D21 compound treatment 1634.0 -155.75 -0.1343 1838.0 396.72 0.3214 0.1323 0.3797 1009 BSPBio_001999 C[N+]1(C)C2CC(CC1C3OC32)OC(=O)[C@@H](CO)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D22 compound treatment 1209.0 -580.75 -0.5009 1468.0 26.721 0.0216 -0.3389 -0.6759 1000109 BSPBio_002000 Nc1ncnc2n(cnc12)[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D23 mock treatment 1483.0 -306.75 -0.2646 1409.0 -32.279 -0.0261 -0.2056 -0.7732 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 D24 mock treatment 808.0 -981.75 -0.8467 1019.0 -422.28 -0.3421 -0.8406 -0.9205 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E01 mock treatment 2153.0 363.25 0.3133 2356.0 914.72 0.741 0.7455 0.9266 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E02 mock treatment 2335.0 545.25 0.4703 2055.0 613.72 0.4972 0.6841 0.9996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E03 compound treatment 2181.0 391.25 0.3374 2263.0 821.72 0.6657 0.7093 0.9504 1000114 BSPBio_002001 CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E04 compound treatment 1409.0 -380.75 -0.3284 782.0 -659.28 -0.5341 -0.6099 -0.9727 1224 BSPBio_002002 C[C@@]12CCC3C(CCc4cc(O)ccc34)C2CC[C@@H]1OC(=O)CCC5CCCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E05 compound treatment 2265.0 475.25 0.4099 2370.0 928.72 0.7524 0.8218 0.9592 1282 BSPBio_002003 NS(=O)(=O)c1cc2c(N=CNS2(=O)=O)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E06 compound treatment 491.0 -1298.8 -1.1201 579.0 -862.28 -0.6985 -1.286 -0.9742 1468 BSPBio_002004 CCCCC(=O)O[C@H]1CCC2C3CCc4cc(O)ccc4C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E07 compound treatment 1250.0 -539.75 -0.4655 1865.0 423.72 0.3433 -0.0864 -0.1495 3057880 BSPBio_002005 COc1ccc(cc1)C(=C(c2ccc(OC)cc2)c3ccc(OC)cc3)Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E08 compound treatment 2043.0 253.25 0.2184 1945.0 503.72 0.4081 0.443 0.9571 1216 BSPBio_002006 C[C@@]12CCC3C(CCc4cc(O)ccc34)C2C[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E09 compound treatment 532.0 -1257.8 -1.0848 909.0 -532.28 -0.4312 -1.072 -0.9183 1396 BSPBio_002007 Cc1cc(O)cc(C)c1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E10 compound treatment 819.0 -970.75 -0.8372 518.0 -923.28 -0.748 -1.1209 -0.9984 3058535 BSPBio_002008 C[C@@]12CCC3C(CCc4cc(O)ccc34)C2CCC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E11 compound treatment 1922.0 132.25 0.1141 1503.0 61.721 0.05 0.116 0.9315 2069230 BSPBio_002009 CN(C)CC[C@H](c1ccc(Cl)cc1)c2ccccn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E12 compound treatment 1413.0 -376.75 -0.3249 1667.0 225.72 0.1829 -0.1005 -0.2694 1485 BSPBio_002010 CCC(=C)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E13 compound treatment 8.0 -1781.8 -1.5367 1.0 -1440.3 -1.1668 -1.9116 -0.9908 436 BSPBio_002011 CN(C)CCCN1c2ccccc2Sc3ccc(Cl)cc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E14 compound treatment 2406.0 616.25 0.5315 2201.0 759.72 0.6155 0.811 0.9973 1176 BSPBio_002012 CC[C@@H](CO)NCCN[C@@H](CC)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E15 compound treatment 2301.0 511.25 0.4409 1725.0 283.72 0.2298 0.4743 0.9539 1132 BSPBio_002013 CCCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E16 compound treatment 1789.0 -0.7541 -7.0E-4 1205.0 -236.28 -0.1914 -0.1358 -0.7095 1139 BSPBio_002014 C[C@@]12CCC3C(CCc4cc(O)ccc34)C2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E17 compound treatment 448.0 -1341.8 -1.1572 602.0 -839.28 -0.6799 -1.299 -0.9679 901 BSPBio_002015 CN(C)[C@H]1[C@@H]2C[C@H]3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)C(=O)c4c(O)ccc(Cl)c4[C@@]3(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E18 compound treatment 1763.0 -26.754 -0.0231 1786.0 344.72 0.2793 0.1812 0.6465 803 BSPBio_002016 CCc1cc(ccn1)C(=S)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E19 compound treatment 1475.0 -314.75 -0.2715 1697.0 255.72 0.2072 -0.0455 -0.1331 1332 BSPBio_002017 NS(=O)(=O)c1cc(ccc1Cl)C2(O)NC(=O)c3ccccc32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E20 compound treatment 2.0 -1787.8 -1.5419 1.0 -1440.3 -1.1668 -1.9153 -0.9905 727 BSPBio_002018 CCN(CC)C(C)CN1c2ccccc2Sc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E21 compound treatment 1366.0 -423.75 -0.3655 1488.0 46.721 0.0378 -0.2317 -0.6305 1480 BSPBio_002019 Clc1ccc2oc(=O)[nH]c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E22 compound treatment 254.0 -1535.8 -1.3245 290.0 -1151.3 -0.9327 -1.5961 -0.9853 3177451 BSPBio_002020 CC(=O)OCC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E23 mock treatment 1076.0 -713.75 -0.6156 1355.0 -86.279 -0.0699 -0.4847 -0.7824 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 E24 mock treatment 902.0 -887.75 -0.7657 993.0 -448.28 -0.3632 -0.7982 -0.9419 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F01 mock treatment 1654.0 -135.75 -0.1171 2350.0 908.72 0.7362 0.4378 0.5873 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F02 mock treatment 2946.0 1156.2 0.9972 70.0 -1371.3 -1.1109 -0.0804 -0.0538 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F03 compound treatment 2084.0 294.25 0.2538 1941.0 499.72 0.4048 0.4657 0.9747 800 BSPBio_002021 C[C@](N)(Cc1ccc(O)c(O)c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F04 compound treatment 1227.0 -562.75 -0.4854 1164.0 -277.28 -0.2246 -0.502 -0.9387 972 BSPBio_002022 CN(C)S(=O)(=O)c1ccc2Sc3ccccc3/C(=C\CCN4CCN(C)CC4)/c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F05 compound treatment 2367.0 577.25 0.4979 2477.0 1035.7 0.8391 0.9453 0.9689 991 BSPBio_002023 CC[C@@H](CO)NC(=O)[C@H]1CN(C)[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F06 compound treatment 1985.0 195.25 0.1684 2397.0 955.72 0.7742 0.6665 0.8412 1444 BSPBio_002024 C1CN=C(N1)C2CCCc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F07 compound treatment 502.0 -1287.8 -1.1106 624.0 -817.28 -0.6621 -1.2535 -0.9694 1234 BSPBio_002025 C[C@H]1CC2C3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)C2[C@@]4(C)C=CC(=O)C=C14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F08 compound treatment 1475.0 -314.75 -0.2715 2058.0 616.72 0.4996 0.1613 0.2837 1000116 BSPBio_002026 CC(=O)CC(c1ccccc1)c2c(O)c3ccccc3oc2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F09 compound treatment 1750.0 -39.754 -0.0343 624.0 -817.28 -0.6621 -0.4924 -0.7427 734 BSPBio_002027 CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F10 compound treatment 1844.0 54.246 0.0468 2426.0 984.72 0.7977 0.5972 0.7473 1256 BSPBio_002028 Cc1cc(NS(=O)(=O)c2ccc(N)cc2)no1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F11 compound treatment 1410.0 -379.75 -0.3275 1183.0 -258.28 -0.2092 -0.3795 -0.9766 3173081 BSPBio_002029 COCCc1ccc(OCC(O)CNC(C)C)cc1.OC(C(O)C(=O)O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F12 compound treatment 4.0 -1785.8 -1.5401 3.0 -1438.3 -1.1652 -1.9129 -0.9905 731 BSPBio_002030 CSc1ccc2Sc3ccccc3N(CCC4CCCCN4C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F13 compound treatment 2336.0 546.25 0.4711 2070.0 628.72 0.5093 0.6933 0.9992 683 BSPBio_002031 Cc1ncc([N+](=O)[O-])n1CCO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F14 compound treatment 1252.0 -537.75 -0.4638 1157.0 -284.28 -0.2303 -0.4908 -0.9478 816 BSPBio_002032 Cc1cc(cc(C)c1CC2=NCCN2)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F15 compound treatment 345.0 -1444.8 -1.246 182.0 -1259.3 -1.0202 -1.6024 -0.9951 814 BSPBio_002033 Clc1ccc(COC(Cn2ccnc2)c3ccc(Cl)cc3Cl)c(Cl)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F16 compound treatment 1410.0 -379.75 -0.3275 688.0 -753.28 -0.6102 -0.6631 -0.9574 2060475 BSPBio_002034 COc1cc(OC)c2C(=O)CC(Oc2c1)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F17 compound treatment 912.0 -877.75 -0.757 1463.0 21.721 0.0176 -0.5229 -0.6905 1077 BSPBio_002035 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F18 compound treatment 1678.0 -111.75 -0.0964 1644.0 202.72 0.1642 0.048 0.2519 3177389 BSPBio_002036 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](N)C[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F19 compound treatment 1712.0 -77.754 -0.0671 966.0 -475.28 -0.385 -0.3197 -0.8179 82 BSPBio_002037 Nc1cc(nc(N)[n+]1[O-])N2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F20 compound treatment 1693.0 -96.754 -0.0834 1512.0 70.721 0.0573 -0.0185 -0.1827 1533 BSPBio_002038 Cc1cc(CC(=O)O)n(C)c1C(=O)c2ccc(Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F21 compound treatment 1397.0 -392.75 -0.3387 1398.0 -43.279 -0.0351 -0.2643 -0.7761 1000139 BSPBio_002039 CO[C@]1(NC(=O)C(C(=O)O)c2ccc(O)cc2)[C@H]3OCC(=C(N3C1=O)C(=O)O)CSc4nnnn4C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F22 compound treatment 1270.0 -519.75 -0.4483 1163.0 -278.28 -0.2254 -0.4764 -0.9494 753 BSPBio_002040 O=C1C(CCS(=O)c2ccccc2)C(=O)N(N1c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F23 mock treatment 1512.0 -277.75 -0.2396 1756.0 314.72 0.255 0.0109 0.0311 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 F24 mock treatment 923.0 -866.75 -0.7475 35.0 -1406.3 -1.1392 -1.3342 -0.9791 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G01 mock treatment 3851.0 2061.2 1.7777 3117.0 1675.7 1.3575 2.217 0.9911 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G02 mock treatment 2819.0 1029.2 0.8877 5.0 -1436.3 -1.1635 -0.1951 -0.1333 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G03 compound treatment 26.0 -1763.8 -1.5212 2.0 -1439.3 -1.166 -1.9001 -0.9914 1309 BSPBio_002041 Cc1cc(C2CCCCC2)n(O)c(=O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G04 compound treatment 701.0 -1088.8 -0.939 37.0 -1404.3 -1.1376 -1.4684 -0.9955 945 BSPBio_002042 C[C@@H]1CC2C3C[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)COC(=O)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G05 compound treatment 4149.0 2359.2 2.0348 30.0 -1411.3 -1.1433 0.6304 0.2701 956 BSPBio_002043 CCn1nc(C(=O)O)c(=O)c2cc3OCOc3cc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G06 compound treatment 519.0 -1270.8 -1.096 46.0 -1395.3 -1.1303 -1.5742 -0.9999 3177453 BSPBio_002044 CC(=O)OCC(=O)[C@]12OC(C)(C)O[C@@H]2CC3C4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@@]31C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G07 compound treatment 231.0 -1558.8 -1.3444 12.0 -1429.3 -1.1579 -1.7694 -0.9972 927 BSPBio_002045 CN1CCC[C@@H]1CCO[C@](C)(c2ccccc2)c3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G08 compound treatment 685.0 -1104.8 -0.9528 455.0 -986.28 -0.799 -1.2387 -0.9962 694 BSPBio_002046 C[C@H]1CC2C3CC[C@](O)(C(=O)C)[C@@]3(C)C[C@H](O)[C@]2(F)C4(C)C=CC(=O)C=C14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G09 compound treatment 3384.0 1594.2 1.375 90.0 -1351.3 -1.0947 0.1982 0.1128 1303 BSPBio_002047 C[N+]1(CCC2CC1)CC2OC(=O)C(O)(c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G10 compound treatment 65.0 -1724.8 -1.4875 24.0 -1417.3 -1.1482 -1.8637 -0.9918 720 BSPBio_002048 Fc1c[nH]c(=O)[nH]c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G11 compound treatment 3153.0 1363.2 1.1757 185.0 -1256.3 -1.0177 0.1117 0.0719 1090 BSPBio_002049 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G12 compound treatment 1765.0 -24.754 -0.0213 78.0 -1363.3 -1.1044 -0.796 -0.7206 1000135 BSPBio_002050 CC(C(=O)O)c1ccc(c(F)c1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G13 compound treatment 4022.0 2232.2 1.9252 109.0 -1332.3 -1.0793 0.5982 0.271 877 BSPBio_002051 CC(C)(Oc1ccc(Cl)cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G14 compound treatment 2748.0 958.25 0.8264 110.0 -1331.3 -1.0785 -0.1782 -0.1312 3043753 BSPBio_002052 [O-][N+](=O)c1ccc(/C=N/N2CCOC2=O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G15 compound treatment 2178.0 388.25 0.3348 32.0 -1409.3 -1.1417 -0.5705 -0.4795 1088 BSPBio_002053 CCN(CC)CCOc1ccc(cc1)/C(=C(\Cl)/c2ccccc2)/c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G16 compound treatment 2782.0 992.25 0.8558 785.0 -656.28 -0.5317 0.2292 0.2275 1188 BSPBio_002054 NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccco2)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G17 compound treatment 3417.0 1627.2 1.4034 434.0 -1007.3 -0.816 0.4154 0.2559 448 BSPBio_002055 Clc1cccc(Cl)c1N=C2NCCN2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G18 compound treatment 2305.0 515.25 0.4444 108.0 -1333.3 -1.0801 -0.4495 -0.3849 742 BSPBio_002056 C[C@@H]1[C@H](O)CC[C@@]2(C)[C@H]1CC[C@@]3(C)C2[C@H](O)C[C@H]4/C(=C(/CCC=C(C)C)\C(=O)O)/[C@H](C[C@@]43C)OC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G19 compound treatment 20.0 -1769.8 -1.5263 7.0 -1434.3 -1.1619 -1.9009 -0.9909 1272 BSPBio_002057 Clc1ccccc1C(c2ccccc2)(c3ccccc3)n4ccnc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G20 compound treatment 2184.0 394.25 0.34 145.0 -1296.3 -1.0501 -0.5021 -0.4549 1257 BSPBio_002058 CC[N+](CC)(CC)CCOc1cccc(OCC[N+](CC)(CC)CC)c1OCC[N+](CC)(CC)CC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G21 compound treatment 2495.0 705.25 0.6082 37.0 -1404.3 -1.1376 -0.3743 -0.2902 1337 BSPBio_002059 Cc1onc(c1C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4ccccc4Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G22 compound treatment 1699.0 -90.754 -0.0783 45.0 -1396.3 -1.1311 -0.8552 -0.7542 796 BSPBio_002060 Cc1ccc(C)c(OCCCC(C)(C)C(=O)O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G23 mock treatment 2877.0 1087.2 0.9377 251.0 -1190.3 -0.9643 -0.0188 -0.014 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 G24 mock treatment 2015.0 225.25 0.1943 110.0 -1331.3 -1.0785 -0.6252 -0.5706 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H01 mock treatment 1819.0 29.246 0.0252 1474.0 32.721 0.0265 0.0366 0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H02 mock treatment 1287.0 -502.75 -0.4336 1987.0 545.72 0.4421 0.006 0.0097 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H03 compound treatment 1104.0 -685.75 -0.5914 1470.0 28.721 0.0233 -0.4018 -0.6788 1000108 BSPBio_002061 NC(=O)c1ccc[n+](c1)[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n4cnc5c(N)ncnc45)[C@@H](O)[C@H]2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H04 compound treatment 1538.0 -251.75 -0.2171 1832.0 390.72 0.3165 0.0703 0.1831 1552436 BSPBio_002062 COc1ccc(cc1)c2cc(=O)c3cc(OC)ccc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H05 compound treatment 738.0 -1051.8 -0.9071 869.0 -572.28 -0.4636 -0.9692 -0.9514 3173600 BSPBio_002063 Oc1ccc2C[C@H]3N(CC=C)CC[C@]4(C5Oc1c24)[C@@]3(O)CCC5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H06 compound treatment 1484.0 -305.75 -0.2637 1363.0 -78.279 -0.0634 -0.2313 -0.8528 1011559 BSPBio_002064 Cc1cc(=O)oc2cc(O)c(O)cc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H07 compound treatment 963.0 -826.75 -0.713 1639.0 197.72 0.1602 -0.3909 -0.5349 1083 BSPBio_002065 C(C1=NCCN1)c2cccc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H08 compound treatment 1569.0 -220.75 -0.1904 2253.0 811.72 0.6576 0.3304 0.4826 743 BSPBio_002066 CC(C)(C)NCC(O)c1cc(O)cc(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H09 compound treatment 1855.0 65.246 0.0563 1758.0 316.72 0.2566 0.2212 0.8422 890 BSPBio_002067 COc1ccc2cc(ccc2c1)[C@H](C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H10 compound treatment 3151.0 1361.2 1.174 2743.0 1301.7 1.0545 1.5758 0.9986 965 BSPBio_002068 C(C1=NCCN1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H11 compound treatment 2454.0 664.25 0.5729 2701.0 1259.7 1.0205 1.1267 0.9627 1300 BSPBio_002069 OC(=O)c1cccnc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H12 compound treatment 2698.0 908.25 0.7833 2516.0 1074.7 0.8706 1.1695 0.9986 679 BSPBio_002070 CC(=O)Nc1cc(ccc1O)[As](=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H13 compound treatment 858.0 -931.75 -0.8036 605.0 -836.28 -0.6775 -1.0473 -0.9964 110 BSPBio_002071 COC(=O)C1=C(C)NC(=C(C1c2ccccc2[N+](=O)[O-])C(=O)OC)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H14 compound treatment 157.0 -1632.8 -1.4082 343.0 -1098.3 -0.8897 -1.6249 -0.9755 1030891 BSPBio_002072 Cc1cc(=O)oc2c(O)c(O)ccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H15 compound treatment 1472.0 -317.75 -0.274 1506.0 64.721 0.0524 -0.1567 -0.5616 3173466 BSPBio_002073 [O-][N+](=O)c1ccc(/C=N/N2CC(=O)NC2=O)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H16 compound treatment 2020.0 230.25 0.1986 1869.0 427.72 0.3465 0.3854 0.9651 1499608 BSPBio_002074 COc1ccc2c(=O)cc(oc2c1)c3ccccc3OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H17 compound treatment 991.0 -798.75 -0.6889 1068.0 -373.28 -0.3024 -0.7009 -0.9317 3172716 BSPBio_002075 NC(=O)N/N=C/c1ccc(o1)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H18 compound treatment 6.0 -1783.8 -1.5384 14.0 -1427.3 -1.1563 -1.9054 -0.9901 892 BSPBio_002076 C[n+]1c2cc(N)ccc2cc3ccc(N)cc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H19 compound treatment 996.0 -793.75 -0.6846 857.0 -584.28 -0.4733 -0.8188 -0.9838 1406 BSPBio_002077 NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H20 compound treatment 2231.0 441.25 0.3806 1816.0 374.72 0.3036 0.4837 0.9937 198 BSPBio_002078 CCCCNC(=O)NS(=O)(=O)c1ccc(C)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H21 compound treatment 1147.0 -642.75 -0.5543 1572.0 130.72 0.1059 -0.3171 -0.5619 879 BSPBio_002079 NC[C@H](O)c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H22 compound treatment 1846.0 56.246 0.0485 1606.0 164.72 0.1334 0.1287 0.9061 1064 BSPBio_002080 [O-][N+](=O)O[C@@H]1CO[C@@H]2[C@H](CO[C@H]12)O[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H23 mock treatment 1420.0 -369.75 -0.3189 1731.0 289.72 0.2347 -0.0595 -0.1503 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 H24 mock treatment 1096.0 -693.75 -0.5983 1248.0 -193.28 -0.1566 -0.5338 -0.8631 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I01 mock treatment 2387.0 597.25 0.5151 2629.0 1187.7 0.9622 1.0446 0.9571 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I02 mock treatment 3233.0 1443.2 1.2447 2590.0 1148.7 0.9306 1.5382 0.9897 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I03 compound treatment 1096.0 -693.75 -0.5983 334.0 -1107.3 -0.897 -1.0574 -0.9806 820 BSPBio_002081 Oc1ccc(Cl)c2cccnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I04 compound treatment 2407.0 617.25 0.5323 2586.0 1144.7 0.9274 1.0322 0.9653 3172720 BSPBio_002082 CNC(C)[C@@H]1CC[C@@H](N)[C@@H](OC2[C@@H](N)C[C@@H](N)[C@H](OC3OC[C@](C)(O)[C@H](NC)[C@H]3O)[C@H]2O)O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I05 compound treatment 410.0 -1379.8 -1.19 513.0 -928.28 -0.752 -1.3732 -0.9755 1352 BSPBio_002083 COc1cc2CC[C@H](NC(=O)C)c3cc(=O)c(OC)ccc3-c2c(OC)c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I06 compound treatment 0.0 -1789.8 -1.5436 3.0 -1438.3 -1.1652 -1.9154 -0.9904 704 BSPBio_002084 CN(C)c1ccc(cc1)C(=C2C=CC(=[N+](C)C)C=C2)c3ccc(cc3)N(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I07 compound treatment 2888.0 1098.2 0.9472 2732.0 1290.7 1.0456 1.4091 0.9988 1111 BSPBio_002085 CCC(C)C1NC(=O)C(CCNCS(=O)(=O)O)NC(=O)C(CCNC(=O)C(NC(=O)C(CCNCS(=O)(=O)O)NC(=O)C(CCNCS(=O)(=O)O)NC(=O)C(NC1=O)C(C)CC)C(C)O)NC(=O)C(CCNCS(=O)(=O)O)NC(=O)C(NC(=O)C(CCNCS(=O)(=O)O)NC(=O)CCCCC(C)C)C(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I08 compound treatment 2310.0 520.25 0.4487 2187.0 745.72 0.6041 0.7444 0.9893 906 BSPBio_002086 N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I09 compound treatment 1702.0 -87.754 -0.0757 1586.0 144.72 0.1172 0.0294 0.2106 682 BSPBio_002087 CC(=O)OCC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)C3C(=O)C[C@@]21C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I10 compound treatment 2497.0 707.25 0.61 2066.0 624.72 0.5061 0.7892 0.9957 896 BSPBio_002088 COc1ccccc1OCC(O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I11 compound treatment 2497.0 707.25 0.61 2664.0 1222.7 0.9905 1.1317 0.9729 2060358 BSPBio_002089 C[C@@H]1CCC2[C@](C)(CO)[C@@H](O)CC[C@]2(C)[C@]31CC[C@@](CO)(CCO)O3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I12 compound treatment 35.0 -1754.8 -1.5134 46.0 -1395.3 -1.1303 -1.8694 -0.9897 3044526 BSPBio_002090 NC(=N)N/N=C\c1c(Cl)cccc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I13 compound treatment 1454.0 -335.75 -0.2896 772.0 -669.28 -0.5422 -0.5881 -0.9568 964 BSPBio_002091 CN(C)N=Nc1[nH]cnc1C(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I14 compound treatment 3015.0 1225.2 1.0567 2311.0 869.72 0.7046 1.2454 0.9806 3055 BSPBio_002092 NC(=N)NCCN1CCCCCCC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I15 compound treatment 2546.0 756.25 0.6522 2233.0 791.72 0.6414 0.9147 1.0 1446 BSPBio_002093 OC(COc1cccc2oc(cc(=O)c12)C(=O)O)COc3cccc4oc(cc(=O)c34)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I16 compound treatment 2618.0 828.25 0.7143 1958.0 516.72 0.4186 0.8011 0.9676 1290 BSPBio_002094 OC(=O)c1ccc(cc1)S(=O)(=O)N(Cl)Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I17 compound treatment 1901.0 111.25 0.0959 2013.0 571.72 0.4632 0.3953 0.8358 1000807 BSPBio_002095 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I18 compound treatment 811.0 -978.75 -0.8441 603.0 -838.28 -0.6791 -1.0771 -0.9942 1261 BSPBio_002096 OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c3ccc(Cl)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I19 compound treatment 2513.0 723.25 0.6238 1797.0 355.72 0.2882 0.6448 0.9385 1221 BSPBio_002097 CN(C)CCOC(=O)C(c1ccccc1)C2(O)CCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I20 compound treatment 1678.0 -111.75 -0.0964 1858.0 416.72 0.3376 0.1706 0.4858 3173079 BSPBio_002098 CC1(C)N[C@@H](C(=O)N1C2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I21 compound treatment 2205.0 415.25 0.3581 1612.0 170.72 0.1383 0.351 0.9144 894 BSPBio_002099 ClCCN(CCCl)P1(=O)NCCCO1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I22 compound treatment 97.0 -1692.8 -1.4599 7.0 -1434.3 -1.1619 -1.8539 -0.9936 1238 BSPBio_002100 Oc1c(Cl)cc(Cl)c(Cl)c1Cc2c(O)c(Cl)cc(Cl)c2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I23 mock treatment 1595.0 -194.75 -0.168 1526.0 84.721 0.0686 -0.0702 -0.3871 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 I24 mock treatment 769.0 -1020.8 -0.8804 1101.0 -340.28 -0.2757 -0.8174 -0.8861 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J01 mock treatment 1671.0 -118.75 -0.1024 2285.0 843.72 0.6835 0.4109 0.5945 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J02 mock treatment 1643.0 -146.75 -0.1266 2216.0 774.72 0.6276 0.3543 0.5534 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J03 compound treatment 2095.0 305.25 0.2633 1906.0 464.72 0.3765 0.4524 0.9847 1169 BSPBio_002101 C[C@@]12CCC3C(CCC4=CC(=O)CC[C@H]34)C2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J04 compound treatment 1626.0 -163.75 -0.1412 2189.0 747.72 0.6057 0.3285 0.5281 2060323 BSPBio_002102 COc1ccccc1c2cc(=O)c3c(OC)cccc3o2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J05 compound treatment 1628.0 -161.75 -0.1395 1899.0 457.72 0.3708 0.1636 0.4128 1000107 BSPBio_002103 CC(=O)O[C@]1(CCC2C3CCC4=CC(=O)CC[C@@H]4C3CC[C@@]21C)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J06 compound treatment 1914.0 124.25 0.1072 2440.0 998.72 0.8091 0.6479 0.7938 1184 BSPBio_002104 Nc1ncnc2n(cnc12)C3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J07 compound treatment 1042.0 -747.75 -0.6449 1410.0 -31.279 -0.0253 -0.4739 -0.7343 1115 BSPBio_002105 C[C@@]12CCC3C(CCC4=C3CCC(=O)C4)C2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J08 compound treatment 2001.0 211.25 0.1822 1715.0 273.72 0.2217 0.2856 0.9952 865 BSPBio_002106 Cc1ccc(cc1)C(=O)c2ccc(CC(=O)O)n2C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J09 compound treatment 1660.0 -129.75 -0.1119 1936.0 494.72 0.4008 0.2043 0.4909 747 BSPBio_002107 CCn1cc(C(=O)O)c(=O)c2cc(F)c(cc12)N3CCNCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J10 compound treatment 2205.0 415.25 0.3581 2193.0 751.72 0.609 0.6839 0.968 1081 BSPBio_002108 Cc1c(N)c(=O)n(c2ccccc2)n1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J11 compound treatment 2403.0 613.25 0.5289 1999.0 557.72 0.4518 0.6935 0.9969 1219 BSPBio_002109 CC[C@@]12CCC3C(CCC4=CC(=O)CC[C@H]34)C2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J12 compound treatment 2384.0 594.25 0.5125 2279.0 837.72 0.6786 0.8423 0.9904 830 BSPBio_002110 COc1ccc(CN(CCN(C)C)c2ccccn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J13 compound treatment 135.0 -1654.8 -1.4272 15.0 -1426.3 -1.1554 -1.8262 -0.9945 809 BSPBio_002111 CNCCC=C1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J14 compound treatment 1154.0 -635.75 -0.5483 456.0 -985.28 -0.7982 -0.9521 -0.9832 763 BSPBio_002112 CCN(CC)CCCC(C)Nc1c2ccc(Cl)cc2nc3ccc(OC)cc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J15 compound treatment 1614.0 -175.75 -0.1516 1275.0 -166.28 -0.1347 -0.2024 -0.9983 3177388 BSPBio_002113 COc1ccc2[C@@H](OC(=O)c2c1OC)[C@@H]3N(C)CCc4cc5OCOc5c(OC)c34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J16 compound treatment 1937.0 147.25 0.127 2122.0 680.72 0.5515 0.4797 0.8478 1046 BSPBio_002114 CC1C2C(CC3C4CC[C@H]5C[C@@H](O)CC[C@]5(C)C4CC(=O)[C@]23C)OC61CCC(C)CO6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J17 compound treatment 2418.0 628.25 0.5418 2073.0 631.72 0.5118 0.745 0.9996 905 BSPBio_002115 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J18 compound treatment 2195.0 405.25 0.3495 1985.0 543.72 0.4405 0.5586 0.9934 1284 BSPBio_002116 OC(=O)CN(CC(=O)O)Cc1cc2c(c3ccccc3C(=O)O)c4cc(CN(CC(=O)O)CC(=O)O)c(=O)cc4oc2cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J19 compound treatment 1730.0 -59.754 -0.0515 1584.0 142.72 0.1156 0.0453 0.358 770 BSPBio_002117 CC(CCc1ccccc1)NC(C)C(O)c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J20 compound treatment 46.0 -1743.8 -1.5039 32.0 -1409.3 -1.1417 -1.8707 -0.9908 1028 BSPBio_002118 Oc1ccc(cc1)C(=C2C=CC(=O)C=C2)c3ccc(O)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J21 compound treatment 1811.0 21.246 0.0183 1771.0 329.72 0.2671 0.2018 0.7538 3173595 BSPBio_002119 C[C@H]1OC(OC/2CC3O[C@@](O)(CC(O)C3C(=O)O)CC(O)C(O)CCC(O)CC(O)CC(O)CC(=O)O[C@@H](C)C(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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J22 compound treatment 991.0 -798.75 -0.6889 1679.0 237.72 0.1926 -0.3509 -0.4906 686 BSPBio_002120 C(Nc1ncnc2[nH]cnc12)c3ccco3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J23 mock treatment 1038.0 -751.75 -0.6484 1506.0 64.721 0.0524 -0.4214 -0.6478 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 J24 mock treatment 1061.0 -728.75 -0.6285 1294.0 -147.28 -0.1193 -0.5288 -0.8266 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K01 mock treatment 2336.0 546.25 0.4711 922.0 -519.28 -0.4207 0.0357 0.0565 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K02 mock treatment 2972.0 1182.2 1.0196 3087.0 1645.7 1.3332 1.6637 0.9912 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K03 compound treatment 2610.0 820.25 0.7074 2630.0 1188.7 0.963 1.1812 0.9885 760 BSPBio_002121 N[C@@H]1CONC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K04 compound treatment 89.0 -1700.8 -1.4668 38.0 -1403.3 -1.1368 -1.8411 -0.9921 756 BSPBio_002122 CCCCCCc1ccc(O)cc1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K05 compound treatment 3616.0 1826.2 1.5751 2571.0 1129.7 0.9152 1.7609 0.9666 859 BSPBio_002123 CC(=O)O[C@@]1(CCC2C3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)C3CC[C@@]21C)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K06 compound treatment 2932.0 1142.2 0.9851 3290.0 1848.7 1.4977 1.7556 0.9794 465 BSPBio_002124 NCCc1c[nH]cn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K07 compound treatment 319.0 -1470.8 -1.2685 44.0 -1397.3 -1.132 -1.6974 -0.9984 1006 BSPBio_002125 Nc1ccn(C2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K08 compound treatment 2598.0 808.25 0.6971 2734.0 1292.7 1.0473 1.2334 0.9804 700 BSPBio_002126 CN1C2CC[C@H]1C[C@H](C2)OC(=O)C(O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K09 compound treatment 1750.0 -39.754 -0.0343 1481.0 39.721 0.0322 -0.0015 -0.0317 1058 BSPBio_002127 C[C@@]12CCC3C(CCC4=Cc5oncc5C[C@]34C)C2CC[C@@]1(O)C#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K10 compound treatment 2258.0 468.25 0.4038 3120.0 1678.7 1.36 1.2472 0.8791 789 BSPBio_002128 C[N+]1(C)C2CC[C@H]1C[C@H](C2)OC(=O)C(O)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K11 compound treatment 3824.0 2034.2 1.7545 3752.0 2310.7 1.8719 2.5643 0.9995 1186 BSPBio_002129 Nc1ccc(cc1)S(=O)(=O)c2ccc(N)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K12 compound treatment 2315.0 525.25 0.453 1445.0 3.7213 0.003 0.3225 0.7118 776 BSPBio_002130 NNc1nncc2ccccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K13 compound treatment 3715.0 1925.2 1.6604 3666.0 2224.7 1.8023 2.4485 0.9992 745 BSPBio_002131 CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K14 compound treatment 3059.0 1269.2 1.0947 3557.0 2115.7 1.714 1.986 0.9765 931 BSPBio_002132 NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K15 compound treatment 2835.0 1045.2 0.9015 3168.0 1726.7 1.3988 1.6266 0.9774 1104 BSPBio_002133 C[C@H](CCC(=O)O)[C@H]1CCC2C3C(CC(=O)[C@]12C)[C@@]4(C)CCC(=O)CC4CC3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K16 compound treatment 825.0 -964.75 -0.8321 578.0 -863.28 -0.6994 -1.0829 -0.9963 848 BSPBio_002134 CC(=O)OCC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)C3[C@@H](O)C[C@@]21C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K17 compound treatment 2409.0 619.25 0.5341 1753.0 311.72 0.2525 0.5562 0.9415 1451 BSPBio_002135 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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K18 compound treatment 866.0 -923.75 -0.7967 855.0 -586.28 -0.475 -0.8992 -0.9695 1136 BSPBio_002136 C[C@@]12C[C@H](O)C3C(CCC4=CC(=O)CC[C@]34C)C2CC[C@]1(O)C(=O)COC(=O)CCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K19 compound treatment 1448.0 -341.75 -0.2947 1550.0 108.72 0.0881 -0.1461 -0.4751 844 BSPBio_002137 CNCCCN1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K20 compound treatment 634.0 -1155.8 -0.9968 733.0 -708.28 -0.5738 -1.1106 -0.9656 881 BSPBio_002138 CC12C[C@H](O)C3C(CCC4=CC(=O)CCC34C)C2CC[C@]1(O)C(=O)COP(=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K21 compound treatment 548.0 -1241.8 -1.071 632.0 -809.28 -0.6556 -1.2209 -0.9723 3172851 BSPBio_002139 C[C@@H]1CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K22 compound treatment 1907.0 117.25 0.1011 1429.0 -12.279 -0.0099 0.0645 0.6345 1131 BSPBio_002140 NS(=O)(=O)c1cc2c(NCNS2(=O)=O)cc1C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K23 mock treatment 2506.0 716.25 0.6177 2544.0 1102.7 0.8933 1.0685 0.9838 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 K24 mock treatment 1282.0 -507.75 -0.4379 1003.0 -438.28 -0.3551 -0.5607 -0.9946 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L01 mock treatment 445.0 -1344.8 -1.1598 280.0 -1161.3 -0.9408 -1.4853 -0.9946 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L02 mock treatment 1811.0 21.246 0.0183 2341.0 899.72 0.7289 0.5284 0.7247 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L03 compound treatment 832.0 -957.75 -0.826 2133.0 691.72 0.5604 -0.1878 -0.1882 1443 BSPBio_002141 CN(C)CCOC(c1ccccc1)c2ccccc2C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L04 compound treatment 711.0 -1078.8 -0.9304 2566.0 1124.7 0.9112 -0.0136 -0.0104 1000219 BSPBio_002142 N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L05 compound treatment 1561.0 -228.75 -0.1973 2919.0 1477.7 1.1971 0.707 0.5827 3173215 BSPBio_002143 Cc1onc(c1C(=O)NC2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L06 compound treatment 1238.0 -551.75 -0.4759 2619.0 1177.7 0.9541 0.3382 0.3172 2060466 BSPBio_002144 OC(=O)Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L07 compound treatment 393.0 -1396.8 -1.2046 1276.0 -165.28 -0.1339 -0.9465 -0.7809 1181 BSPBio_002145 Cc1cc(c(O)c(C)c1CC2=NCCN2)C(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L08 compound treatment 515.0 -1274.8 -1.0994 1687.0 245.72 0.1991 -0.6367 -0.5698 2935 BSPBio_002146 CC(=O)NCc1c(I)c(NC(=O)C)c(I)c(C(=O)O)c1I 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L09 compound treatment 0.0 -1789.8 -1.5436 8.0 -1433.3 -1.1611 -1.9125 -0.9901 1356 BSPBio_002147 Oc1cccc2cccnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L10 compound treatment 403.0 -1386.8 -1.196 856.0 -585.28 -0.4741 -1.181 -0.9179 3077178 BSPBio_002148 CC1CCC2(C)C(CCC=C2C)C1(C)CC/C(=C/Cn3c[n+](C)c4c(N)ncnc34)/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L11 compound treatment 6.0 -1783.8 -1.5384 16.0 -1425.3 -1.1546 -1.9043 -0.99 943 BSPBio_002149 CCCCC1C(=O)N(N(C1=O)c2ccc(O)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L12 compound treatment 926.0 -863.75 -0.745 2248.0 806.72 0.6535 -0.0646 -0.0652 1009258 BSPBio_002150 O=C1NC(=O)C(=O)C(=O)N1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L13 compound treatment 29.0 -1760.8 -1.5186 162.0 -1279.3 -1.0364 -1.8066 -0.9827 876 BSPBio_002151 CN(C)[C@H]1[C@@H]2[C@@H](O)[C@H]3C(=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)C(=O)c4c(O)cccc4[C@@]3(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L14 compound treatment 589.0 -1200.8 -1.0356 1517.0 75.721 0.0613 -0.6889 -0.6641 1013195 BSPBio_002152 Nc1ncnc2[nH]cnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L15 compound treatment 33.0 -1756.8 -1.5151 50.0 -1391.3 -1.1271 -1.8683 -0.9894 959 BSPBio_002153 COc1ccc(Cc2nccc3cc(OC)c(OC)cc23)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L16 compound treatment 7.0 -1782.8 -1.5376 2.0 -1439.3 -1.166 -1.9117 -0.9907 1009556 BSPBio_002154 Nc1c2ccccc2nc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L17 compound treatment 363.0 -1426.8 -1.2305 1273.0 -168.28 -0.1363 -0.9665 -0.7807 838 BSPBio_002155 COc1ccc(C(=O)c2ccccc2)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L18 compound treatment 5.0 -1784.8 -1.5393 2.0 -1439.3 -1.166 -1.9129 -0.9906 909 BSPBio_002156 COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L19 compound treatment 844.0 -945.75 -0.8157 1478.0 36.721 0.0297 -0.5557 -0.6809 950 BSPBio_002157 Oc1ccc(Cl)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L20 compound treatment 455.0 -1334.8 -1.1512 1705.0 263.72 0.2136 -0.6629 -0.5662 1000253 BSPBio_002158 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](N)[C@@H](O)[C@@H]1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L21 compound treatment 529.0 -1260.8 -1.0873 1619.0 177.72 0.144 -0.6671 -0.6082 719 BSPBio_002159 CN(CC#C)Cc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L22 compound treatment 53.0 -1736.8 -1.4979 185.0 -1256.3 -1.0177 -1.7788 -0.9823 1101 BSPBio_002160 CCCC1O[C@@H]2CC3C4CCC5=CC(=O)C=CC5(C)C4[C@@H](O)CC3(C)[C@@]2(O1)C(=O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L23 mock treatment 768.0 -1021.8 -0.8812 1654.0 212.72 0.1723 -0.5013 -0.5583 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 L24 mock treatment 549.0 -1240.8 -1.0701 563.0 -878.28 -0.7115 -1.2598 -0.9803 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M01 mock treatment 4022.0 2232.2 1.9252 3723.0 2281.7 1.8485 2.6684 0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M02 mock treatment 3522.0 1732.2 1.494 3834.0 2392.7 1.9384 2.427 0.9917 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M03 compound treatment 982.0 -807.75 -0.6967 1174.0 -267.28 -0.2165 -0.6457 -0.8851 1334 BSPBio_002161 C[C@@H]1CC2C3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COP(=O)(O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M04 compound treatment 914.0 -875.75 -0.7553 1034.0 -407.28 -0.3299 -0.7674 -0.931 702 BSPBio_002162 CCCCCC(=O)O[C@@]1(CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@@]21C)C(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M05 compound treatment 2191.0 401.25 0.3461 3183.0 1741.7 1.411 1.2424 0.8552 1018 BSPBio_002163 COc1ccc2C[C@H]3[C@@H]4CCCC[C@@]4(CCN3C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M06 compound treatment 478.0 -1311.8 -1.1313 385.0 -1056.3 -0.8557 -1.405 -0.9905 430 BSPBio_002164 NC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M07 compound treatment 236.0 -1553.8 -1.34 344.0 -1097.3 -0.8889 -1.5761 -0.9801 1024 BSPBio_002165 c1ccc2c(c1)sc3ccccc32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M08 compound treatment 1669.0 -120.75 -0.1041 2077.0 635.72 0.515 0.2905 0.5529 3174102 BSPBio_002166 OCCOCCN1CCN(CC1)C(c2ccccc2)c3ccc(Cl)cc3.OC(=O)c1cc2ccccc2c(Cc3c(O)c(cc4ccccc34)C(=O)O)c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M09 compound treatment 963.0 -826.75 -0.713 2232.0 790.72 0.6406 -0.0512 -0.0535 969 BSPBio_002167 CCCCOc1cc(C(=O)NCCN(CC)CC)c2ccccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M10 compound treatment 3062.0 1272.2 1.0973 3570.0 2128.7 1.7245 1.9953 0.9762 1124 BSPBio_002168 CN1C2CC[C@@H]1C[C@H](C2)OC(=O)[C@H](CO)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M11 compound treatment 3421.0 1631.2 1.4069 3168.0 1726.7 1.3988 1.9839 1.0 915 BSPBio_002169 OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M12 compound treatment 3661.0 1871.2 1.6139 3753.0 2311.7 1.8728 2.4654 0.9973 1000138 BSPBio_002170 CC(C)Cc1ccc(cc1)C(C)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M13 compound treatment 3501.0 1711.2 1.4759 3673.0 2231.7 1.8079 2.322 0.9949 1265 BSPBio_002171 Cc1onc(c1C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4c(Cl)cccc4Cl 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M14 compound treatment 722.0 -1067.8 -0.9209 730.0 -711.28 -0.5762 -1.0586 -0.9745 1174 BSPBio_002172 CN(C)CCCN1c2ccccc2CCc3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M15 compound treatment 3474.0 1684.2 1.4526 3482.0 2040.7 1.6532 2.1961 0.9979 1481 BSPBio_002173 Oc1c(Cc2c(O)c3ccccc3oc2=O)c(=O)oc4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M16 compound treatment 3137.0 1347.2 1.1619 3206.0 1764.7 1.4296 1.8325 0.9947 1127 BSPBio_002174 CC1Cc2ccccc2N1NC(=O)c3ccc(Cl)c(c3)S(=O)(=O)N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M17 compound treatment 21.0 -1768.8 -1.5255 18.0 -1423.3 -1.153 -1.894 -0.9905 819 BSPBio_002175 CCN(CC)CCOC(=O)C1(CCCCC1)C2CCCCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M18 compound treatment 1771.0 -18.754 -0.0162 2770.0 1328.7 1.0764 0.7497 0.6964 2797 BSPBio_002176 COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)O)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M19 compound treatment 2609.0 819.25 0.7066 1186.0 -255.28 -0.2068 0.3534 0.48 1370 BSPBio_002177 C/C=C(/C(=C/C)/c1ccc(O)cc1)\c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M20 compound treatment 2328.0 538.25 0.4642 2062.0 620.72 0.5029 0.6838 0.9992 1029 BSPBio_002178 CC(C(=O)O)c1ccc(cc1)N2Cc3ccccc3C2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M21 compound treatment 2368.0 578.25 0.4987 2986.0 1544.7 1.2514 1.2375 0.9186 1164 BSPBio_002179 CCN(CC)C(=O)N1CCN(C)CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M22 compound treatment 2483.0 693.25 0.5979 2877.0 1435.7 1.1631 1.2452 0.9522 778 BSPBio_002180 Oc1c(I)cc(I)c2cccnc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M23 mock treatment 2502.0 712.25 0.6143 2593.0 1151.7 0.933 1.0941 0.9794 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 M24 mock treatment 1997.0 207.25 0.1787 2148.0 706.72 0.5725 0.5312 0.8857 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N01 mock treatment 2609.0 819.25 0.7066 32.0 -1409.3 -1.1417 -0.3077 -0.2292 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N02 mock treatment 3106.0 1316.2 1.1352 2304.0 862.72 0.6989 1.2969 0.9729 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N03 compound treatment 3269.0 1479.2 1.2758 1996.0 554.72 0.4494 1.2199 0.9019 952 BSPBio_002181 CC(C)(S)[C@@H](N)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N04 compound treatment 522.0 -1267.8 -1.0934 46.0 -1395.3 -1.1303 -1.5724 -0.9999 3172726 BSPBio_002182 C[C@]12C3CCC(O3)[C@]2(C)C(=O)OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N05 compound treatment 3035.0 1245.2 1.074 1657.0 215.72 0.1748 0.883 0.8115 954 BSPBio_002183 CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N06 compound treatment 3538.0 1748.2 1.5078 1204.0 -237.28 -0.1922 0.9302 0.612 3172727 BSPBio_002184 CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N07 compound treatment 2862.0 1072.2 0.9248 1964.0 522.72 0.4235 0.9533 0.9373 1377 BSPBio_002185 CC1(C)S[C@@H]2[C@H](NC(=O)COc3ccccc3)C(=O)N2[C@H]1C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N08 compound treatment 3450.0 1660.2 1.4319 1073.0 -368.28 -0.2983 0.8015 0.548 3055310 BSPBio_002186 COc1c(O)cc2C(=O)O[C@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]3c2c1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N09 compound treatment 3017.0 1227.2 1.0584 536.0 -905.28 -0.7334 0.2299 0.1785 1404 BSPBio_002187 Nc1ccc(N=Nc2ccccc2)c(N)n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N10 compound treatment 3690.0 1900.2 1.6389 1132.0 -309.28 -0.2506 0.9817 0.5921 2060339 BSPBio_002188 COc1cc2N3C4[C@H]5[C@H]6C[C@@H]7N(CC[C@@]74c2cc1OC)CC6=CCOC5CC3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N11 compound treatment 3172.0 1382.2 1.1921 1487.0 45.721 0.037 0.8692 0.7287 976 BSPBio_002189 CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N12 compound treatment 649.0 -1140.8 -0.9839 103.0 -1338.3 -1.0842 -1.4623 -0.9988 1113269 BSPBio_002190 CN1Cc2c3OCOc3ccc2C4C(O)Cc5cc6OCOc6cc5C41 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N13 compound treatment 1986.0 196.25 0.1693 1486.0 44.721 0.0362 0.1453 0.8394 992 BSPBio_002191 CC[C@H]1[C@@H](Cc2cncn2C)COC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N14 compound treatment 3130.0 1340.2 1.1559 1282.0 -159.28 -0.129 0.7261 0.6243 1064620 BSPBio_002192 COC1=CC23CCCN3CCc4cc5OCOc5cc4C2C1O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N15 compound treatment 3308.0 1518.2 1.3094 1237.0 -204.28 -0.1655 0.8089 0.6129 1428 BSPBio_002193 CC(C)NCC(O)COc1cccc2[nH]ccc12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N16 compound treatment 3560.0 1770.2 1.5268 1628.0 186.72 0.1513 1.1865 0.7734 2060472 BSPBio_002194 C[C@@]12CCC3C(C=CC4=CC(=O)CC[C@]34C)C2CC[C@@]1(O)CCC(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N17 compound treatment 2742.0 952.25 0.8213 1306.0 -135.28 -0.1096 0.5032 0.6074 3173725 BSPBio_002195 CCN1CCN(C(=O)NC(C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)O)c4ccccc4)C(=O)C1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N18 compound treatment 2330.0 540.25 0.4659 1144.0 -297.28 -0.2408 0.1592 0.3035 2060324 BSPBio_002196 CC12CC[C@@H]3[C@H](CC3(C)C)C(=C)CC2O1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N19 compound treatment 1535.0 -254.75 -0.2197 309.0 -1132.3 -0.9173 -0.804 -0.8524 1333 BSPBio_002197 CCC(C)CCCCC(=O)NC(CCN)C(=O)NC(C(C)O)C(=O)NC(CCN)C(=O)NC1CCNC(=O)C(NC(=O)C(CCN)NC(=O)C(CCN)NC(=O)C(CC(C)C)NC(=O)C(Cc2ccccc2)NC(=O)C(CCN)NC1=O)C(C)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N20 compound treatment 2356.0 566.25 0.4884 653.0 -788.28 -0.6386 -0.1062 -0.1321 3173360 BSPBio_002198 CC(CCC(=O)O)[C@H]1CCC2C3CC[C@@H]4CCCC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N21 compound treatment 2060.0 270.25 0.2331 1210.0 -231.28 -0.1874 0.0323 0.1081 1000106 BSPBio_002199 O=C(C1CCCCC1)N2CC3N(CCc4ccccc34)C(=O)C2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N22 compound treatment 1366.0 -423.75 -0.3655 1188.0 -253.28 -0.2052 -0.4035 -0.9627 710 BSPBio_002200 CC(=O)OCC1=C(N2C(SC1)[C@H](NC(=O)CCCC(N)C(=O)O)C2=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N23 mock treatment 2607.0 817.25 0.7048 1266.0 -175.28 -0.142 0.398 0.5535 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 N24 mock treatment 1316.0 -473.75 -0.4086 681.0 -760.28 -0.6159 -0.7244 -0.9801 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O01 mock treatment 1534.0 -255.75 -0.2206 16.0 -1425.3 -1.1546 -0.9724 -0.8272 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O02 mock treatment 2940.0 1150.2 0.992 1302.0 -139.28 -0.1128 0.6217 0.6227 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O03 compound treatment 2432.0 642.25 0.5539 457.0 -984.28 -0.7974 -0.1722 -0.1773 1138 BSPBio_002201 CC/C(=C(/CC)\c1ccc(O)cc1)/c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O04 compound treatment 3278.0 1488.2 1.2836 474.0 -967.28 -0.7836 0.3535 0.2351 3045140 BSPBio_002202 CC(C)[N+]1(C)C2CC[C@@H]1C[C@H](C2)OC(=O)C(CO)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O05 compound treatment 3467.0 1677.2 1.4466 808.0 -633.28 -0.513 0.6601 0.4301 1518 BSPBio_002203 OC(=O)c1cc(ccc1O)c2ccc(F)cc2F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O06 compound treatment 2977.0 1187.2 1.024 516.0 -925.28 -0.7496 0.194 0.1529 735 BSPBio_002204 NNC(=O)c1ccncc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O07 compound treatment 1899.0 109.25 0.0942 442.0 -999.28 -0.8095 -0.5058 -0.6206 707 BSPBio_002205 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](CCC6C5CC[C@]7(C)[C@H](CC[C@]67O)C8=CC(=O)OC8)C4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O08 compound treatment 2411.0 621.25 0.5358 256.0 -1185.3 -0.9602 -0.3001 -0.2729 888 BSPBio_002206 CC(C)[N+](C)(CCC(C(=O)N)(c1ccccc1)c2ccccc2)C(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O09 compound treatment 2185.0 395.25 0.3409 894.0 -547.28 -0.4434 -0.0725 -0.1296 1454 BSPBio_002207 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](CCC6C5C[C@@H](O)[C@]7(C)[C@H](CC[C@]67O)C8=CC(=O)OC8)C4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O10 compound treatment 2250.0 460.25 0.3969 613.0 -828.28 -0.671 -0.1938 -0.2486 1479 BSPBio_002208 CC(C)NCC(O)c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O11 compound treatment 1025.0 -764.75 -0.6596 283.0 -1158.3 -0.9383 -1.1299 -0.9851 1204 BSPBio_002209 CN1C[C@@H](C[C@H]2[C@H]1Cc3c[nH]c4cccc2c34)C(=O)N[C@]5(C)O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@H](Cc8ccccc8)N6C5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O12 compound treatment 1846.0 56.246 0.0485 298.0 -1143.3 -0.9262 -0.6206 -0.6692 3650171 BSPBio_002210 C[C@H](COc1ccccc1)N[C@H](C)[C@H](O)c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O13 compound treatment 2638.0 848.25 0.7316 573.0 -868.28 -0.7034 0.0199 0.0196 3174228 BSPBio_002211 CN[C@H]1C(O)C(O)C(CO)OC1OC2[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)OC(C)[C@]2(O)CO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O14 compound treatment 1944.0 154.25 0.133 571.0 -870.28 -0.705 -0.4045 -0.5637 3177386 BSPBio_002212 NC[C@H]1O[C@H](OC2[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 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O15 compound treatment 1564.0 -225.75 -0.1947 259.0 -1182.3 -0.9578 -0.8149 -0.8338 3173092 BSPBio_002213 CN(C)CCOC(c1ccccc1)c2ccccc2.Cn1c(=O)n(C)c2nc(Cl)[nH]c2c1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O16 compound treatment 133.0 -1656.8 -1.4289 45.0 -1396.3 -1.1311 -1.8102 -0.9933 1157 BSPBio_002214 CC(=O)N1CCN(CC1)c2ccc(OCC3CO[C@@](Cn4ccnc4)(O3)c5ccc(Cl)cc5Cl)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O17 compound treatment 1420.0 -369.75 -0.3189 670.0 -771.28 -0.6248 -0.6673 -0.9513 1519 BSPBio_002215 CC1(C)OC(=O)NC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O18 compound treatment 37.0 -1752.8 -1.5117 41.0 -1400.3 -1.1344 -1.871 -0.99 729 BSPBio_002216 OC[C@H]1O[C@](O)(CO)[C@@H](O)[C@@H]1O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O19 compound treatment 882.0 -907.75 -0.7829 334.0 -1107.3 -0.897 -1.1879 -0.9977 3059213 BSPBio_002217 COc1ccc(C(=O)c2ccccc2O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O20 compound treatment 852.0 -937.75 -0.8088 414.0 -1027.3 -0.8322 -1.1604 -0.9999 873 BSPBio_002218 Nc1nc(=O)c2N(C=O)C(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)CNc2[nH]1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O21 compound treatment 763.0 -1026.8 -0.8855 459.0 -982.28 -0.7958 -1.1889 -0.9986 1002 BSPBio_002219 CN(C)CCOC(c1ccccc1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O22 compound treatment 625.0 -1164.8 -1.0046 242.0 -1199.3 -0.9716 -1.3973 -0.9999 953 BSPBio_002220 C[C@H](N)[C@H](O)c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O23 mock treatment 1357.0 -432.75 -0.3732 580.0 -861.28 -0.6977 -0.7573 -0.957 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 O24 mock treatment 824.0 -965.75 -0.8329 809.0 -632.28 -0.5122 -0.9512 -0.9727 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P01 mock treatment 2629.0 839.25 0.7238 3140.0 1698.7 1.3762 1.4849 0.955 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P02 mock treatment 2910.0 1120.2 0.9662 3310.0 1868.7 1.5139 1.7537 0.9765 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P03 compound treatment 2554.0 764.25 0.6591 2932.0 1490.7 1.2077 1.32 0.9594 349 BSPBio_002221 COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)C(=O)c4ccco4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P04 compound treatment 3793.0 2003.2 1.7277 2848.0 1406.7 1.1396 2.0275 0.9796 1000126 BSPBio_002222 C[C@H](CCC(=O)O)[C@H]1CCC2C3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P05 compound treatment 5.0 -1784.8 -1.5393 25.0 -1416.3 -1.1473 -1.8997 -0.9895 2551 BSPBio_002223 COc1cc(NC(C)CCCN)c2ncccc2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P06 compound treatment 3037.0 1247.2 1.0757 3797.0 2355.7 1.9084 2.1101 0.9632 3055321 BSPBio_002224 CC(CCC(=O)O)[C@H]1CCC2C3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P07 compound treatment 2674.0 884.25 0.7626 2275.0 833.72 0.6754 1.0168 0.9982 962 BSPBio_002225 CCC1(C(=O)NCNC1=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P08 compound treatment 1357.0 -432.75 -0.3732 1721.0 279.72 0.2266 -0.1037 -0.2375 886 BSPBio_002226 O[C@@H]([C@H]1C[C@@H]2CCN1C[C@@H]2C=C)c3ccnc4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P09 compound treatment 2930.0 1140.2 0.9834 2622.0 1180.7 0.9565 1.3717 0.9999 722 BSPBio_002227 CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P10 compound treatment 2495.0 705.25 0.6082 2447.0 1005.7 0.8147 1.0062 0.9896 2060331 BSPBio_002228 CC1=CCC(=C)[C@H]2CC(C)(C)[C@@H]2CC1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P11 compound treatment 3260.0 1470.2 1.268 2701.0 1259.7 1.0205 1.6182 0.9942 2431 BSPBio_002229 CCN(CC)CCNC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P12 compound treatment 2662.0 872.25 0.7523 2208.0 766.72 0.6211 0.9711 0.9955 3177312 BSPBio_002230 CC(C)CCCC(C)C1CCC2C3=CC[C@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P13 compound treatment 3097.0 1307.2 1.1274 2219.0 777.72 0.63 1.2427 0.9622 779 BSPBio_002231 CCN(CC)CCOC(=O)c1ccc(N)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P14 compound treatment 2658.0 868.25 0.7488 2151.0 709.72 0.575 0.9361 0.9915 BSPBio_002232 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P15 compound treatment 1697.0 -92.754 -0.08 1452.0 10.721 0.0087 -0.0504 -0.6267 1057 BSPBio_002233 OC(CCN1CCCC1)(C2CCCCC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P16 compound treatment 1605.0 -184.75 -0.1593 1779.0 337.72 0.2736 0.0808 0.2552 3177456 BSPBio_002234 CC(C)CCCC(C)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P17 compound treatment 607.0 -1182.8 -1.0201 576.0 -865.28 -0.701 -1.217 -0.9832 1000117 BSPBio_002235 CC(=O)[C@H]1CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P18 compound treatment 1995.0 205.25 0.177 1809.0 367.72 0.2979 0.3358 0.9691 3174615 BSPBio_002236 CC(C)CCCC(C)[C@H]1CCC2C3CC=C4CC(=O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P19 compound treatment 3.0 -1786.8 -1.541 1.0 -1440.3 -1.1668 -1.9147 -0.9906 937 BSPBio_002237 CCC(=O)c1ccc2Sc3ccccc3N(CC(C)N(C)C)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P20 compound treatment 1189.0 -600.75 -0.5181 2074.0 632.72 0.5126 -0.0039 -0.0054 2060399 BSPBio_002238 CC(C)CCCC(C)[C@H]1CCC2C3C[C@@H](O)[C@@]4(O)C[C@@H](O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P21 compound treatment 249.0 -1540.8 -1.3288 1845.0 403.72 0.3271 -0.7084 -0.5176 1070 BSPBio_002239 CCC(C(CC)c1ccc(O)cc1)c2ccc(O)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P22 compound treatment 1224.0 -565.75 -0.4879 1840.0 398.72 0.323 -0.1166 -0.1993 2060413 BSPBio_002240 CC(C)CCCC(C)[C@H]1CCC2C3CC[C@H]4CC(=O)CC[C@]4(C)C3CC[C@]12C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P23 mock treatment 1935.0 145.25 0.1253 2018.0 576.72 0.4672 0.4189 0.8661 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2459 P24 mock treatment 1384.0 -405.75 -0.3499 1931.0 489.72 0.3967 0.0331 0.0625 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A01 compound treatment 1590.0 -563.56 -0.486 602.0 -550.48 -0.4459 -0.659 -0.9991 3556344 DAlcMix-H_000641 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)OCC=C)c2csc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A02 compound treatment 2697.0 543.44 0.4687 14.0 -1138.5 -0.9223 -0.3207 -0.31 2019958 DAlcMix-H_000642 CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)N4CCOCC4)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A03 compound treatment 2605.0 451.44 0.3893 1658.0 505.52 0.4095 0.5649 0.9997 3639260 DAlcMix-H_000643 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)OCC=C)c2ccc(cc2)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A04 compound treatment 2053.0 -100.56 -0.0867 14.0 -1138.5 -0.9223 -0.7135 -0.7702 2019985 DAlcMix-H_000644 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4coc5ccccc5c4=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A05 compound treatment 1199.0 -954.56 -0.8233 1585.0 432.52 0.3504 -0.3344 -0.3737 2020549 DAlcMix-H_000645 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)OCC=C)c2coc3ccccc3c2=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A06 compound treatment 2323.0 169.44 0.1461 12.0 -1140.5 -0.9239 -0.55 -0.588 3638726 DAlcMix-H_000646 C[C@@H]1C[C@H](OCCCCO)OC(=C1)C(=O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A07 compound treatment 1179.0 -974.56 -0.8405 11.0 -1141.5 -0.9247 -1.2482 -0.9989 2020522 DAlcMix-H_000647 CC(=O)n1cc([C@H]2C[C@@H](OCCCCO)OC(=C2)C(=O)OCC=C)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A08 compound treatment 1639.0 -514.56 -0.4438 683.0 -469.48 -0.3803 -0.5827 -0.997 2019337 DAlcMix-H_000648 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCC2)c3ccc4OCOc4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A09 compound treatment 1273.0 -880.56 -0.7594 20.0 -1132.5 -0.9174 -1.1857 -0.9956 3641234 DAlcMix-H_000649 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)OCC=C)c2ccc(Br)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A10 compound treatment 2144.0 -9.5625 -0.0082 645.0 -507.48 -0.4111 -0.2965 -0.7211 3639214 DAlcMix-H_000650 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCC2)c3ccc(cc3)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A11 compound treatment 637.0 -1516.6 -1.308 2.0 -1150.5 -0.932 -1.5839 -0.9862 3556596 DAlcMix-H_000651 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)OCC=C)c2csc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A12 compound treatment 1018.0 -1135.6 -0.9794 650.0 -502.48 -0.4071 -0.9804 -0.9243 3639272 DAlcMix-H_000652 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCC2)c3ccc(C#C)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A13 mock treatment 600.0 -1553.6 -1.3399 32.0 -1120.5 -0.9077 -1.5893 -0.982 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A14 mock treatment 1132.0 -1021.6 -0.8811 23.0 -1129.5 -0.915 -1.27 -0.9998 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A15 compound treatment 1473.0 -680.56 -0.587 846.0 -306.48 -0.2483 -0.5906 -0.9267 2019442 DAlcMix-H_000653 CC(=O)n1cc([C@@H]2C[C@H](OCCCCO)OC(=C2)C(=O)OCC=C)c3ccccc13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A16 compound treatment 24.0 -2129.6 -1.8367 41.0 -1111.5 -0.9004 -1.9354 -0.9462 2019418 DAlcMix-H_000654 CC(=O)n1cc([C@@H]2C[C@H](OCCCCO)OC(=C2)C(=O)N3CCOCC3)c4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A17 compound treatment 757.0 -1396.6 -1.2045 237.0 -915.48 -0.7416 -1.3761 -0.9729 3556468 DAlcMix-H_000655 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)OCC=C)c3csc4ccccc34)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A18 compound treatment 46.0 -2107.6 -1.8177 20.0 -1132.5 -0.9174 -1.934 -0.9499 2019445 DAlcMix-H_000656 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCOCC2)c3coc4ccccc4c3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A19 compound treatment 351.0 -1802.6 -1.5546 5.0 -1147.5 -0.9296 -1.7566 -0.9698 2021062 DAlcMix-H_000657 CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)OCC=C)c4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A20 compound treatment 11.0 -2142.6 -1.8479 688.0 -464.48 -0.3763 -1.5727 -0.834 2021065 DAlcMix-H_000658 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4coc5ccccc5c4=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A21 compound treatment 15.0 -2138.6 -1.8444 7.0 -1145.5 -0.928 -1.9604 -0.9495 3641950 DAlcMix-H_000659 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(cc2)C(F)(F)F)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A22 compound treatment 772.0 -1381.6 -1.1915 774.0 -378.48 -0.3066 -1.0594 -0.861 3640481 DAlcMix-H_000660 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)C4CCCCC4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A23 compound treatment 0.0 -2153.6 -1.8574 16.0 -1136.5 -0.9207 -1.9644 -0.9476 2020900 DAlcMix-H_000661 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)OCC=C)c3ccccc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 A24 compound treatment 894.0 -1259.6 -1.0863 309.0 -843.48 -0.6833 -1.2513 -0.975 2020876 DAlcMix-H_000662 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4ccccc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B01 compound treatment 285.0 -1868.6 -1.6116 108.0 -1044.5 -0.8461 -1.7379 -0.9548 3089667 DAlcMix-H_000663 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@H](OC(=O)Nc3ccccc3c4ccccc4)[C@H]1OC(=O)Nc5ccccc5c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B02 compound treatment 1461.0 -692.56 -0.5973 856.0 -296.48 -0.2402 -0.5922 -0.9199 3650050 DAlcMix-H_000664 OC(=O)C(=O)NCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B03 compound treatment 2357.0 203.44 0.1755 1984.0 831.52 0.6736 0.6004 0.8625 3001022 DAlcMix-H_000665 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccc(OC)cc2)[C@H](OC(=O)Nc3ccccc3c4ccccc4)[C@@H]1OC(=O)Nc5ccccc5c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B04 compound treatment 1882.0 -271.56 -0.2342 1857.0 704.52 0.5707 0.238 0.3857 3650051 DAlcMix-H_000666 O=C(NCCCCCNCC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B05 compound treatment 1563.0 -590.56 -0.5093 867.0 -285.48 -0.2313 -0.5237 -0.9362 3413987 DAlcMix-H_000667 CO[C@H]1O[C@H](CO)[C@@H](OC(=O)Nc2ccccc2)[C@@H]3OC(=O)[C@H](Cc4cccc(Br)c4)C/C=C/C[C@@H](Cc5cccc(Br)c5)C(=O)O[C@@H]13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B06 compound treatment 2286.0 132.44 0.1142 1313.0 160.52 0.13 0.1727 0.9979 3650038 DAlcMix-H_000668 O=C(NCCCCCN(CC#N)CC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B07 compound treatment 1255.0 -898.56 -0.775 359.0 -793.48 -0.6428 -1.0025 -0.9957 3188751 DAlcMix-H_000669 CCOC(=O)[C@H]1C/C=C/C[C@H](C(=O)OCC)C(=O)O[C@H]2[C@H](OC(=O)Nc3ccccc3)[C@@H](CO)O[C@H](OC)[C@@H]2OC1=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B08 compound treatment 1262.0 -891.56 -0.7689 1221.0 68.522 0.0555 -0.5045 -0.6544 3650052 DAlcMix-H_000670 CN(CCCCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B09 compound treatment 2014.0 -139.56 -0.1204 1216.0 63.522 0.0515 -0.0487 -0.3722 3187371 DAlcMix-H_000671 COC(=O)[C@H]1N=C(O[C@H]1c2ccccc2)c3ccc(OCCCO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B10 compound treatment 1957.0 -196.56 -0.1695 147.0 -1005.5 -0.8146 -0.6958 -0.8364 3650053 DAlcMix-H_000672 CN(C)CCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B11 compound treatment 327.0 -1826.6 -1.5753 26.0 -1126.5 -0.9126 -1.7592 -0.9663 3187528 DAlcMix-H_000673 COC(=O)[C@]1(CCS(=O)(=O)c2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B12 compound treatment 1701.0 -452.56 -0.3903 681.0 -471.48 -0.382 -0.5461 -0.9999 3650054 DAlcMix-H_000674 C[N+](C)(C)CCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B13 mock treatment 1851.0 -302.56 -0.2609 2136.0 983.52 0.7968 0.3789 0.4519 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B14 mock treatment 902.0 -1251.6 -1.0794 968.0 -184.48 -0.1494 -0.8689 -0.7974 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B15 compound treatment 51.0 -2102.6 -1.8134 18.0 -1134.5 -0.9191 -1.9321 -0.9504 3068276 DAlcMix-H_000675 COC(=O)[C@]1(Cc2ccccc2)N=C(O[C@@H]1c3ccccc3)c4ccc(OCCCO)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B16 compound treatment 1754.0 -399.56 -0.3446 851.0 -301.48 -0.2442 -0.4164 -0.9858 3650055 DAlcMix-H_000676 COC(=O)C(=O)NCCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B17 compound treatment 1900.0 -253.56 -0.2187 763.0 -389.48 -0.3155 -0.3777 -0.984 3186313 DAlcMix-H_000677 OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4N(CCS(=O)(=O)c5ccccc5)C3=O)[C@@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B18 compound treatment 446.0 -1707.6 -1.4727 57.0 -1095.5 -0.8875 -1.6689 -0.9706 3650056 DAlcMix-H_000678 O=C(NCCCCCCNCC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B19 compound treatment 5.0 -2148.6 -1.853 0.0 -1152.5 -0.9336 -1.9705 -0.9496 3186444 DAlcMix-H_000679 OCCCOc1ccc(cc1)C2=N[C@@]3(Cc4ccccc4)[C@@H](O2)c5ccccc5CN(Cc6ccccc6)C3=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B20 compound treatment 91.0 -2062.6 -1.7789 127.0 -1025.5 -0.8308 -1.8453 -0.9399 3650057 DAlcMix-H_000680 O=C(NCCCCCCN(CC#N)CC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B21 compound treatment 208.0 -1945.6 -1.678 39.0 -1113.5 -0.902 -1.8243 -0.9576 3186913 DAlcMix-H_000681 OCC(NS(=O)(=O)c1ccc(Br)cc1)C=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B22 compound treatment 1204.0 -949.56 -0.819 418.0 -734.48 -0.595 -0.9998 -0.9877 3650058 DAlcMix-H_000682 OC(=O)C(=O)NCCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B23 mock treatment 1446.0 -707.56 -0.6102 461.0 -691.48 -0.5602 -0.8276 -0.9991 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 B24 compound treatment 1287.0 -866.56 -0.7474 261.0 -891.48 -0.7222 -1.0391 -0.9999 3650059 DAlcMix-H_000683 COC(=O)C[N+](C)(C)CCCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C01 compound treatment 49.0 -2104.6 -1.8151 1705.0 552.52 0.4476 -0.967 -0.5172 3643480 DAlcMix-H_000684 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc(Br)cc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C02 compound treatment 1121.0 -1032.6 -0.8905 1276.0 123.52 0.1001 -0.559 -0.6237 3640568 DAlcMix-H_000685 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4ccc(cc4)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C03 compound treatment 2723.0 569.44 0.4911 1736.0 583.52 0.4727 0.6815 0.9998 2022709 DAlcMix-H_000686 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2coc3ccccc3c2=O)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C04 compound treatment 1688.0 -465.56 -0.4015 1169.0 16.522 0.0134 -0.2745 -0.6832 3640684 DAlcMix-H_000687 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4ccc(Br)cc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C05 compound treatment 2651.0 497.44 0.429 1524.0 371.52 0.301 0.5162 0.985 2022520 DAlcMix-H_000688 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccccc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C06 compound treatment 2046.0 -107.56 -0.0928 1191.0 38.522 0.0312 -0.0435 -0.4447 3640775 DAlcMix-H_000689 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCOCC3)c4csc5ccccc45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C07 compound treatment 2776.0 622.44 0.5368 1242.0 89.522 0.0725 0.4309 0.7954 3642182 DAlcMix-H_000690 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(Br)cc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C08 compound treatment 1231.0 -922.56 -0.7957 1062.0 -90.478 -0.0733 -0.6145 -0.769 2021038 DAlcMix-H_000691 CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)N4CCOCC4)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C09 compound treatment 2551.0 397.44 0.3428 1041.0 -111.48 -0.0903 0.1785 0.5036 2021980 DAlcMix-H_000692 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccccc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C10 compound treatment 1834.0 -319.56 -0.2756 799.0 -353.48 -0.2864 -0.3974 -0.9998 3640851 DAlcMix-H_000693 C[C@H]1C[C@@H](OCCCCO)OC(=C1)C(=O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C11 mock treatment 2221.0 67.438 0.0582 442.0 -710.48 -0.5756 -0.3659 -0.6324 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C12 mock treatment 1574.0 -579.56 -0.4998 1104.0 -48.478 -0.0393 -0.3812 -0.7603 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C13 compound treatment 631.0 -1522.6 -1.3131 309.0 -843.48 -0.6833 -1.4117 -0.9537 3641424 DAlcMix-H_000694 CCO[C@@H]1OC(=C[C@H](C)[C@H]1CCCO)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C14 compound treatment 1519.0 -634.56 -0.5473 1243.0 90.522 0.0733 -0.3351 -0.6069 2020498 DAlcMix-H_000695 CC(=O)n1cc([C@H]2C[C@@H](OCCCCO)OC(=C2)C(=O)N3CCOCC3)c4ccccc14 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C15 mock treatment 2116.0 -37.563 -0.0324 1986.0 833.52 0.6752 0.4546 0.6724 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C16 mock treatment 1204.0 -949.56 -0.819 750.0 -402.48 -0.3261 -0.8096 -0.9185 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C17 compound treatment 1887.0 -266.56 -0.2299 1913.0 760.52 0.6161 0.2731 0.4153 3643393 DAlcMix-H_000696 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc(C#C)cc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C18 compound treatment 1170.0 -983.56 -0.8483 760.0 -392.48 -0.318 -0.8247 -0.9103 3641008 DAlcMix-H_000697 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)C3CCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C19 compound treatment 1688.0 -465.56 -0.4015 525.0 -627.48 -0.5083 -0.6434 -0.9932 2022142 DAlcMix-H_000698 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C20 compound treatment 1294.0 -859.56 -0.7413 760.0 -392.48 -0.318 -0.749 -0.9286 2020336 DAlcMix-H_000699 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C21 compound treatment 1371.0 -782.56 -0.6749 763.0 -389.48 -0.3155 -0.7004 -0.94 3640620 DAlcMix-H_000700 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)OCC=C)c3ccc(C#C)cc3)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C22 compound treatment 1412.0 -741.56 -0.6396 677.0 -475.48 -0.3852 -0.7246 -0.9705 2020417 DAlcMix-H_000701 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)c3ccc4OCOc4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C23 compound treatment 1718.0 -435.56 -0.3757 760.0 -392.48 -0.318 -0.4905 -0.9966 2022169 DAlcMix-H_000702 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2coc3ccccc3c2=O)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 C24 compound treatment 1223.0 -930.56 -0.8026 256.0 -896.48 -0.7262 -1.081 -0.9988 3641095 DAlcMix-H_000703 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)c3ccc(cc3)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D01 compound treatment 1075.0 -1078.6 -0.9302 2100.0 947.52 0.7676 -0.115 -0.0953 3187069 DAlcMix-H_000704 OCc1ccc(cc1)[C@H]2[C@H](C(=O)NCc3ccccc3)c4ccccc4C(=O)N2Cc5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D02 compound treatment 1975.0 -178.56 -0.154 1321.0 168.52 0.1365 -0.0124 -0.0601 3650060 DAlcMix-H_000705 OC(=O)C(=O)NCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D03 compound treatment 2122.0 -31.563 -0.0272 1571.0 418.52 0.3391 0.2205 0.6482 3068653 DAlcMix-H_000706 C[C@]1([C@@H](N(Cc2ccccc2)C(=O)c3ccccc31)c4ccc(CO)cc4)C(=O)NCc5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D04 compound treatment 2136.0 -17.563 -0.0151 1693.0 540.52 0.4379 0.2989 0.6822 3650061 DAlcMix-H_000707 O=C(NCCCCNCC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D05 compound treatment 1562.0 -591.56 -0.5102 918.0 -234.48 -0.19 -0.4951 -0.9094 3186559 DAlcMix-H_000708 COc1ccc(CCNC(=O)[C@]2(Cc3ccccc3I)[C@@H](N(Cc4ccccc4)C(=O)c5ccccc52)c6ccc(CO)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D06 compound treatment 2603.0 449.44 0.3876 1431.0 278.52 0.2256 0.4336 0.9668 3650062 DAlcMix-H_000709 O=C(NCCCCN(CC#N)CC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D07 compound treatment 1424.0 -729.56 -0.6292 480.0 -672.48 -0.5448 -0.8301 -0.9974 3068322 DAlcMix-H_000710 Cc1ccc(S[C@@]2(CC(=O)N(Cc3ccccc3)[C@@H]2c4ccc(CO)cc4I)C(=O)NCc5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D08 compound treatment 1998.0 -155.56 -0.1342 1425.0 272.52 0.2208 0.0612 0.2371 3650039 DAlcMix-H_000711 CN(CCCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D09 compound treatment 2501.0 347.44 0.2997 1630.0 477.52 0.3868 0.4854 0.992 3186638 DAlcMix-H_000712 COc1ccc(CCN2C(=O)[C@]3(Cc4ccccc24)[C@@H](N(Cc5ccccc5)C(=O)c6ccccc63)c7ccc(CO)cc7)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D10 compound treatment 1242.0 -911.56 -0.7862 1296.0 143.52 0.1163 -0.4737 -0.596 3650063 DAlcMix-H_000713 CN(C)CCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D11 mock treatment 2581.0 427.44 0.3686 1700.0 547.52 0.4436 0.5743 0.9958 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D12 mock treatment 1869.0 -284.56 -0.2454 1322.0 169.52 0.1373 -0.0764 -0.2718 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D13 compound treatment 2844.0 690.44 0.5955 1388.0 235.52 0.1908 0.556 0.8891 3220717 DAlcMix-H_000714 COC(=O)c1c(CC[C@@H](CO)NC(=O)N[C@@H](Cc2ccccc2)Cn3cc(nn3)c4ccccc4)oc(C(=O)N5CCOCC5)c1C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D14 compound treatment 1277.0 -876.56 -0.756 334.0 -818.48 -0.6631 -1.0034 -0.9979 3650064 DAlcMix-H_000715 C[N+](C)(CCCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D15 mock treatment 2662.0 508.44 0.4385 1347.0 194.52 0.1576 0.4215 0.9046 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D16 mock treatment 1696.0 -457.56 -0.3946 676.0 -476.48 -0.386 -0.552 -0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D17 compound treatment 2305.0 151.44 0.1306 1454.0 301.52 0.2443 0.2651 0.957 3188911 DAlcMix-H_000716 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N[C@H](Cc3ccccc3)Cn4cc(CN(C)C2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D18 compound treatment 1818.0 -335.56 -0.2894 1403.0 250.52 0.203 -0.0611 -0.173 3650065 DAlcMix-H_000717 CN(C)CCCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D19 compound treatment 1942.0 -211.56 -0.1825 1222.0 69.522 0.0563 -0.0892 -0.4671 3188912 DAlcMix-H_000718 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N[C@H](C)Cn3cc(CN(C)C2=O)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D20 compound treatment 1508.0 -645.56 -0.5568 677.0 -475.48 -0.3852 -0.6661 -0.9838 3650066 DAlcMix-H_000719 C[N+](C)(C)CCCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D21 compound treatment 389.0 -1764.6 -1.5219 4.0 -1148.5 -0.9304 -1.734 -0.9721 3069305 DAlcMix-H_000720 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N2CCC[C@H]2CO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D22 compound treatment 1443.0 -710.56 -0.6128 540.0 -612.48 -0.4962 -0.7842 -0.9945 3650067 DAlcMix-H_000721 OC(=O)C(=O)NCCCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D23 compound treatment 24.0 -2129.6 -1.8367 0.0 -1152.5 -0.9336 -1.9589 -0.9508 3069320 DAlcMix-H_000722 COc1ccc(cc1)[Si](C)(C)[C@H](CCn2cc(CCO)nn2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 D24 compound treatment 1227.0 -926.56 -0.7991 454.0 -698.48 -0.5658 -0.9652 -0.9857 3650068 DAlcMix-H_000723 C[N+](C)(CCCCCCCC(=O)Nc1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E01 mock treatment 2204.0 50.438 0.0435 1536.0 383.52 0.3107 0.2505 0.7983 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E02 mock treatment 882.0 -1271.6 -1.0967 1367.0 214.52 0.1738 -0.6526 -0.5877 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E03 compound treatment 2711.0 557.44 0.4808 1727.0 574.52 0.4654 0.6691 0.9999 3642008 DAlcMix-H_000724 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(C#C)cc2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E04 compound treatment 1807.0 -346.56 -0.2989 1087.0 -65.478 -0.053 -0.2489 -0.8198 3641211 DAlcMix-H_000725 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCOCC2)c3ccc(Br)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E05 compound treatment 958.0 -1195.6 -1.0311 159.0 -993.48 -0.8048 -1.2982 -0.9925 3641744 DAlcMix-H_000726 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)C2CCCCC2)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E06 compound treatment 1757.0 -396.56 -0.342 1053.0 -99.478 -0.0806 -0.2988 -0.8504 3642136 DAlcMix-H_000727 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(Br)cc2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E07 compound treatment 809.0 -1344.6 -1.1596 234.0 -918.48 -0.7441 -1.3461 -0.977 3643364 DAlcMix-H_000728 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc(cc2)C(F)(F)F)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E08 compound treatment 2307.0 153.44 0.1323 919.0 -233.48 -0.1891 -0.0402 -0.174 3641378 DAlcMix-H_000729 CCO[C@@H]1OC(=C[C@H](C)[C@H]1CCCO)C(=O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E09 mock treatment 2033.0 -120.56 -0.104 1643.0 490.52 0.3974 0.2075 0.5051 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E10 mock treatment 2000.0 -153.56 -0.1324 1146.0 -6.4776 -0.0052 -0.0974 -0.7345 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E11 compound treatment 1548.0 -605.56 -0.5223 591.0 -561.48 -0.4549 -0.6909 -0.9976 3643174 DAlcMix-H_000730 CCO[C@H]1OC(=C[C@@H](C2CC2)[C@@H]1CCCO)C(=O)OCC=C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E12 compound treatment 1526.0 -627.56 -0.5412 1040.0 -112.48 -0.0911 -0.4472 -0.8147 3641524 DAlcMix-H_000731 CCO[C@@H]1OC(=C[C@H](C2CC2)[C@H]1CCCO)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E13 compound treatment 1804.0 -349.56 -0.3015 1023.0 -129.48 -0.1049 -0.2874 -0.9002 3644299 DAlcMix-H_000732 CC(C)(C)[C@@H]1C[C@H](OCc2ccc(CO)cc2)OC(=C1)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E14 compound treatment 1265.0 -888.56 -0.7663 2577.0 1424.5 1.154 0.2741 0.1979 3641698 DAlcMix-H_000733 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)C2CCCCC2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E15 compound treatment 994.0 -1159.6 -1.0001 441.0 -711.48 -0.5764 -1.1147 -0.9657 3644307 DAlcMix-H_000734 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)C5CCCCC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E16 compound treatment 14.0 -2139.6 -1.8453 946.0 -206.48 -0.1673 -1.4231 -0.7681 2021956 DAlcMix-H_000735 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccccc2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E17 mock treatment 1680.0 -473.56 -0.4084 1448.0 295.52 0.2394 -0.1195 -0.2525 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E18 mock treatment 467.0 -1686.6 -1.4546 652.0 -500.48 -0.4054 -1.3152 -0.871 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E19 compound treatment 989.0 -1164.6 -1.0044 180.0 -972.48 -0.7878 -1.2673 -0.9928 3644309 DAlcMix-H_000736 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E20 compound treatment 1296.0 -857.56 -0.7396 539.0 -613.48 -0.497 -0.8744 -0.9813 3641904 DAlcMix-H_000737 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E21 compound treatment 1442.0 -711.56 -0.6137 644.0 -508.48 -0.4119 -0.7252 -0.9812 3644317 DAlcMix-H_000738 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccc(cc5)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E22 compound treatment 1702.0 -451.56 -0.3895 723.0 -429.48 -0.3479 -0.5214 -0.9984 3642337 DAlcMix-H_000739 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2csc3ccccc23)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E23 compound treatment 65.0 -2088.6 -1.8013 17.0 -1135.5 -0.9199 -1.9242 -0.9513 3644333 DAlcMix-H_000740 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5csc6ccccc56)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 E24 compound treatment 1419.0 -734.56 -0.6335 466.0 -686.48 -0.5561 -0.8412 -0.9979 3643341 DAlcMix-H_000741 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F01 mock treatment 2575.0 421.44 0.3635 1613.0 460.52 0.3731 0.5208 0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F02 mock treatment 1061.0 -1092.6 -0.9423 6.0 -1146.5 -0.9288 -1.323 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F03 compound treatment 43.0 -2110.6 -1.8203 1220.0 67.522 0.0547 -1.2484 -0.6855 3069321 DAlcMix-H_000742 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N2Cc3ccccc3C[C@H]2CO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F04 compound treatment 1226.0 -927.56 -0.8 1182.0 29.522 0.0239 -0.5488 -0.6857 3650069 DAlcMix-H_000743 O=C(NCCCNCC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F05 compound treatment 0.0 -2153.6 -1.8574 2.0 -1150.5 -0.932 -1.9724 -0.9491 3188633 DAlcMix-H_000744 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N2Cc3ccccc3C[C@H]2CO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F06 compound treatment 632.0 -1521.6 -1.3123 40.0 -1112.5 -0.9012 -1.5652 -0.9832 3650070 DAlcMix-H_000745 O=C(NCCCN(CC#C)CC#C)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F07 compound treatment 25.0 -2128.6 -1.8358 84.0 -1068.5 -0.8656 -1.9102 -0.9411 3188765 DAlcMix-H_000746 COc1ccc(cc1)[Si](C)(C)[C@H]2[C@H](C)[C@]3(O[C@@H]2CCn4cc(CCO)nn4)C(=O)N(C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F08 compound treatment 1366.0 -787.56 -0.6792 1338.0 185.52 0.1503 -0.374 -0.5376 3650071 DAlcMix-H_000747 CN(CCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F09 mock treatment 1642.0 -511.56 -0.4412 1868.0 715.52 0.5797 0.0979 0.1344 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F10 mock treatment 1070.0 -1083.6 -0.9345 1309.0 156.52 0.1268 -0.5711 -0.6056 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F11 compound treatment 134.0 -2019.6 -1.7418 50.0 -1102.5 -0.8931 -1.8632 -0.9518 3069640 DAlcMix-H_000748 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCn4cc(CCO)nn4)C(=O)N(C)c5ccccc53 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F12 compound treatment 165.0 -1988.6 -1.7151 93.0 -1059.5 -0.8583 -1.8196 -0.9488 3650072 DAlcMix-H_000749 C[N+](C)(C)CCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F13 compound treatment 13.0 -2140.6 -1.8461 280.0 -872.48 -0.7068 -1.8052 -0.9132 3069787 DAlcMix-H_000750 COc1ccc(cc1)[Si](C)(C)[C@@H](CCn2cc(CCO)nn2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F14 compound treatment 599.0 -1554.6 -1.3407 712.0 -440.48 -0.3568 -1.2004 -0.8652 3650042 DAlcMix-H_000751 C[N+](C)(CCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F15 compound treatment 0.0 -2153.6 -1.8574 93.0 -1059.5 -0.8583 -1.9203 -0.9385 3069277 DAlcMix-H_000752 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N(CCO)Cc2ccccc2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F16 compound treatment 1365.0 -788.56 -0.6801 646.0 -506.48 -0.4103 -0.771 -0.9707 3650073 DAlcMix-H_000753 COC(=O)C(=O)NCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F17 mock treatment 2419.0 265.44 0.2289 1348.0 195.52 0.1584 0.2739 0.9838 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F18 mock treatment 35.0 -2118.6 -1.8272 2502.0 1349.5 1.0933 -0.5189 -0.2437 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F19 compound treatment 40.0 -2113.6 -1.8229 20.0 -1132.5 -0.9174 -1.9377 -0.9495 3189272 DAlcMix-H_000754 COc1ccc(cc1)[Si](C)(C)[C@@H](CC(=O)N2CCC[C@H]2CO)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F20 compound treatment 744.0 -1409.6 -1.2157 326.0 -826.48 -0.6695 -1.3331 -0.9605 3650074 DAlcMix-H_000755 O=C(NCCN(CC#C)CC#C)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F21 compound treatment 3.0 -2150.6 -1.8548 2.0 -1150.5 -0.932 -1.9706 -0.9493 3070282 DAlcMix-H_000756 COc1ccc(cc1)[Si](C)(C)[C@H](CC(=O)N(CCO)Cc2ccccc2)/C=C/C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F22 compound treatment 1512.0 -641.56 -0.5533 930.0 -222.48 -0.1802 -0.5187 -0.8913 3650075 DAlcMix-H_000757 C[N+](C)(CCCCC(=O)Nc1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F23 compound treatment 47.0 -2106.6 -1.8168 696.0 -456.48 -0.3698 -1.5462 -0.8339 3189277 DAlcMix-H_000758 COc1ccc(cc1)[Si](C)(C)[C@@H]2[C@@H](C)[C@@]3(O[C@H]2CCO)C(=O)N(C)c4ccccc43 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 F24 compound treatment 633.0 -1520.6 -1.3114 22.0 -1130.5 -0.9158 -1.5749 -0.9846 3650068 DAlcMix-H_000759 C[N+](C)(CCCCCCCC(=O)Nc1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G01 compound treatment 1080.0 -1073.6 -0.9259 100.0 -1052.5 -0.8526 -1.2576 -0.9992 3644335 DAlcMix-H_000760 CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)N4CCN(Cc5ccccc5)CC4)c6ccccc16 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G02 compound treatment 855.0 -1298.6 -1.12 611.0 -541.48 -0.4387 -1.1021 -0.9163 2022118 DAlcMix-H_000761 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G03 mock treatment 2194.0 40.438 0.0349 1152.0 -0.47761 -4.0E-4 0.0244 0.6992 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G04 mock treatment 1978.0 -175.56 -0.1514 700.0 -452.48 -0.3666 -0.3663 -0.9235 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G05 compound treatment 1390.0 -763.56 -0.6585 276.0 -876.48 -0.71 -0.9677 -0.9993 3644337 DAlcMix-H_000762 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5coc6ccccc6c5=O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G06 compound treatment 1531.0 -622.56 -0.5369 964.0 -188.48 -0.1527 -0.4876 -0.8736 2022145 DAlcMix-H_000763 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2coc3ccccc3c2=O)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G07 compound treatment 1033.0 -1120.6 -0.9664 835.0 -317.48 -0.2572 -0.8652 -0.8652 3644345 DAlcMix-H_000764 CC(C)(C)[C@@H]1C[C@H](OCCCCO)OC(=C1)C(=O)N2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G08 compound treatment 1392.0 -761.56 -0.6568 776.0 -376.48 -0.305 -0.6801 -0.9391 3643078 DAlcMix-H_000765 CCO[C@H]1OC(=C[C@@H](C)[C@@H]1CCCO)C(=O)N2CCOCC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G09 compound treatment 312.0 -1841.6 -1.5883 22.0 -1130.5 -0.9158 -1.7707 -0.9658 3644363 DAlcMix-H_000766 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccc(cc4)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G10 compound treatment 1364.0 -789.56 -0.681 717.0 -435.48 -0.3528 -0.731 -0.9531 3643238 DAlcMix-H_000767 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)C2CCCCC2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G11 compound treatment 938.0 -1215.6 -1.0484 226.0 -926.48 -0.7506 -1.272 -0.9866 3644421 DAlcMix-H_000768 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccc(cc5)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G12 compound treatment 1672.0 -481.56 -0.4153 635.0 -517.48 -0.4192 -0.5901 -1.0 2022496 DAlcMix-H_000769 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccccc2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G13 compound treatment 1250.0 -903.56 -0.7793 108.0 -1044.5 -0.8461 -1.1494 -0.9992 3644381 DAlcMix-H_000770 CC(=O)n1cc([C@@H]2C[C@H](OCCCCO)OC(=C2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G14 compound treatment 1326.0 -827.56 -0.7137 534.0 -618.48 -0.501 -0.859 -0.985 2022577 DAlcMix-H_000771 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc3OCOc3c2)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G15 compound treatment 1867.0 -286.56 -0.2471 224.0 -928.48 -0.7522 -0.7066 -0.8925 3644383 DAlcMix-H_000772 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4coc5ccccc5c4=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G16 compound treatment 1376.0 -777.56 -0.6706 464.0 -688.48 -0.5577 -0.8686 -0.9958 3643457 DAlcMix-H_000773 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc(Br)cc2)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G17 compound treatment 1182.0 -971.56 -0.8379 258.0 -894.48 -0.7246 -1.1049 -0.9974 3644416 DAlcMix-H_000774 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)C5CCCCC5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G18 compound treatment 2371.0 217.44 0.1875 289.0 -863.48 -0.6995 -0.362 -0.4999 3643559 DAlcMix-H_000775 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2csc3ccccc23)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G19 mock treatment 1387.0 -766.56 -0.6611 699.0 -453.48 -0.3674 -0.7273 -0.9615 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G20 mock treatment 1256.0 -897.56 -0.7741 337.0 -815.48 -0.6606 -1.0145 -0.9969 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G21 compound treatment 1003.0 -1150.6 -0.9923 17.0 -1135.5 -0.9199 -1.3521 -0.9993 3644417 DAlcMix-H_000776 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G22 compound treatment 1674.0 -479.56 -0.4136 259.0 -893.48 -0.7238 -0.8043 -0.9648 2022658 DAlcMix-H_000777 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G23 compound treatment 1508.0 -645.56 -0.5568 82.0 -1070.5 -0.8672 -1.0069 -0.9771 3644442 DAlcMix-H_000778 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccc5OCOc5c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 G24 compound treatment 1803.0 -350.56 -0.3023 371.0 -781.48 -0.6331 -0.6614 -0.9428 2022685 DAlcMix-H_000779 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2coc3ccccc3c2=O)C(=O)N4CCOCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H01 compound treatment 2343.0 189.44 0.1634 1990.0 837.52 0.6785 0.5953 0.853 3615849 DAlcMix-H_000780 COc1cc2CCN(CC(C)O)CCCc3c(noc3-c2cc1OC)c4ccc(OCCO[Si](C(C)C)(C(C)C)C(C)C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H02 compound treatment 2203.0 49.438 0.0426 1602.0 449.52 0.3642 0.2877 0.7845 3650076 DAlcMix-H_000781 OC(=O)C(=O)NCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H03 mock treatment 3284.0 1130.4 0.975 2338.0 1185.5 0.9604 1.3685 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H04 mock treatment 2347.0 193.44 0.1668 1584.0 431.52 0.3496 0.3652 0.9427 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H05 compound treatment 2897.0 743.44 0.6412 2041.0 888.52 0.7198 0.9624 0.9983 3556313 DAlcMix-H_000782 COc1cc2CCN3CC[C@H]4C(=NO[C@]43c2cc1OC)c5ccc(OCCO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H06 compound treatment 1054.0 -1099.6 -0.9483 51.0 -1101.5 -0.8923 -1.3015 -0.9995 3650077 DAlcMix-H_000783 O=C(NCCCCCCN(CC#C)CC#C)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H07 compound treatment 3552.0 1398.4 1.2061 1671.0 518.52 0.4201 1.1499 0.9003 3556309 DAlcMix-H_000784 COc1cc2CCN3CCC[C@H]4C(=NO[C@]43c2cc1OC)c5ccc(OCCO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H08 compound treatment 2770.0 616.44 0.5317 1415.0 262.52 0.2127 0.5263 0.9192 3650078 DAlcMix-H_000785 CN(CCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H09 compound treatment 2755.0 601.44 0.5187 1312.0 159.52 0.1292 0.4582 0.8571 3623281 DAlcMix-H_000786 COc1ccc(COC[C@]2(Oc3ccccc3[C@H]4NC(=O)N2CC=C)[C@@H]4CO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H10 compound treatment 2807.0 653.44 0.5636 3243.0 2090.5 1.6936 1.596 0.8942 3650079 DAlcMix-H_000787 CN(C)CCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H11 compound treatment 2332.0 178.44 0.1539 1480.0 327.52 0.2653 0.2964 0.9664 3623285 DAlcMix-H_000788 COc1ccc(COC[C@]2(NC(=O)N[C@H]3[C@H]2CO)Oc4ccccc34)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H12 compound treatment 1473.0 -680.56 -0.587 505.0 -647.48 -0.5245 -0.7859 -0.9984 3650041 DAlcMix-H_000789 C[N+](C)(C)CCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H13 compound treatment 3465.0 1311.4 1.1311 1443.0 290.52 0.2354 0.9662 0.8363 3623301 DAlcMix-H_000790 COc1ccc(COC[C@]2(NC(=S)N[C@H]3[C@H]2CO)Oc4ccccc34)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H14 compound treatment 1887.0 -266.56 -0.2299 388.0 -764.48 -0.6193 -0.6005 -0.909 3650080 DAlcMix-H_000791 C[N+](C)(CCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H15 compound treatment 1137.0 -1016.6 -0.8767 94.0 -1058.5 -0.8575 -1.2263 -0.9999 3623393 DAlcMix-H_000792 COc1ccc(COC[C@]2(Oc3ccccc3[C@H]4NC(=O)N2C)[C@@H]4CO)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H16 compound treatment 1994.0 -159.56 -0.1376 904.0 -248.48 -0.2013 -0.2396 -0.9828 3650081 DAlcMix-H_000793 COC(=O)C(=O)NCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H17 compound treatment 2406.0 252.44 0.2177 1449.0 296.52 0.2402 0.3238 0.9988 3623008 DAlcMix-H_000794 CN1C(=O)N[C@H]2[C@@H](COC(=O)c3ccccc3)[C@]1(CO)Oc4ccccc24 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H18 compound treatment 1626.0 -527.56 -0.455 632.0 -520.48 -0.4216 -0.6199 -0.9993 3650082 DAlcMix-H_000795 O=C(NCCCCN(CC#C)CC#C)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H19 mock treatment 2576.0 422.44 0.3643 1125.0 -27.478 -0.0223 0.2419 0.6627 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H20 mock treatment 1540.0 -613.56 -0.5292 489.0 -663.48 -0.5375 -0.7542 -1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H21 compound treatment 1396.0 -757.56 -0.6534 556.0 -596.48 -0.4832 -0.8037 -0.989 3623012 DAlcMix-H_000796 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2CO)N=C5SCc6ccccc6CN45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H22 compound treatment 1136.0 -1017.6 -0.8776 266.0 -886.48 -0.7181 -1.1284 -0.995 3650083 DAlcMix-H_000797 COC(=O)C[N+](C)(C)CCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H23 compound treatment 1779.0 -374.56 -0.323 631.0 -521.48 -0.4225 -0.5271 -0.9912 3623023 DAlcMix-H_000798 OC[C@@]1(Oc2ccccc2[C@@H]3[C@H]1COC(=O)c4ccccc4)N=C5SCc6ccccc6CN35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 H24 compound treatment 1301.0 -852.56 -0.7353 535.0 -617.48 -0.5002 -0.8736 -0.9824 3650084 DAlcMix-H_000799 C[N+](C)(C)CCCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I01 compound treatment 2047.0 -106.56 -0.0919 1419.0 266.52 0.2159 0.0877 0.3737 3644425 DAlcMix-H_000800 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccc(Br)cc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I02 compound treatment 2743.0 589.44 0.5084 1511.0 358.52 0.2904 0.5648 0.9647 3642140 DAlcMix-H_000801 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(Br)cc2)C(=O)N3CCN(C)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I03 compound treatment 1726.0 -427.56 -0.3688 273.0 -879.48 -0.7125 -0.7645 -0.953 3644429 DAlcMix-H_000802 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccccc4)CC3)c5csc6ccccc56)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I04 compound treatment 2404.0 250.44 0.216 1725.0 572.52 0.4638 0.4807 0.9395 3642393 DAlcMix-H_000803 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I05 mock treatment 3492.0 1338.4 1.1543 2036.0 883.52 0.7158 1.3224 0.9736 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I06 mock treatment 2645.0 491.44 0.4238 2126.0 973.52 0.7887 0.8574 0.9576 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I07 compound treatment 1450.0 -703.56 -0.6068 75.0 -1077.5 -0.8729 -1.0463 -0.9842 3644430 DAlcMix-H_000804 CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)N4CCN(Cc5ccccc5)CC4)c6ccccc16 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I08 compound treatment 2815.0 661.44 0.5705 841.0 -311.48 -0.2523 0.225 0.3606 3643310 DAlcMix-H_000805 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc3OCOc3c2)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I09 compound treatment 2586.0 432.44 0.373 650.0 -502.48 -0.4071 -0.0241 -0.0437 3644439 DAlcMix-H_000806 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)C4CCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I10 compound treatment 2517.0 363.44 0.3134 1132.0 -20.478 -0.0166 0.2099 0.6687 3643459 DAlcMix-H_000807 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc(Br)cc2)C(=O)N3CCN(C)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I11 compound treatment 2282.0 128.44 0.1108 770.0 -382.48 -0.3099 -0.1408 -0.4278 3644440 DAlcMix-H_000808 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I12 compound treatment 2606.0 452.44 0.3902 857.0 -295.48 -0.2394 0.1067 0.233 3643561 DAlcMix-H_000809 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2csc3ccccc23)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I13 compound treatment 525.0 -1628.6 -1.4046 6.0 -1146.5 -0.9288 -1.6499 -0.9798 3644444 DAlcMix-H_000810 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccc(cc4)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I14 compound treatment 2683.0 529.44 0.4566 1190.0 37.522 0.0304 0.3444 0.7525 3643587 DAlcMix-H_000811 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I15 compound treatment 1991.0 -162.56 -0.1402 652.0 -500.48 -0.4054 -0.3858 -0.8994 3644470 DAlcMix-H_000812 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccccc2)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I16 compound treatment 1133.0 -1020.6 -0.8802 1059.0 -93.478 -0.0757 -0.6759 -0.7651 3643602 DAlcMix-H_000813 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2coc3ccccc3c2=O)C(=O)N4CCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I17 compound treatment 196.0 -1957.6 -1.6883 7.0 -1145.5 -0.928 -1.85 -0.9603 3644448 DAlcMix-H_000814 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4ccc(Br)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I18 compound treatment 1183.0 -970.56 -0.8371 7.0 -1145.5 -0.928 -1.2481 -0.9987 3557014 DAlcMix-H_000815 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6csc7ccccc67)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I19 compound treatment 1935.0 -218.56 -0.1885 491.0 -661.48 -0.5359 -0.5122 -0.9017 3644453 DAlcMix-H_000816 CC(=O)n1cc([C@H]2C[C@@H](OCCCCO)OC(=C2)C(=O)N3CCN(Cc4ccccc4)CC3)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I20 compound treatment 724.0 -1429.6 -1.2329 119.0 -1033.5 -0.8372 -1.4638 -0.9822 3637760 DAlcMix-H_000817 CC(C)(C)[C@@H]1C[C@H](OCc2ccc(CO)cc2)OC(=C1)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I21 mock treatment 2214.0 60.438 0.0521 1154.0 1.5224 0.0012 0.0377 0.7236 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I22 mock treatment 1427.0 -726.56 -0.6266 733.0 -419.48 -0.3398 -0.6834 -0.9587 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I23 compound treatment 2007.0 -146.56 -0.1264 843.0 -309.48 -0.2507 -0.2667 -0.9497 3644454 DAlcMix-H_000818 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccccc3)CC2)c4coc5ccccc5c4=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 I24 compound treatment 461.0 -1692.6 -1.4598 120.0 -1032.5 -0.8364 -1.6237 -0.9651 3637992 DAlcMix-H_000819 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)C6CCCCC6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J01 compound treatment 1844.0 -309.56 -0.267 1754.0 601.52 0.4873 0.1558 0.2804 3623026 DAlcMix-H_000820 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2CO)N=C5SCCCN45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J02 compound treatment 1664.0 -489.56 -0.4222 1330.0 177.52 0.1438 -0.1969 -0.4414 3650085 DAlcMix-H_000821 OC(=O)C(=O)NCCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J03 compound treatment 2016.0 -137.56 -0.1186 1693.0 540.52 0.4379 0.2257 0.4976 3623036 DAlcMix-H_000822 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2CO)N(C)c5c6C(=O)N(C)C(=O)c6c(C(=O)C)c(=O)n45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J04 compound treatment 1879.0 -274.56 -0.2368 956.0 -196.48 -0.1592 -0.28 -0.9813 3650086 DAlcMix-H_000823 O=C(CCCCCNCC#N)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J05 mock treatment 2567.0 413.44 0.3566 1960.0 807.52 0.6542 0.7147 0.9593 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J06 mock treatment 2003.0 -150.56 -0.1299 861.0 -291.48 -0.2361 -0.2588 -0.9603 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J07 compound treatment 2333.0 179.44 0.1548 1850.0 697.52 0.5651 0.509 0.8688 3623040 DAlcMix-H_000824 OC[C@@]1(Oc2ccccc2[C@@H]3[C@H]1COC(=O)c4ccccc4)N=C5SCCCN35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J08 compound treatment 2191.0 37.438 0.0323 1869.0 716.52 0.5805 0.4333 0.7453 3650087 DAlcMix-H_000825 CN(CCCCCC(=O)Nc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J09 compound treatment 2968.0 814.44 0.7024 1804.0 651.52 0.5278 0.8699 0.9901 3623078 DAlcMix-H_000826 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2CO)N=C5SCC(=O)N45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J10 compound treatment 2770.0 616.44 0.5317 1529.0 376.52 0.305 0.5916 0.9652 3650088 DAlcMix-H_000827 CN(C)CCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J11 compound treatment 1911.0 -242.56 -0.2092 1255.0 102.52 0.0831 -0.0892 -0.3963 3623086 DAlcMix-H_000828 OC[C@@]1(Oc2ccccc2[C@@H]3[C@H]1COC(=O)c4ccccc4)N=C5SCC(=O)N35 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J12 compound treatment 2354.0 200.44 0.1729 800.0 -352.48 -0.2855 -0.0797 -0.2387 3650089 DAlcMix-H_000829 C[N+](C)(C)CCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J13 compound treatment 3377.0 1223.4 1.0552 1390.0 237.52 0.1924 0.8822 0.8225 3623098 DAlcMix-H_000830 CCOC(=O)OC[C@@H]1[C@@H]2NC(=O)N(C)[C@@]1(CO)Oc3ccccc23 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J14 compound treatment 2550.0 396.44 0.3419 833.0 -319.48 -0.2588 0.0588 0.137 3650046 DAlcMix-H_000831 C[N+](C)(CCCCCC(=O)Nc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J15 compound treatment 1634.0 -519.56 -0.4481 764.0 -388.48 -0.3147 -0.5394 -0.9851 3623140 DAlcMix-H_000832 COc1ccc(COC[C@@]2(Oc3ccccc3[C@@H]4[C@H]2CO)N=C5Sc6ccc(cc6C(=O)N45)[N+](=O)[O-])cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J16 compound treatment 2442.0 288.44 0.2488 859.0 -293.48 -0.2378 0.0078 0.0226 3650090 DAlcMix-H_000833 COC(=O)C(=O)NCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J17 compound treatment 2470.0 316.44 0.2729 1111.0 -41.478 -0.0336 0.1692 0.6154 3614381 DAlcMix-H_000834 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](CO)NC(=O)N[C@H](Cc7ccccc7)c8cn(C[C@@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J18 compound treatment 2095.0 -58.563 -0.0505 680.0 -472.48 -0.3828 -0.3064 -0.7935 3650091 DAlcMix-H_000835 C[N+](C)(CCCCCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J19 compound treatment 2631.0 477.44 0.4118 1441.0 288.52 0.2337 0.4564 0.964 3614385 DAlcMix-H_000836 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](CO)NC(=O)N[C@@H](Cc7ccccc7)c8cn(C[C@@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J20 compound treatment 1700.0 -453.56 -0.3912 886.0 -266.48 -0.2159 -0.4293 -0.9607 3650092 DAlcMix-H_000837 O=C(CCCCCCN(CC#N)CC#N)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J21 mock treatment 1921.0 -232.56 -0.2006 1791.0 638.52 0.5173 0.2239 0.4036 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J22 mock treatment 1383.0 -770.56 -0.6646 697.0 -455.48 -0.369 -0.7308 -0.9615 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J23 compound treatment 1999.0 -154.56 -0.1333 1862.0 709.52 0.5748 0.3122 0.5291 3614388 DAlcMix-H_000838 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@H](Cc5ccccc5)NC(=O)c6oc(CC[C@@H](CO)NC(=O)N[C@H](Cc7ccccc7)c8cn(C[C@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 J24 compound treatment 1427.0 -726.56 -0.6266 970.0 -182.48 -0.1478 -0.5476 -0.8506 3650093 DAlcMix-H_000839 CN(C)CCCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K01 compound treatment 2760.0 606.44 0.523 2444.0 1291.5 1.0463 1.1097 0.9487 3644456 DAlcMix-H_000840 CCO[C@@H]1OC(=C[C@H](C)[C@H]1CCCO)C(=O)N2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K02 compound treatment 1557.0 -596.56 -0.5145 601.0 -551.48 -0.4468 -0.6797 -0.9975 2019818 DAlcMix-H_000841 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccccc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K03 compound treatment 2689.0 535.44 0.4618 1517.0 364.52 0.2953 0.5353 0.9767 3644462 DAlcMix-H_000842 CCO[C@@H]1OC(=C[C@H](C2CC2)[C@H]1CCCO)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K04 compound treatment 2384.0 230.44 0.1987 550.0 -602.48 -0.4881 -0.2046 -0.3882 2019899 DAlcMix-H_000843 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc7OCOc7c6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K05 compound treatment 1929.0 -224.56 -0.1937 1060.0 -92.478 -0.0749 -0.1899 -0.9146 3644474 DAlcMix-H_000844 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc3OCOc3c2)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K06 compound treatment 428.0 -1725.6 -1.4882 0.0 -1152.5 -0.9336 -1.7125 -0.9748 3638166 DAlcMix-H_000845 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc(cc6)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K07 mock treatment 3160.0 1006.4 0.868 1991.0 838.52 0.6793 1.0941 0.9926 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K08 mock treatment 3390.0 1236.4 1.0664 1561.0 408.52 0.3309 0.9881 0.8849 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K09 compound treatment 878.0 -1275.6 -1.1001 91.0 -1061.5 -0.8599 -1.386 -0.9926 3644478 DAlcMix-H_000846 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K10 compound treatment 290.0 -1863.6 -1.6072 3.0 -1149.5 -0.9312 -1.795 -0.9663 3638398 DAlcMix-H_000847 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc(Br)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K11 compound treatment 1271.0 -882.56 -0.7612 114.0 -1038.5 -0.8413 -1.1331 -0.9988 3644486 DAlcMix-H_000848 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(Br)cc2)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K12 compound treatment 1992.0 -161.56 -0.1393 560.0 -592.48 -0.48 -0.4379 -0.8762 2019467 DAlcMix-H_000849 OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c5coc6ccccc6c5=O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K13 compound treatment 1586.0 -567.56 -0.4895 151.0 -1001.5 -0.8113 -0.9198 -0.9707 3644494 DAlcMix-H_000850 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K14 compound treatment 631.0 -1522.6 -1.3131 0.0 -1152.5 -0.9336 -1.5887 -0.986 3640484 DAlcMix-H_000851 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)C6CCCCC6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K15 mock treatment 3049.0 895.44 0.7723 1521.0 368.52 0.2985 0.7572 0.9145 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K16 mock treatment 2475.0 321.44 0.2772 1300.0 147.52 0.1195 0.2805 0.9293 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K17 compound treatment 2115.0 -38.563 -0.0333 331.0 -821.48 -0.6655 -0.4941 -0.7415 3644496 DAlcMix-H_000852 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K18 compound treatment 1399.0 -754.56 -0.6508 2.0 -1150.5 -0.932 -1.1192 -0.9846 2020898 DAlcMix-H_000853 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccccc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K19 compound treatment 2383.0 229.44 0.1979 882.0 -270.48 -0.2191 -0.015 -0.0509 3644498 DAlcMix-H_000854 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2coc3ccccc3c2=O)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K20 compound treatment 20.0 -2133.6 -1.8401 11.0 -1141.5 -0.9247 -1.955 -0.9493 3640571 DAlcMix-H_000855 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc(cc6)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K21 compound treatment 2422.0 268.44 0.2315 833.0 -319.48 -0.2588 -0.0193 -0.0556 3644525 DAlcMix-H_000856 CCO[C@H]1OC(=C[C@@H](C)[C@@H]1CCCO)C(=O)N2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K22 compound treatment 174.0 -1979.6 -1.7073 10.0 -1142.5 -0.9255 -1.8617 -0.9586 3641098 DAlcMix-H_000857 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)c5ccc(cc5)C(F)(F)F 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K23 mock treatment 2090.0 -63.563 -0.0548 1307.0 154.52 0.1252 0.0498 0.3641 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 K24 mock treatment 2003.0 -150.56 -0.1299 1023.0 -129.48 -0.1049 -0.166 -0.9944 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L01 compound treatment 2918.0 764.44 0.6593 2375.0 1222.5 0.9904 1.1665 0.9804 3556401 DAlcMix-H_000858 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L02 compound treatment 2541.0 387.44 0.3341 1368.0 215.52 0.1746 0.3597 0.9542 3650050 DAlcMix-H_000859 OC(=O)C(=O)NCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L03 compound treatment 3394.0 1240.4 1.0698 2096.0 943.52 0.7644 1.297 0.9864 3556405 DAlcMix-H_000860 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L04 compound treatment 2381.0 227.44 0.1962 791.0 -361.48 -0.2928 -0.0684 -0.194 3650094 DAlcMix-H_000861 O=C(CCCCNCC#N)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L05 compound treatment 3517.0 1363.4 1.1759 1736.0 583.52 0.4727 1.1658 0.9198 3556409 DAlcMix-H_000862 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L06 compound treatment 2630.0 476.44 0.4109 1074.0 -78.478 -0.0636 0.2456 0.5907 3650095 DAlcMix-H_000863 O=C(CCCCN(CC#N)CC#N)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L07 mock treatment 3237.0 1083.4 0.9344 2136.0 983.52 0.7968 1.2241 0.9969 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L08 mock treatment 2223.0 69.438 0.0599 1336.0 183.52 0.1487 0.1475 0.9201 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L09 compound treatment 2845.0 691.44 0.5963 1536.0 383.52 0.3107 0.6414 0.9538 3556407 DAlcMix-H_000864 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@@H](Cc3ccccc3)c4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L10 compound treatment 2746.0 592.44 0.511 1202.0 49.522 0.0401 0.3897 0.7603 3650096 DAlcMix-H_000865 CN(C)CCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L11 compound treatment 3593.0 1439.4 1.2415 1533.0 380.52 0.3083 1.0958 0.8567 3556412 DAlcMix-H_000866 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N[C@@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L12 compound treatment 2850.0 696.44 0.6006 1306.0 153.52 0.1244 0.5127 0.8358 3650045 DAlcMix-H_000867 C[N+](C)(C)CCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L13 compound treatment 3142.0 988.44 0.8525 1504.0 351.52 0.2848 0.8042 0.8947 3614406 DAlcMix-H_000868 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@H](Cc3ccccc3)C(=O)NCc4cn(C[C@@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](CO)NC(=O)N[C@H](Cc7ccccc7)C(=O)NCc8cn(C[C@@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L14 compound treatment 1442.0 -711.56 -0.6137 56.0 -1096.5 -0.8883 -1.062 -0.9837 3650097 DAlcMix-H_000869 C[N+](C)(CCCCC(=O)Nc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L15 mock treatment 2665.0 511.44 0.4411 1544.0 391.52 0.3172 0.5362 0.9869 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L16 mock treatment 2231.0 77.438 0.0668 1139.0 -13.478 -0.0109 0.0395 0.5838 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L17 compound treatment 981.0 -1172.6 -1.0113 1429.0 276.52 0.224 -0.5567 -0.5374 3614409 DAlcMix-H_000870 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@H](Cc3ccccc3)C(=O)NCc4cn(C[C@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](CO)NC(=O)N[C@H](Cc7ccccc7)C(=O)NCc8cn(C[C@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L18 compound treatment 2242.0 88.438 0.0763 1333.0 180.52 0.1462 0.1573 0.9539 3650098 DAlcMix-H_000871 CN(C)CCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L19 compound treatment 2512.0 358.44 0.3091 1252.0 99.522 0.0806 0.2756 0.8627 3614411 DAlcMix-H_000872 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@@H](Cc3ccccc3)C(=O)NCc4cn(C[C@@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](CO)NC(=O)N[C@@H](Cc7ccccc7)C(=O)NCc8cn(C[C@@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L20 compound treatment 793.0 -1360.6 -1.1734 201.0 -951.48 -0.7708 -1.3748 -0.9792 3650099 DAlcMix-H_000873 C[N+](C)(C)CCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L21 compound treatment 2589.0 435.44 0.3755 1026.0 -126.48 -0.1025 0.1931 0.4961 3614413 DAlcMix-H_000874 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@@H](Cc3ccccc3)C(=O)NCc4cn(C[C@H](Cc5ccccc5)NC(=O)c6oc(CC[C@H](CO)NC(=O)N[C@@H](Cc7ccccc7)C(=O)NCc8cn(C[C@H](Cc9ccccc9)NC2=O)nn8)c(C(=O)OC)c6C(=O)OC)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L22 compound treatment 2032.0 -121.56 -0.1048 858.0 -294.48 -0.2386 -0.2428 -0.9318 3650100 DAlcMix-H_000875 C[N+](C)(CCCCCNC(=O)OCc1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L23 mock treatment 2168.0 14.438 0.0125 866.0 -286.48 -0.2321 -0.1553 -0.6682 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 L24 mock treatment 1691.0 -462.56 -0.3989 575.0 -577.48 -0.4678 -0.6129 -0.9969 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M01 compound treatment 2373.0 219.44 0.1893 1215.0 62.522 0.0507 0.1696 0.8659 3644527 DAlcMix-H_000876 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)C(C)(C)C)C(=O)N2CCN(Cc3ccccc3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M02 compound treatment 75.0 -2078.6 -1.7927 198.0 -954.48 -0.7732 -1.8144 -0.9293 3640687 DAlcMix-H_000877 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c6ccc(Br)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M03 compound treatment 2100.0 -53.563 -0.0462 535.0 -617.48 -0.5002 -0.3864 -0.7691 3644531 DAlcMix-H_000878 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)C2CCCCC2)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M04 compound treatment 565.0 -1588.6 -1.3701 372.0 -780.48 -0.6323 -1.4159 -0.9383 2021060 DAlcMix-H_000879 CC(=O)n1cc([C@H]2C[C@@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4)c7ccccc17 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M05 compound treatment 3334.0 1180.4 1.0181 1675.0 522.52 0.4233 1.0192 0.9244 3638178 DAlcMix-H_000880 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)NC3CC3)c4ccc(cc4)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M06 compound treatment 1645.0 -508.56 -0.4386 408.0 -744.48 -0.6031 -0.7366 -0.9878 3641011 DAlcMix-H_000881 OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2)C5CCCCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M07 compound treatment 2564.0 410.44 0.354 818.0 -334.48 -0.271 0.0587 0.1317 3644532 DAlcMix-H_000882 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccccc2)C(=O)N3CCN(Cc4ccccc4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M08 compound treatment 1952.0 -201.56 -0.1738 986.0 -166.48 -0.1349 -0.2183 -0.9921 3641384 DAlcMix-H_000883 CCO[C@@H]1OC(=C[C@H](C)[C@H]1CCCO)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M09 mock treatment 3007.0 853.44 0.7361 1716.0 563.52 0.4565 0.8433 0.9736 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M10 mock treatment 1858.0 -295.56 -0.2549 1073.0 -79.478 -0.0644 -0.2258 -0.8587 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M11 compound treatment 2535.0 381.44 0.329 566.0 -586.48 -0.4751 -0.1033 -0.1788 3644534 DAlcMix-H_000884 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc3OCOc3c2)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M12 compound treatment 2123.0 -30.563 -0.0264 227.0 -925.48 -0.7497 -0.5488 -0.7315 3641530 DAlcMix-H_000885 CCO[C@@H]1OC(=C[C@H](C2CC2)[C@H]1CCCO)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M13 mock treatment 2837.0 683.44 0.5894 1067.0 -85.478 -0.0692 0.3678 0.6198 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M14 mock treatment 2198.0 44.438 0.0383 466.0 -686.48 -0.5561 -0.3661 -0.6568 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M15 compound treatment 2402.0 248.44 0.2143 23.0 -1129.5 -0.915 -0.4955 -0.5273 3644544 DAlcMix-H_000886 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M16 compound treatment 2201.0 47.438 0.0409 869.0 -283.48 -0.2296 -0.1335 -0.5721 2022059 DAlcMix-H_000887 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc3OCOc3c2)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M17 compound treatment 2505.0 351.44 0.3031 822.0 -330.48 -0.2677 0.025 0.0619 3644545 DAlcMix-H_000888 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M18 compound treatment 2156.0 2.4375 0.0021 455.0 -697.48 -0.565 -0.3981 -0.7045 3643154 DAlcMix-H_000889 CCO[C@H]1OC(=C[C@@H](C2CC2)[C@@H]1CCCO)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M19 compound treatment 414.0 -1739.6 -1.5003 1451.0 298.52 0.2418 -0.8899 -0.5856 3644546 DAlcMix-H_000890 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2coc3ccccc3c2=O)C(=O)N4CCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M20 compound treatment 1546.0 -607.56 -0.524 755.0 -397.48 -0.322 -0.5982 -0.9727 3641910 DAlcMix-H_000891 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M21 compound treatment 1575.0 -578.56 -0.499 662.0 -490.48 -0.3973 -0.6338 -0.9936 3637752 DAlcMix-H_000892 CC(C)(C)[C@@H]1C[C@H](OCc2ccc(CO)cc2)OC(=C1)C(=O)N3CCCCCCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M22 compound treatment 754.0 -1399.6 -1.2071 170.0 -982.48 -0.7959 -1.4163 -0.9796 3642142 DAlcMix-H_000893 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2ccc(Br)cc2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M23 compound treatment 1675.0 -478.56 -0.4127 732.0 -420.48 -0.3406 -0.5327 -0.9955 2019977 DAlcMix-H_000894 CC(=O)n1cc([C@@H]2C[C@H](OCc3ccc(CO)cc3)OC(=C2)C(=O)N4CCCCCCC4)c5ccccc15 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 M24 compound treatment 244.0 -1909.6 -1.6469 50.0 -1102.5 -0.8931 -1.7961 -0.9587 3642343 DAlcMix-H_000895 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N01 compound treatment 2984.0 830.44 0.7162 2169.0 1016.5 0.8235 1.0887 0.9976 3556423 DAlcMix-H_000896 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@H](Cc3ccccc3)C(=O)NCc4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N02 compound treatment 2551.0 397.44 0.3428 1441.0 288.52 0.2337 0.4077 0.9826 3650101 DAlcMix-H_000897 OC(=O)C(=O)NCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N03 compound treatment 3454.0 1300.4 1.1216 1227.0 74.522 0.0604 0.8358 0.7441 3556419 DAlcMix-H_000898 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@H](Cc3ccccc3)C(=O)NCc4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N04 compound treatment 2723.0 569.44 0.4911 1630.0 477.52 0.3868 0.6208 0.993 3650102 DAlcMix-H_000899 O=C(CCCNCC#N)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N05 compound treatment 3267.0 1113.4 0.9603 1659.0 506.52 0.4103 0.9692 0.9281 3556424 DAlcMix-H_000900 COC(=O)c1c(C(=O)OC)c2oc1CC[C@H](CO)NC(=O)N[C@@H](Cc3ccccc3)C(=O)NCc4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N06 compound treatment 2769.0 615.44 0.5308 944.0 -208.48 -0.1689 0.2559 0.4594 3650103 DAlcMix-H_000901 O=C(CCCN(CC#N)CC#N)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N07 compound treatment 3324.0 1170.4 1.0095 1911.0 758.52 0.6145 1.1483 0.9717 3556414 DAlcMix-H_000902 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N08 compound treatment 2571.0 417.44 0.36 1469.0 316.52 0.2564 0.4359 0.9862 3650104 DAlcMix-H_000903 CN(CCCC(=O)Nc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N09 mock treatment 3122.0 968.44 0.8352 1699.0 546.52 0.4427 0.9037 0.9559 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N10 mock treatment 2908.0 754.44 0.6507 184.0 -968.48 -0.7846 -0.0947 -0.0929 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N11 compound treatment 4066.0 1912.4 1.6494 1267.0 114.52 0.0928 1.2319 0.7457 3556416 DAlcMix-H_000904 COC(=O)c1c(C(=O)OC)c2oc1CC[C@@H](CO)NC(=O)N[C@H](Cc3ccccc3)c4cn(C[C@H](Cc5ccccc5)NC2=O)nn4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N12 compound treatment 2822.0 668.44 0.5765 859.0 -293.48 -0.2378 0.2395 0.3841 3650105 DAlcMix-H_000905 C[N+](C)(C)CCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N13 mock treatment 2914.0 760.44 0.6558 672.0 -480.48 -0.3892 0.1885 0.2472 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N14 mock treatment 3978.0 1824.4 1.5735 892.0 -260.48 -0.211 0.9634 0.6068 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N15 compound treatment 2964.0 810.44 0.699 1855.0 702.52 0.5691 0.8967 0.9948 3650036 DAlcMix-H_000906 OC(=O)C(=O)NCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N16 compound treatment 2763.0 609.44 0.5256 1391.0 238.52 0.1932 0.5083 0.9077 3650106 DAlcMix-H_000907 COC(=O)C(=O)NCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N17 compound treatment 2875.0 721.44 0.6222 1206.0 53.522 0.0434 0.4706 0.7546 3650037 DAlcMix-H_000908 O=C(NCCNCC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N18 compound treatment 2395.0 241.44 0.2082 1419.0 266.52 0.2159 0.2999 0.9998 3650107 DAlcMix-H_000909 COC(=O)C(=O)NCCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N19 compound treatment 2648.0 494.44 0.4264 1195.0 42.522 0.0344 0.3259 0.7617 3650038 DAlcMix-H_000910 O=C(NCCCCCN(CC#N)CC#N)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N20 compound treatment 2360.0 206.44 0.178 1372.0 219.52 0.1778 0.2516 1.0 3650108 DAlcMix-H_000911 COC(=O)[C@H](CCCCN(C)CC#N)NC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N21 compound treatment 2209.0 55.438 0.0478 989.0 -163.48 -0.1324 -0.0598 -0.425 3650039 DAlcMix-H_000912 CN(CCCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N22 compound treatment 1991.0 -162.56 -0.1402 1373.0 220.52 0.1786 0.0272 0.1197 3650110 DAlcMix-H_000913 COC(=O)C[N+](C)(C)CCCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N23 compound treatment 2389.0 235.44 0.2031 854.0 -298.48 -0.2418 -0.0274 -0.0868 3650040 DAlcMix-H_000914 CN(C)CCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 N24 compound treatment 1420.0 -733.56 -0.6327 677.0 -475.48 -0.3852 -0.7197 -0.9717 3650111 DAlcMix-H_000915 C[N+](C)(CCCCCCCC(=O)Nc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O01 compound treatment 2370.0 216.44 0.1867 1830.0 677.52 0.5489 0.5201 0.8971 3640683 DAlcMix-H_000916 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCCCCCC3)c4ccc(Br)cc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O02 compound treatment 1719.0 -434.56 -0.3748 33.0 -1119.5 -0.9069 -0.9063 -0.9236 2022140 DAlcMix-H_000917 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O03 compound treatment 1675.0 -478.56 -0.4127 1533.0 380.52 0.3083 -0.0739 -0.1434 3640480 DAlcMix-H_000918 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCCCCCC3)C4CCCCC4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O04 compound treatment 2221.0 67.438 0.0582 1549.0 396.52 0.3212 0.2683 0.8218 2022167 DAlcMix-H_000919 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2coc3ccccc3c2=O)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O05 compound treatment 2726.0 572.44 0.4937 1651.0 498.52 0.4039 0.6347 0.995 3640567 DAlcMix-H_000920 OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N3CCCCCCC3)c4ccc(cc4)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O06 compound treatment 1535.0 -618.56 -0.5335 742.0 -410.48 -0.3325 -0.6124 -0.9741 3643081 DAlcMix-H_000921 CCO[C@H]1OC(=C[C@@H](C)[C@@H]1CCCO)C(=O)N2CCN(Cc3ccc4OCOc4c3)CC2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O07 compound treatment 2065.0 -88.563 -0.0764 1244.0 91.522 0.0741 -0.0016 -0.0149 2022164 DAlcMix-H_000922 CCO[C@@H]1OC(=C[C@@H]([C@H]1CCCO)c2coc3ccccc3c2=O)C(=O)N4CCCCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O08 compound treatment 215.0 -1938.6 -1.6719 133.0 -1019.5 -0.8259 -1.7662 -0.9471 3643241 DAlcMix-H_000923 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)C2CCCCC2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O09 compound treatment 2959.0 805.44 0.6947 1756.0 603.52 0.4889 0.8369 0.9852 2019877 DAlcMix-H_000924 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4ccc5OCOc5c4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O10 compound treatment 1868.0 -285.56 -0.2463 276.0 -876.48 -0.71 -0.6762 -0.8998 2022518 DAlcMix-H_000925 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccccc2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O11 mock treatment 3136.0 982.44 0.8473 162.0 -990.48 -0.8024 0.0318 0.0272 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O12 mock treatment 2944.0 790.44 0.6817 716.0 -436.48 -0.3536 0.232 0.3021 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O13 compound treatment 3001.0 847.44 0.7309 694.0 -458.48 -0.3714 0.2542 0.31 3637754 DAlcMix-H_000926 CC(C)(C)[C@@H]1C[C@H](OCc2ccc(CO)cc2)OC(=C1)C(=O)N3CCOCC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O14 compound treatment 1960.0 -193.56 -0.1669 487.0 -665.48 -0.5391 -0.4993 -0.8846 2022599 DAlcMix-H_000927 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc3OCOc3c2)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O15 compound treatment 2571.0 417.44 0.36 1091.0 -61.478 -0.0498 0.2194 0.6035 3637986 DAlcMix-H_000928 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)C4CCCCC4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O16 compound treatment 2026.0 -127.56 -0.11 990.0 -162.48 -0.1316 -0.1709 -0.996 3643344 DAlcMix-H_000929 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc(cc2)C(F)(F)F)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O17 compound treatment 2358.0 204.44 0.1763 1084.0 -68.478 -0.0555 0.0854 0.4623 2019796 DAlcMix-H_000930 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4ccccc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O18 compound treatment 1180.0 -973.56 -0.8397 107.0 -1045.5 -0.847 -1.1926 -1.0 3643460 DAlcMix-H_000931 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2ccc(Br)cc2)C(=O)N3CCN(Cc4ccc5OCOc5c4)CC3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O19 compound treatment 2296.0 142.44 0.1228 1258.0 105.52 0.0855 0.1473 0.9843 3638160 DAlcMix-H_000932 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4ccc(cc4)C(F)(F)F)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O20 compound treatment 174.0 -1979.6 -1.7073 226.0 -926.48 -0.7506 -1.738 -0.9319 3643562 DAlcMix-H_000933 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2csc3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O21 compound treatment 2176.0 22.438 0.0194 1177.0 24.522 0.0199 0.0277 0.9999 3638392 DAlcMix-H_000934 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4ccc(Br)cc4)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O22 compound treatment 583.0 -1570.6 -1.3545 440.0 -712.48 -0.5772 -1.3659 -0.9277 2022680 DAlcMix-H_000935 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2cn(C(=O)C)c3ccccc23)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O23 compound treatment 1581.0 -572.56 -0.4938 1017.0 -135.48 -0.1098 -0.4268 -0.8437 3638574 DAlcMix-H_000936 OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)N3CCOCC3)c4csc5ccccc45)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 O24 compound treatment 1169.0 -984.56 -0.8491 900.0 -252.48 -0.2045 -0.7451 -0.853 2022707 DAlcMix-H_000937 CCO[C@H]1OC(=C[C@H]([C@@H]1CCCO)c2coc3ccccc3c2=O)C(=O)N4CCN(Cc5ccc6OCOc6c5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P01 compound treatment 1994.0 -159.56 -0.1376 1570.0 417.52 0.3382 0.1419 0.3885 3650041 DAlcMix-H_000938 C[N+](C)(C)CCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P02 compound treatment 865.0 -1288.6 -1.1113 653.0 -499.48 -0.4046 -1.0719 -0.9064 3650112 DAlcMix-H_000939 OC(=O)C(=O)NCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P03 compound treatment 1565.0 -588.56 -0.5076 1272.0 119.52 0.0968 -0.2905 -0.5621 3650042 DAlcMix-H_000940 C[N+](C)(CCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P04 compound treatment 2277.0 123.44 0.1065 643.0 -509.48 -0.4127 -0.2166 -0.5081 3650113 DAlcMix-H_000941 COC(=O)C[N+](C)(C)CCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P05 compound treatment 2282.0 128.44 0.1108 1755.0 602.52 0.4881 0.4235 0.8461 3650043 DAlcMix-H_000942 COC(=O)C(=O)NCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P06 compound treatment 1801.0 -352.56 -0.3041 1109.0 -43.478 -0.0352 -0.2399 -0.7838 3650114 DAlcMix-H_000943 O=C(CCN(CC#N)CC#N)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P07 compound treatment 2591.0 437.44 0.3773 1507.0 354.52 0.2872 0.4699 0.9909 3650044 DAlcMix-H_000944 CN(C)CCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P08 compound treatment 1062.0 -1091.6 -0.9414 718.0 -434.48 -0.352 -0.9146 -0.91 3650115 DAlcMix-H_000945 CN(CCCCCCNC(=O)OCc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P09 compound treatment 558.0 -1595.6 -1.3761 1365.0 212.52 0.1722 -0.8513 -0.6139 3650045 DAlcMix-H_000946 C[N+](C)(C)CCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P10 compound treatment 1976.0 -177.56 -0.1531 1341.0 188.52 0.1527 -3.0E-4 -0.0014 3650116 DAlcMix-H_000947 CN(C)CCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P11 mock treatment 2935.0 781.44 0.674 842.0 -310.48 -0.2515 0.2987 0.4152 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P12 mock treatment 1971.0 -182.56 -0.1575 808.0 -344.48 -0.2791 -0.3087 -0.9633 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P13 compound treatment 2450.0 296.44 0.2557 1164.0 11.522 0.0093 0.1874 0.7324 3650046 DAlcMix-H_000948 C[N+](C)(CCCCCC(=O)Nc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P14 compound treatment 1420.0 -733.56 -0.6327 571.0 -581.48 -0.4711 -0.7805 -0.9895 3650117 DAlcMix-H_000949 C[N+](C)(CCC(=O)Nc1ccccc1)CC#N 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P15 compound treatment 2362.0 208.44 0.1798 863.0 -289.48 -0.2345 -0.0387 -0.131 3650047 DAlcMix-H_000950 COC(=O)C(=O)NCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P16 compound treatment 2046.0 -107.56 -0.0928 1103.0 -49.478 -0.0401 -0.0939 -0.9296 3650118 DAlcMix-H_000951 COC(=O)C(=O)NCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P17 compound treatment 2238.0 84.438 0.0728 1080.0 -72.478 -0.0587 0.01 0.1066 3650048 DAlcMix-H_000952 COC(=O)C(=O)NCCCCCCNC(=O)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P18 compound treatment 1764.0 -389.56 -0.336 891.0 -261.48 -0.2118 -0.3874 -0.9753 3650119 DAlcMix-H_000953 COC(=O)[C@H](CCCCNCC#N)NC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P19 compound treatment 163.0 -1990.6 -1.7168 45.0 -1107.5 -0.8972 -1.8483 -0.9542 3650049 DAlcMix-H_000954 O=C(NCCCCCN(CC#C)CC#C)OCc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P20 compound treatment 1885.0 -268.56 -0.2316 686.0 -466.48 -0.3779 -0.431 -0.9724 3650121 DAlcMix-H_000955 COC(=O)[C@H](CCCCN(CC#N)CC#N)NC(=O)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P21 mock treatment 2578.0 424.44 0.3661 708.0 -444.48 -0.3601 0.0042 0.0082 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P22 compound treatment 1540.0 -613.56 -0.5292 1120.0 -32.478 -0.0263 -0.3928 -0.7413 3650123 DAlcMix-H_000956 C[N+](C)(CCCCCCNC(=O)OCc1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P23 mock treatment 1404.0 -749.56 -0.6465 745.0 -407.48 -0.3301 -0.6905 -0.9513 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2465 P24 compound treatment 1176.0 -977.56 -0.8431 1033.0 -119.48 -0.0968 -0.6646 -0.7831 3650124 DAlcMix-H_000957 COC(=O)C(=O)NCCCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A01 compound treatment 8.0 -1520.4 -1.3113 837.0 -680.17 -0.551 -1.3168 -0.9258 3652363 HDAC1-H_000001 COc1cc2nc(Cl)nc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A02 compound treatment 1660.0 131.59 0.1135 1399.0 -118.17 -0.0957 0.0126 0.0846 3652364 HDAC1-H_000002 ONC(=O)CCc1cn(nn1)c2cccc(c2)C(=O)N3CCN(CC3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A03 compound treatment 2393.0 864.59 0.7457 1447.0 -70.169 -0.0568 0.4871 0.6513 3652365 HDAC1-H_000003 COc1cc2nc(Cl)nc(NC3CCCCC3)c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A04 compound treatment 1037.0 -491.41 -0.4238 1899.0 381.83 0.3093 -0.081 -0.1543 3652366 HDAC1-H_000004 COc1ccc(NC(=O)Cn2cc(CCC(=O)NO)nn2)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A05 compound treatment 973.0 -555.41 -0.479 307.0 -1210.2 -0.9804 -1.0319 -0.9457 3652367 HDAC1-H_000005 COc1cc2nc(Cl)nc(Nc3ccc(F)c(Cl)c3)c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A06 compound treatment 1869.0 340.59 0.2937 2128.0 610.83 0.4948 0.5576 0.969 3652368 HDAC1-H_000006 ONC(=O)CCc1cn(nn1)c2ccc3[nH]ccc3c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A07 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3650892 HDAC1-H_000007 COc1cc2nc(nc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC)N5CCCN(C)CC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A08 compound treatment 1056.0 -472.41 -0.4074 1068.0 -449.17 -0.3639 -0.5454 -0.9984 3652369 HDAC1-H_000008 CCOc1cc(OCC)cc(c1)C(=O)N[C@@H](Cc2ccc(cc2)n3cc(CCC(=O)NO)nn3)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A09 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3652371 HDAC1-H_000009 COc1cc2nc(nc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC)N5CCCCCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A10 compound treatment 588.0 -940.41 -0.8111 582.0 -935.17 -0.7576 -1.1092 -0.9994 3652372 HDAC1-H_000010 COC(=O)[C@@H](NC(=O)Cn1cc(nn1)c2cccc(/C=C/C(=O)NO)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A11 compound treatment 35.0 -1493.4 -1.288 6.0 -1511.2 -1.2242 -1.7764 -0.9997 3652374 HDAC1-H_000011 COc1cc2nc(nc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC)N5CCCN(Cc6ccccc6)CC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A12 compound treatment 1803.0 274.59 0.2368 683.0 -834.17 -0.6758 -0.3104 -0.4335 3652375 HDAC1-H_000012 CC(C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCCn2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A13 mock treatment 2158.0 629.59 0.543 2221.0 703.83 0.5702 0.7871 0.9997 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A14 mock treatment 1904.0 375.59 0.3239 1044.0 -473.17 -0.3833 -0.042 -0.0837 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A15 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3652377 HDAC1-H_000013 COc1cc2nc(nc(NC3CCCCC3)c2cc1OC)N4CCCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A16 compound treatment 60.0 -1468.4 -1.2664 32.0 -1485.2 -1.2032 -1.7463 -0.9997 3652378 HDAC1-H_000014 COc1ccc(cc1)n2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A17 compound treatment 165.0 -1363.4 -1.1759 3.0 -1514.2 -1.2266 -1.6988 -0.9998 3652380 HDAC1-H_000015 COc1cc2nc(nc(NC3CCCCC3)c2cc1OC)N4CCCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A18 compound treatment 1724.0 195.59 0.1687 1451.0 -66.169 -0.0536 0.0814 0.4598 3652381 HDAC1-H_000016 COC(=O)[C@@H](NC(=O)Cn1cc(CCC(=O)NO)nn1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A19 compound treatment 0.0 -1528.4 -1.3182 13.0 -1504.2 -1.2185 -1.7937 -0.9992 3652383 HDAC1-H_000017 COc1cc2nc(nc(NC3CCCCC3)c2cc1OC)N4CCCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A20 compound treatment 1077.0 -451.41 -0.3893 1484.0 -33.169 -0.0269 -0.2943 -0.7541 3652384 HDAC1-H_000018 CC(C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCCn2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A21 compound treatment 3.0 -1525.4 -1.3156 0.0 -1517.2 -1.2291 -1.7994 -0.9994 3652386 HDAC1-H_000019 COc1cc2nc(nc(Nc3ccc(F)c(Cl)c3)c2cc1OC)N4CCCN(C)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A22 compound treatment 619.0 -909.41 -0.7843 946.0 -571.17 -0.4627 -0.8818 -0.9683 3652387 HDAC1-H_000020 COc1ccc(cc1)n2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A23 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3652388 HDAC1-H_000021 COc1cc2nc(nc(Nc3ccc(F)c(Cl)c3)c2cc1OC)N4CCCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 A24 compound treatment 250.0 -1278.4 -1.1026 200.0 -1317.2 -1.0671 -1.5342 -0.9999 3652372 HDAC1-H_000022 COC(=O)[C@@H](NC(=O)Cn1cc(nn1)c2cccc(/C=C/C(=O)NO)c2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B01 compound treatment 2531.0 1002.6 0.8647 2033.0 515.83 0.4179 0.9069 0.9443 1003435 HDAC1-H_000023 OC(=O)c1ccc(O)c(c1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B02 compound treatment 9.0 -1519.4 -1.3104 0.0 -1517.2 -1.2291 -1.7957 -0.9995 3652389 HDAC1-H_000024 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)[C@@H]2O[C@H](CSc3nc(c(o3)c4ccccc4)c5ccccc5)C[C@@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B03 compound treatment 2298.0 769.59 0.6637 2233.0 715.83 0.5799 0.8794 0.9977 3652390 HDAC1-H_000025 O=C(NCCCNC(=O)c1ccccn1)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B04 compound treatment 1764.0 235.59 0.2032 1926.0 408.83 0.3312 0.3779 0.9725 3652391 HDAC1-H_000026 NCCCn1cc(CNc2ccc(cc2)C(=O)NCCCCCCC(=O)NO)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B05 compound treatment 2531.0 1002.6 0.8647 2423.0 905.83 0.7338 1.1303 0.9967 3652392 HDAC1-H_000027 COC(=O)c1ccc(nc1)C(=O)NCCCNC(=O)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B06 compound treatment 78.0 -1450.4 -1.2509 106.0 -1411.2 -1.1432 -1.6929 -0.999 3635011 HDAC1-H_000028 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B07 compound treatment 1947.0 418.59 0.361 1955.0 437.83 0.3547 0.5061 1.0 3652393 HDAC1-H_000029 O=C(NCCCCNC(=O)c1ccccn1)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B08 compound treatment 10.0 -1518.4 -1.3096 4.0 -1513.2 -1.2258 -1.7928 -0.9995 3634742 HDAC1-H_000030 CN(C[C@H]1C[C@H](OC(O1)c2ccc(NC(=O)CCCCCCC(=O)NO)cc2)c3ccc(CO)cc3)Cc4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B09 compound treatment 2965.0 1436.6 1.239 1989.0 471.83 0.3822 1.1464 0.8841 3652394 HDAC1-H_000031 COC(=O)c1ccc(nc1)C(=O)NCCCCNC(=O)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B10 compound treatment 1180.0 -348.41 -0.3005 1456.0 -61.169 -0.0496 -0.2475 -0.8127 3634942 HDAC1-H_000032 ONC(=O)CCCCCCC(=O)Nc1cccc(c1)C(=O)NCCOCCOCCNC(=O)c2cccc(NC(=O)CCCCCCC(=O)NO)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B11 compound treatment 1667.0 138.59 0.1195 1688.0 170.83 0.1384 0.1824 0.9973 3652395 HDAC1-H_000033 O=C(NCCCCCNC(=O)c1ccccn1)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B12 compound treatment 1463.0 -65.411 -0.0564 1407.0 -110.17 -0.0892 -0.103 -0.9755 3634875 HDAC1-H_000034 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C(=O)NCCOCCOCCNC(=O)c2ccc(NC(=O)CCCCCCC(=O)NO)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B13 mock treatment 2336.0 807.59 0.6965 2525.0 1007.8 0.8165 1.0698 0.9969 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B14 mock treatment 1532.0 3.5891 0.0031 718.0 -799.17 -0.6474 -0.4556 -0.7037 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B15 compound treatment 885.0 -643.41 -0.5549 805.0 -712.17 -0.5769 -0.8003 -0.9998 3652396 HDAC1-H_000035 O=C(NCCCCCCNC(=O)c1ccccn1)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B16 compound treatment 1268.0 -260.41 -0.2246 1606.0 88.831 0.072 -0.1079 -0.4576 3652397 HDAC1-H_000036 ONC(=O)CCCCCCNC(=O)c1ccc(NCc2cn(Cc3ccc(Cn4cc(CNc5ccc(cc5)C(=O)NCCCCCCC(=O)O)nn4)cc3)nn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B17 compound treatment 1476.0 -52.411 -0.0452 1955.0 437.83 0.3547 0.2188 0.612 3652398 HDAC1-H_000037 COC(=O)c1ccc(nc1)C(=O)NCCCCCCNC(=O)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B18 compound treatment 3.0 -1525.4 -1.3156 4.0 -1513.2 -1.2258 -1.7971 -0.9994 3635064 HDAC1-H_000038 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CSc3nc4ccccc4o3)CC(O2)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B19 compound treatment 1916.0 387.59 0.3343 2021.0 503.83 0.4082 0.525 0.9951 3652399 HDAC1-H_000039 CC(C)(C)OC(=O)NCCCNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B20 compound treatment 10.0 -1518.4 -1.3096 15.0 -1502.2 -1.2169 -1.7865 -0.9993 3634604 HDAC1-H_000040 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CN3CCCCCCC3)CC(O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B21 compound treatment 1488.0 -40.411 -0.0349 1184.0 -333.17 -0.2699 -0.2155 -0.7918 3652400 HDAC1-H_000041 CC(C)(C)OC(=O)NCCCCNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B22 compound treatment 4.0 -1524.4 -1.3147 0.0 -1517.2 -1.2291 -1.7988 -0.9994 3634671 HDAC1-H_000042 CN(CC=C)CC1CC(OC(O1)c2ccc(NC(=O)CCCCCCC(=O)NO)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B23 compound treatment 651.0 -877.41 -0.7567 935.0 -582.17 -0.4716 -0.8686 -0.9741 3652401 HDAC1-H_000043 CC(C)(C)OC(=O)NCCCCCNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 B24 compound treatment 1.0 -1527.4 -1.3173 3.0 -1514.2 -1.2266 -1.7989 -0.9994 3652402 HDAC1-H_000044 ONC(=O)/C=C/c1ccc(CNCCc2c[nH]c3ccccc23)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C01 compound treatment 88.0 -1440.4 -1.2423 40.0 -1477.2 -1.1967 -1.7246 -0.9998 3652404 HDAC1-H_000045 COc1cc2nc(nc(Nc3ccc(F)c(Cl)c3)c2cc1OC)N4CCCN(Cc5ccccc5)CC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C02 compound treatment 993.0 -535.41 -0.4618 781.0 -736.17 -0.5964 -0.7482 -0.992 3652375 HDAC1-H_000046 CC(C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCCn2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C03 compound treatment 12.0 -1516.4 -1.3078 15.0 -1502.2 -1.2169 -1.7853 -0.9994 1429650 HDAC1-H_000047 COc1cc2ncnc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C04 compound treatment 338.0 -1190.4 -1.0267 239.0 -1278.2 -1.0355 -1.4582 -1.0 3652405 HDAC1-H_000048 COc1ccc(OC)c(NC(=O)Cn2cc(nn2)c3cccc(/C=C/C(=O)NO)c3)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C05 compound treatment 1117.0 -411.41 -0.3548 1044.0 -473.17 -0.3833 -0.5219 -0.9993 3652407 HDAC1-H_000049 COc1cc2nc(Cl)nc(OC3CCN(Cc4ccccc4)CC3)c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C06 compound treatment 696.0 -832.41 -0.7179 772.0 -745.17 -0.6037 -0.9345 -0.9963 3652408 HDAC1-H_000050 CCOC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn3cc(nn3)c4cccc(/C=C/C(=O)NO)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C07 compound treatment 841.0 -687.41 -0.5929 391.0 -1126.2 -0.9123 -1.0643 -0.9782 3652410 HDAC1-H_000051 COc1cc2nc(nc(OC3CCN(Cc4ccccc4)CC3)c2cc1OC)N5CCCN(C)CC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C08 compound treatment 796.0 -732.41 -0.6317 886.0 -631.17 -0.5113 -0.8082 -0.9945 3652411 HDAC1-H_000052 ONC(=O)/C=C/c1cccc(c1)c2cn(CC(=O)N3CCOCC3)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C09 compound treatment 1413.0 -115.41 -0.0995 1136.0 -381.17 -0.3088 -0.2887 -0.8899 3652413 HDAC1-H_000053 Oc1nc(O)c2cc(Br)ccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C10 compound treatment 770.0 -758.41 -0.6541 989.0 -528.17 -0.4279 -0.7651 -0.9788 3652414 HDAC1-H_000054 CN1CCN(CC1)C(=O)Cn2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C11 mock treatment 1130.0 -398.41 -0.3436 1354.0 -163.17 -0.1322 -0.3364 -0.9138 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C12 mock treatment 1255.0 -273.41 -0.2358 1318.0 -199.17 -0.1613 -0.2808 -0.9829 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C13 compound treatment 1298.0 -230.41 -0.1987 1181.0 -336.17 -0.2723 -0.3331 -0.988 3652416 HDAC1-H_000055 Clc1nc(Cl)c2cc(Br)ccc2n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C14 compound treatment 431.0 -1097.4 -0.9465 762.0 -755.17 -0.6118 -1.1018 -0.9777 3652417 HDAC1-H_000056 ONC(=O)/C=C/c1cccc(c1)c2cn(CC(=O)Nc3nccs3)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C15 mock treatment 1335.0 -193.41 -0.1668 1264.0 -253.17 -0.2051 -0.263 -0.9947 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C16 mock treatment 663.0 -865.41 -0.7464 917.0 -600.17 -0.4862 -0.8716 -0.9784 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C17 compound treatment 962.0 -566.41 -0.4885 1029.0 -488.17 -0.3955 -0.6251 -0.9945 3652419 HDAC1-H_000057 COc1ccc2nc(O)nc(O)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C18 compound treatment 338.0 -1190.4 -1.0267 423.0 -1094.2 -0.8864 -1.3528 -0.9973 3652420 HDAC1-H_000058 ONC(=O)/C=C/c1cccc(c1)c2cn(CC(=O)Nc3ccon3)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C19 compound treatment 3.0 -1525.4 -1.3156 2.0 -1515.2 -1.2275 -1.7982 -0.9994 3652422 HDAC1-H_000059 Clc1nc(NC2CCCCC2)c3cc(Br)ccc3n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C20 compound treatment 390.0 -1138.4 -0.9818 443.0 -1074.2 -0.8702 -1.3096 -0.9982 3652423 HDAC1-H_000060 ONC(=O)/C=C/c1cccc(c1)c2cn(CCCNC(=O)Nc3ccccc3)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C21 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3652425 HDAC1-H_000061 COc1ccc2nc(Cl)nc(Cl)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C22 compound treatment 311.0 -1217.4 -1.05 324.0 -1193.2 -0.9666 -1.4259 -0.9991 3652426 HDAC1-H_000062 ONC(=O)/C=C/c1cccc(c1)c2cn(CCNC(=O)Nc3ccccc3)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C23 compound treatment 2.0 -1526.4 -1.3165 0.0 -1517.2 -1.2291 -1.8 -0.9994 3652428 HDAC1-H_000063 Clc1nc(NC2CCN(Cc3ccccc3)CC2)c4cc(Br)ccc4n1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 C24 compound treatment 2.0 -1526.4 -1.3165 1.0 -1516.2 -1.2283 -1.7994 -0.9994 3652429 HDAC1-H_000064 ONC(=O)/C=C/c1cccc(c1)c2cn(C[C@H](Cc3ccccc3)NC(=O)c4ccccc4)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D01 compound treatment 1406.0 -122.41 -0.1056 1868.0 350.83 0.2842 0.1263 0.4166 3652431 HDAC1-H_000065 CC(C)(C)OC(=O)NCCCCCCNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D02 compound treatment 1415.0 -113.41 -0.0978 2169.0 651.83 0.5281 0.3042 0.5665 3652432 HDAC1-H_000066 ONC(=O)/C=C/c1ccc(CN(CCc2c[nH]c3ccccc23)C(=O)CCCCC(=O)N(CCc4c[nH]c5ccccc45)Cc6ccc(\C=C\C(=O)NO)cc6)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D03 compound treatment 2324.0 795.59 0.6862 2160.0 642.83 0.5208 0.8534 0.9907 3652434 HDAC1-H_000067 COC(=O)[C@H](CCCCNC(=O)c1ccccn1)NC(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D04 compound treatment 5.0 -1523.4 -1.3139 4.0 -1513.2 -1.2258 -1.7959 -0.9994 3652436 HDAC1-H_000068 OCCN(CCc1c[nH]c2ccccc12)Cc3ccc(/C=C/C(=O)O)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D05 compound treatment 2215.0 686.59 0.5922 2272.0 754.83 0.6115 0.8511 0.9999 3652438 HDAC1-H_000069 COC(=O)c1ccc(nc1)C(=O)NCCCNC(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D06 compound treatment 1498.0 -30.411 -0.0262 1638.0 120.83 0.0979 0.0507 0.5 3652439 HDAC1-H_000070 OC(=O)/C=C/c1ccc(CNCCc2c[nH]c3ccccc23)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D07 compound treatment 2760.0 1231.6 1.0622 2342.0 824.83 0.6682 1.2236 0.975 3652441 HDAC1-H_000071 COC(=O)c1ccc(nc1)C(=O)NCCCCNC(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D08 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3622998 HDAC1-H_000072 OCCN(CCc1c[nH]c2ccccc12)Cc3ccc(/C=C/C(=O)NO)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D09 compound treatment 1015.0 -513.41 -0.4428 1726.0 208.83 0.1692 -0.1935 -0.4082 3652442 HDAC1-H_000073 COC(=O)c1ccc(nc1)C(=O)NCCCCCNC(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D10 mock treatment 1565.0 36.589 0.0316 2038.0 520.83 0.4219 0.3207 0.7579 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D11 mock treatment 1769.0 240.59 0.2075 1881.0 363.83 0.2947 0.3551 0.9852 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D12 mock treatment 1422.0 -106.41 -0.0918 2212.0 694.83 0.5629 0.3331 0.5841 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D13 compound treatment 1624.0 95.589 0.0824 2398.0 880.83 0.7136 0.5629 0.7836 3652443 HDAC1-H_000074 COC(=O)[C@H](CCCCNC(=O)c1ccc(cn1)C(=O)OC)NC(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D14 mock treatment 1335.0 -193.41 -0.1668 1693.0 175.83 0.1424 -0.0172 -0.0785 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D15 mock treatment 2075.0 546.59 0.4714 1782.0 264.83 0.2145 0.485 0.9365 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D16 mock treatment 1156.0 -372.41 -0.3212 1525.0 7.8308 0.0063 -0.2226 -0.693 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D17 compound treatment 1652.0 123.59 0.1066 1870.0 352.83 0.2858 0.2775 0.9096 3652445 HDAC1-H_000075 CCOC(=O)CCCNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D18 mock treatment 1060.0 -468.41 -0.404 1348.0 -169.17 -0.137 -0.3826 -0.8968 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D19 compound treatment 1632.0 103.59 0.0893 1578.0 60.831 0.0493 0.098 0.9607 3652446 HDAC1-H_000076 CCOC(=O)CCCCNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D20 mock treatment 1317.0 -211.41 -0.1823 250.0 -1267.2 -1.0266 -0.8548 -0.8199 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D21 compound treatment 1352.0 -176.41 -0.1521 1338.0 -179.17 -0.1451 -0.2102 -0.9997 3652447 HDAC1-H_000077 COC(=O)CCCCCNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D22 mock treatment 942.0 -586.41 -0.5058 1086.0 -431.17 -0.3493 -0.6046 -0.9837 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D23 compound treatment 1195.0 -333.41 -0.2876 1271.0 -246.17 -0.1994 -0.3443 -0.984 3652448 HDAC1-H_000078 CN(CCCNC(=O)c1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 D24 mock treatment 1272.0 -256.41 -0.2211 570.0 -947.17 -0.7673 -0.6989 -0.8753 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E01 mock treatment 1857.0 328.59 0.2834 1788.0 270.83 0.2194 0.3555 0.992 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E02 mock treatment 825.0 -703.41 -0.6067 1328.0 -189.17 -0.1532 -0.5373 -0.8588 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E03 compound treatment 144.0 -1384.4 -1.194 157.0 -1360.2 -1.1019 -1.6234 -0.9992 3652449 HDAC1-H_000079 COc1ccc2nc(Cl)nc(NC3CCN(Cc4ccccc4)CC3)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E04 compound treatment 642.0 -886.41 -0.7645 1332.0 -185.17 -0.15 -0.6466 -0.83 3652450 HDAC1-H_000080 ONC(=O)/C=C/c1cccc(c1)c2cn(CC(=O)N3CCC4(CC3)N(CNC4=O)c5ccccc5)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E05 compound treatment 941.0 -587.41 -0.5066 605.0 -912.17 -0.739 -0.8808 -0.983 3652452 HDAC1-H_000081 COc1ccc2nc(Cl)nc(NC3CCCCC3)c2c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E06 compound treatment 538.0 -990.41 -0.8542 1310.0 -207.17 -0.1678 -0.7227 -0.8302 3652453 HDAC1-H_000082 CCOC(=O)[C@H](Cc1ccccc1)NC(=O)Cn2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E07 compound treatment 2.0 -1526.4 -1.3165 266.0 -1251.2 -1.0136 -1.6476 -0.9917 3652455 HDAC1-H_000083 COc1cc2nc(Cl)nc(Cl)c2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E08 compound treatment 758.0 -770.41 -0.6644 803.0 -714.17 -0.5786 -0.8789 -0.9976 3652456 HDAC1-H_000084 Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)NCCn3cc(nn3)c4cccc(/C=C/C(=O)NO)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E09 mock treatment 2074.0 545.59 0.4705 1153.0 -364.17 -0.295 0.1241 0.2235 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E10 mock treatment 1918.0 389.59 0.336 1533.0 15.831 0.0128 0.2467 0.7336 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E11 compound treatment 2.0 -1526.4 -1.3165 0.0 -1517.2 -1.2291 -1.8 -0.9994 3652458 HDAC1-H_000085 CN1CCCN(CC1)c2nc(NC3CCN(Cc4ccccc4)CC3)c5cc(Br)ccc5n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E12 compound treatment 1032.0 -496.41 -0.4281 1094.0 -423.17 -0.3428 -0.5451 -0.9939 3652459 HDAC1-H_000086 Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)NCCCn3cc(nn3)c4cccc(/C=C/C(=O)NO)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E13 compound treatment 1.0 -1527.4 -1.3173 0.0 -1517.2 -1.2291 -1.8006 -0.9994 3652461 HDAC1-H_000087 Brc1ccc2nc(nc(NC3CCN(Cc4ccccc4)CC3)c2c1)N5CCCN(Cc6ccccc6)CC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E14 compound treatment 288.0 -1240.4 -1.0698 166.0 -1351.2 -1.0946 -1.5305 -0.9999 3652462 HDAC1-H_000088 ONC(=O)/C=C/c1cccc(c1)c2cn(C[C@H](Cc3ccccc3)NC(=O)Nc4ccccc4)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E15 compound treatment 1.0 -1527.4 -1.3173 1.0 -1516.2 -1.2283 -1.8 -0.9994 3652464 HDAC1-H_000089 Brc1ccc2nc(nc(NC3CCN(Cc4ccccc4)CC3)c2c1)N5CCCCCC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E16 compound treatment 689.0 -839.41 -0.724 190.0 -1327.2 -1.0752 -1.2722 -0.9815 3652465 HDAC1-H_000090 Cc1ccc(cc1)S(=O)(=O)N2CCC[C@H]2Cn3cc(nn3)c4cccc(/C=C/C(=O)NO)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E17 mock treatment 2209.0 680.59 0.587 1276.0 -241.17 -0.1954 0.2769 0.4476 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E18 mock treatment 2131.0 602.59 0.5197 1374.0 -143.17 -0.116 0.2855 0.5361 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E19 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3652467 HDAC1-H_000091 COc1ccc2nc(nc(NC3CCN(Cc4ccccc4)CC3)c2c1)N5CCCN(C)CC5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E20 compound treatment 933.0 -595.41 -0.5135 1038.0 -479.17 -0.3882 -0.6376 -0.9905 3652468 HDAC1-H_000092 CC(C)(C)OC(=O)N/C(=N\C(=O)OC(C)(C)C)/NCCn1cc(nn1)c2cccc(/C=C/C(=O)NO)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E21 compound treatment 0.0 -1528.4 -1.3182 1.0 -1516.2 -1.2283 -1.8006 -0.9994 3652470 HDAC1-H_000093 CN1CCCN(CC1)c2nc(NC3CCCCC3)c4cc(Br)ccc4n2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E22 compound treatment 490.0 -1038.4 -0.8956 652.0 -865.17 -0.7009 -1.1289 -0.9926 3652471 HDAC1-H_000094 CC(C)(C)OC(=O)N/C(=N\C(=O)OC(C)(C)C)/NCCCn1cc(nn1)c2cccc(/C=C/C(=O)NO)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E23 compound treatment 27.0 -1501.4 -1.2949 32.0 -1485.2 -1.2032 -1.7664 -0.9993 3652473 HDAC1-H_000095 Brc1ccc2nc(nc(NC3CCCCC3)c2c1)N4CCCCCC4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 E24 compound treatment 434.0 -1094.4 -0.9439 334.0 -1183.2 -0.9585 -1.3452 -1.0 3652474 HDAC1-H_000096 CC(C)(C)ONC(=O)c1cccc(c1)n2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F01 mock treatment 1563.0 34.589 0.0298 1731.0 213.83 0.1732 0.1436 0.8169 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F02 mock treatment 705.0 -823.41 -0.7102 1550.0 32.831 0.0266 -0.4834 -0.6801 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F03 compound treatment 1888.0 359.59 0.3101 2109.0 591.83 0.4795 0.5583 0.9778 3652476 HDAC1-H_000097 CN(CCCCNC(=O)c1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F04 mock treatment 1355.0 -173.41 -0.1496 2314.0 796.83 0.6455 0.3507 0.5293 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F05 compound treatment 1193.0 -335.41 -0.2893 1191.0 -326.17 -0.2642 -0.3914 -0.999 3652477 HDAC1-H_000098 CN(CCCCCCNC(=O)c1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F06 mock treatment 1450.0 -78.411 -0.0676 1722.0 204.83 0.1659 0.0695 0.3879 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F07 compound treatment 1932.0 403.59 0.3481 2589.0 1071.8 0.8683 0.8601 0.9194 3652478 HDAC1-H_000099 COC(=O)C(=O)NCCCCCCNC(=O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F08 mock treatment 1574.0 45.589 0.0393 1749.0 231.83 0.1878 0.1606 0.837 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F09 mock treatment 2295.0 766.59 0.6612 2392.0 874.83 0.7087 0.9686 0.9994 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F10 mock treatment 1361.0 -167.41 -0.1444 2109.0 591.83 0.4795 0.2369 0.4732 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F11 compound treatment 1738.0 209.59 0.1808 2128.0 610.83 0.4948 0.4777 0.9068 3652479 HDAC1-H_000100 O=C(NCCCCNC(=O)c1ccccn1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F12 mock treatment 1589.0 60.589 0.0523 2019.0 501.83 0.4065 0.3244 0.7915 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F13 compound treatment 1935.0 406.59 0.3507 2574.0 1056.8 0.8562 0.8534 0.9224 3652480 HDAC1-H_000101 O=C(NCCCCCNC(=O)c1ccccn1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F14 mock treatment 1340.0 -188.41 -0.1625 1838.0 320.83 0.2599 0.0689 0.2247 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F15 compound treatment 1678.0 149.59 0.129 1775.0 257.83 0.2089 0.2389 0.9732 3652481 HDAC1-H_000102 O=C(NCCCCCCNC(=O)c1ccccn1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F16 mock treatment 1148.0 -380.41 -0.3281 2054.0 536.83 0.4349 0.0755 0.1386 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F17 mock treatment 3490.0 1961.6 1.6918 2239.0 721.83 0.5848 1.6098 0.8993 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F18 mock treatment 1481.0 -47.411 -0.0409 1180.0 -337.17 -0.2731 -0.2221 -0.804 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F19 compound treatment 1196.0 -332.41 -0.2867 1390.0 -127.17 -0.103 -0.2756 -0.9046 3652482 HDAC1-H_000103 COC(=O)c1ccc(nc1)C(=O)NCCCCCNC(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F20 mock treatment 790.0 -738.41 -0.6368 1254.0 -263.17 -0.2132 -0.6011 -0.895 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F21 compound treatment 1233.0 -295.41 -0.2548 1456.0 -61.169 -0.0496 -0.2152 -0.8291 3616541 HDAC1-H_000104 N[C@H]1C[C@@H]1c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F22 mock treatment 1723.0 194.59 0.1678 1529.0 11.831 0.0096 0.1254 0.7463 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F23 compound treatment 1115.0 -413.41 -0.3565 1422.0 -95.169 -0.0771 -0.3066 -0.8406 1088402 HDAC1-H_000105 COC(=O)c1ccc(nc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 F24 mock treatment 693.0 -835.41 -0.7205 1217.0 -300.17 -0.2432 -0.6814 -0.8961 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G01 compound treatment 1677.0 148.59 0.1282 1452.0 -65.169 -0.0528 0.0533 0.3845 3652483 HDAC1-H_000106 COc1cccc(c1)n2cc(nn2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G02 compound treatment 264.0 -1264.4 -1.0905 198.0 -1319.2 -1.0687 -1.5268 -0.9999 3652378 HDAC1-H_000107 COc1ccc(cc1)n2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G03 mock treatment 2056.0 527.59 0.455 2431.0 913.83 0.7403 0.8452 0.9727 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G04 mock treatment 1750.0 221.59 0.1911 1665.0 147.83 0.1198 0.2198 0.9747 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G05 compound treatment 1990.0 461.59 0.3981 1458.0 -59.169 -0.0479 0.2476 0.6175 3652484 HDAC1-H_000108 COc1ccc(cc1)n2cc(nn2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G06 compound treatment 655.0 -873.41 -0.7533 481.0 -1036.2 -0.8394 -1.1262 -0.9985 3652485 HDAC1-H_000109 COc1cccc(c1)n2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G07 compound treatment 2009.0 480.59 0.4145 2073.0 555.83 0.4503 0.6115 0.9991 3652487 HDAC1-H_000110 ONC(=O)c1cn(nn1)c2cccc(c2)C(=O)N3CCC4(CC3)N(CNC4=O)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G08 compound treatment 1909.0 380.59 0.3282 1828.0 310.83 0.2518 0.4102 0.9914 3652488 HDAC1-H_000111 CC(C)(C)ONC(=O)Cn1cc(nn1)c2cccc(/C=C/C(=O)NO)c2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G09 compound treatment 1826.0 297.59 0.2567 1301.0 -216.17 -0.1751 0.0577 0.1856 3652490 HDAC1-H_000112 COC(=O)c1ccc(Cn2cc(nn2)C(=O)NO)o1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G10 compound treatment 28.0 -1500.4 -1.294 6.0 -1511.2 -1.2242 -1.7807 -0.9996 3652491 HDAC1-H_000113 ONC(=O)/C=C/c1cccc(c1)c2cn(nn2)c3ccc(NC(=O)c4ccccc4)cc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G11 compound treatment 2375.0 846.59 0.7301 1785.0 267.83 0.217 0.6697 0.8792 3652493 HDAC1-H_000114 COC(=O)[C@@H](N)Cc1ccc(cc1)n2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G12 compound treatment 1746.0 217.59 0.1877 783.0 -734.17 -0.5948 -0.2879 -0.4616 3652495 HDAC1-H_000115 Nc1ccc(cc1)n2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G13 compound treatment 1932.0 403.59 0.3481 2124.0 606.83 0.4916 0.5937 0.9857 3652497 HDAC1-H_000116 Nc1ccc(cc1)n2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G14 compound treatment 1541.0 12.589 0.0109 1422.0 -95.169 -0.0771 -0.0468 -0.6016 3652498 HDAC1-H_000117 Nc1cccc(c1)n2cc(nn2)c3cccc(/C=C/C(=O)NO)c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G15 compound treatment 1913.0 384.59 0.3317 1559.0 41.831 0.0339 0.2585 0.7753 3652500 HDAC1-H_000118 Nc1cccc(c1)n2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G16 compound treatment 724.0 -804.41 -0.6938 656.0 -861.17 -0.6976 -0.9839 -1.0 3652501 HDAC1-H_000119 ONC(=O)/C=C/c1cccc(c1)c2cn(nn2)c3cccc(c3)C(=O)N4CCC5(CC4)N(CNC5=O)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G17 compound treatment 1836.0 307.59 0.2653 1906.0 388.83 0.315 0.4103 0.9964 3652503 HDAC1-H_000120 COC(=O)[C@@H](NC(=O)Cn1cc(nn1)C(=O)NO)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G18 compound treatment 248.0 -1280.4 -1.1043 403.0 -1114.2 -0.9026 -1.4191 -0.995 3652505 HDAC1-H_000121 ONC(=O)/C=C/c1cccc(c1)c2cn(CC(=O)N3CCN(CC3)c4ccccc4)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G19 mock treatment 1710.0 181.59 0.1566 1745.0 227.83 0.1846 0.2413 0.9967 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G20 mock treatment 1141.0 -387.41 -0.3341 1141.0 -376.17 -0.3047 -0.4517 -0.9989 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G21 compound treatment 956.0 -572.41 -0.4937 240.0 -1277.2 -1.0347 -1.0807 -0.9427 3652507 HDAC1-H_000122 CC(C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCCn2cc(nn2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G22 compound treatment 1.0 -1527.4 -1.3173 1.0 -1516.2 -1.2283 -1.8 -0.9994 3652509 HDAC1-H_000123 COc1ccc(cc1)C(=O)Nc2cccc(c2)n3cc(nn3)c4cccc(/C=C/C(=O)NO)c4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G23 compound treatment 465.0 -1063.4 -0.9171 453.0 -1064.2 -0.8621 -1.2581 -0.9995 3652511 HDAC1-H_000124 COc1ccc(OC)c(NC(=O)Cn2cc(nn2)C(=O)NO)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 G24 compound treatment 2.0 -1526.4 -1.3165 1.0 -1516.2 -1.2283 -1.7994 -0.9994 3652512 HDAC1-H_000125 ONC(=O)/C=C/c1cccc(c1)c2cn(nn2)c3cccc(c3)C(=O)N4CCN(CC4)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H01 compound treatment 1943.0 414.59 0.3576 2063.0 545.83 0.4422 0.5655 0.9944 1002773 HDAC1-H_000126 OC(=O)c1ccc(nc1)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H02 mock treatment 1688.0 159.59 0.1376 1577.0 59.831 0.0485 0.1316 0.9018 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H03 mock treatment 2195.0 666.59 0.5749 2190.0 672.83 0.5451 0.7919 0.9996 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H04 mock treatment 1535.0 6.5891 0.0057 1677.0 159.83 0.1295 0.0956 0.7374 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H05 compound treatment 2730.0 1201.6 1.0363 2152.0 634.83 0.5143 1.0964 0.9477 3614749 HDAC1-H_000127 COC(=O)CNC(=O)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H06 mock treatment 1954.0 425.59 0.3671 1589.0 71.831 0.0582 0.3007 0.8091 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H07 compound treatment 2716.0 1187.6 1.0242 2211.0 693.83 0.5621 1.1217 0.9601 3652514 HDAC1-H_000128 OC(=O)CNC(=O)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H08 mock treatment 1849.0 320.59 0.2765 1817.0 299.83 0.2429 0.3673 0.9979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H09 compound treatment 158.0 -1370.4 -1.1819 52.0 -1465.2 -1.187 -1.675 -1.0 3652515 HDAC1-H_000129 CCOC(=O)/C=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H10 mock treatment 1048.0 -480.41 -0.4143 1771.0 253.83 0.2056 -0.1476 -0.319 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H11 compound treatment 2082.0 553.59 0.4774 1930.0 412.83 0.3344 0.5741 0.9848 1978 HDAC1-H_000130 OC(=O)/C=C/c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H12 mock treatment 1890.0 361.59 0.3119 1747.0 229.83 0.1862 0.3522 0.9696 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H13 compound treatment 2702.0 1173.6 1.0122 2259.0 741.83 0.601 1.1407 0.969 831713 HDAC1-H_000131 OC(=O)c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H14 mock treatment 1492.0 -36.411 -0.0314 1482.0 -35.169 -0.0285 -0.0424 -0.9988 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H15 compound treatment 1056.0 -472.41 -0.4074 866.0 -651.17 -0.5275 -0.6611 -0.9919 1070606 HDAC1-H_000132 COC(=O)c1ccc(O)c(O)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H16 mock treatment 1486.0 -42.411 -0.0366 1282.0 -235.17 -0.1905 -0.1606 -0.8277 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H17 compound treatment 1493.0 -35.411 -0.0305 1159.0 -358.17 -0.2902 -0.2268 -0.7772 3652517 HDAC1-H_000133 COC(=O)c1ccc(nc1)C(=O)NCCCCCNC(=O)OCc2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H18 mock treatment 1377.0 -151.41 -0.1306 1467.0 -50.169 -0.0406 -0.1211 -0.8853 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H19 mock treatment 1785.0 256.59 0.2213 1733.0 215.83 0.1748 0.2801 0.9932 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H20 mock treatment 1044.0 -484.41 -0.4178 864.0 -653.17 -0.5291 -0.6696 -0.9932 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H21 compound treatment 626.0 -902.41 -0.7783 574.0 -943.17 -0.7641 -1.0906 -1.0 3652518 HDAC1-H_000134 COC(=O)c1ccc(nc1)C(=O)NCCCCCCNC(=O)OC(C)(C)C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H22 mock treatment 534.0 -994.41 -0.8576 797.0 -720.17 -0.5834 -1.019 -0.9824 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H23 compound treatment 1170.0 -358.41 -0.3091 1267.0 -250.17 -0.2027 -0.3619 -0.979 3652519 HDAC1-H_000135 CCOC(=O)CCNC(=O)c1ccccn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 H24 mock treatment 809.0 -719.41 -0.6205 833.0 -684.17 -0.5543 -0.8307 -0.9984 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I01 compound treatment 685.0 -843.41 -0.7274 526.0 -991.17 -0.803 -1.0821 -0.9988 3652520 HDAC1-H_000136 CCOC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn3cc(nn3)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I02 compound treatment 1426.0 -102.41 -0.0883 1398.0 -119.17 -0.0965 -0.1307 -0.999 3652522 HDAC1-H_000137 COc1ccc(NC(=O)Cn2cc(nn2)c3cccc(/C=C/C(=O)NO)c3)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I03 compound treatment 2246.0 717.59 0.6189 1957.0 439.83 0.3563 0.6896 0.9656 3652524 HDAC1-H_000138 ONC(=O)c1cn(CCCNC(=O)Nc2ccccc2)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I04 compound treatment 489.0 -1039.4 -0.8964 94.0 -1423.2 -1.1529 -1.4491 -0.9923 3652525 HDAC1-H_000139 ONC(=O)/C=C/c1cccc(c1)c2cn(nn2)c3ccc4[nH]ccc4c3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I05 mock treatment 1998.0 469.59 0.405 2592.0 1074.8 0.8707 0.9021 0.9394 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I06 mock treatment 2385.0 856.59 0.7388 1729.0 211.83 0.1716 0.6437 0.8488 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I07 compound treatment 2557.0 1028.6 0.8871 1935.0 417.83 0.3385 0.8666 0.9127 3652527 HDAC1-H_000140 ONC(=O)c1cn(CCNC(=O)Nc2ccccc2)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I08 compound treatment 46.0 -1482.4 -1.2785 5.0 -1512.2 -1.225 -1.7703 -0.9998 3652528 HDAC1-H_000141 CCOc1cc(OCC)cc(c1)C(=O)N[C@@H](Cc2ccc(cc2)n3cc(nn3)c4cccc(/C=C/C(=O)NO)c4)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I09 compound treatment 798.0 -730.41 -0.6299 731.0 -786.17 -0.6369 -0.8958 -1.0 3652530 HDAC1-H_000142 ONC(=O)c1cn(C[C@H](Cc2ccccc2)NC(=O)c3ccccc3)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I10 compound treatment 5.0 -1523.4 -1.3139 0.0 -1517.2 -1.2291 -1.7981 -0.9994 3622981 HDAC1-H_000143 Nc1ccccc1NC(=O)c2ccc(CNc3nccc(n3)c4cccnc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I11 compound treatment 592.0 -936.41 -0.8076 310.0 -1207.2 -0.9779 -1.2626 -0.9955 3652532 HDAC1-H_000144 ONC(=O)c1cn(CC(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I12 compound treatment 5.0 -1523.4 -1.3139 3.0 -1514.2 -1.2266 -1.7964 -0.9994 3652533 HDAC1-H_000145 COc1ccc(NCc2ccc(cc2)C(=O)Nc3ccccc3N)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I13 compound treatment 468.0 -1060.4 -0.9146 269.0 -1248.2 -1.0112 -1.3617 -0.9987 3652534 HDAC1-H_000146 CCOC(=O)[C@H](Cc1ccccc1)NC(=O)Cn2cc(nn2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I14 compound treatment 7.0 -1521.4 -1.3122 2.0 -1515.2 -1.2275 -1.7958 -0.9994 3652536 HDAC1-H_000147 Cc1ccc(NCc2ccc(cc2)C(=O)Nc3ccccc3N)cc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I15 compound treatment 2158.0 629.59 0.543 1505.0 -12.169 -0.0099 0.377 0.6942 3652537 HDAC1-H_000148 Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)NCCn3cc(nn3)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I16 compound treatment 1117.0 -411.41 -0.3548 709.0 -808.17 -0.6547 -0.7138 -0.9586 3652539 HDAC1-H_000149 O=C(Nc1ccccc1)c2ccc(CNc3nccc(n3)c4cccnc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I17 compound treatment 1768.0 239.59 0.2066 1542.0 24.831 0.0201 0.1603 0.7723 3652540 HDAC1-H_000150 Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)NCCCn3cc(nn3)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I18 compound treatment 332.0 -1196.4 -1.0319 168.0 -1349.2 -1.093 -1.5025 -0.9996 3652542 HDAC1-H_000151 COc1ccc(NCc2ccc(cc2)C(=O)Nc3ccccc3)cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I19 compound treatment 1942.0 413.59 0.3567 1433.0 -84.169 -0.0682 0.204 0.5618 3652543 HDAC1-H_000152 ONC(=O)c1cn(C[C@H](Cc2ccccc2)NC(=O)Nc3ccccc3)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I20 compound treatment 1192.0 -336.41 -0.2901 1260.0 -257.17 -0.2083 -0.3525 -0.9868 3652545 HDAC1-H_000153 [O-][N+](=O)c1ccccc1NC(=O)c2ccc(CNc3nccc(n3)c4cccnc4)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I21 mock treatment 1302.0 -226.41 -0.1953 1476.0 -41.169 -0.0334 -0.1617 -0.8161 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I22 mock treatment 844.0 -684.41 -0.5903 1268.0 -249.17 -0.2019 -0.5601 -0.8979 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I23 compound treatment 1036.0 -492.41 -0.4247 914.0 -603.17 -0.4886 -0.6458 -0.9976 3652546 HDAC1-H_000154 ONC(=O)c1cn(C[C@@H](Cc2ccccc2)NC(=O)Nc3ccccc3)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 I24 compound treatment 280.0 -1248.4 -1.0767 309.0 -1208.2 -0.9788 -1.4534 -0.9989 3652547 HDAC1-H_000155 Cc1ccc(NCc2ccc(cc2)C(=O)Nc3ccccc3)cc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J01 compound treatment 1412.0 -116.41 -0.1004 1177.0 -340.17 -0.2756 -0.2659 -0.9064 3652548 HDAC1-H_000156 CN(CCCCCNC(=O)c1ccccc1)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J02 mock treatment 1022.0 -506.41 -0.4368 1196.0 -321.17 -0.2602 -0.4928 -0.9694 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J03 compound treatment 1810.0 281.59 0.2429 2187.0 669.83 0.5426 0.5554 0.9343 3652549 HDAC1-H_000157 COC(=O)C(=O)NCCCCCNC(=O)c1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J04 mock treatment 1307.0 -221.41 -0.191 1333.0 -184.17 -0.1492 -0.2405 -0.9925 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J05 mock treatment 1486.0 -42.411 -0.0366 1954.0 436.83 0.3539 0.2244 0.6307 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J06 mock treatment 917.0 -611.41 -0.5273 1371.0 -146.17 -0.1184 -0.4566 -0.8449 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J07 compound treatment 1465.0 -63.411 -0.0547 1222.0 -295.17 -0.2391 -0.2078 -0.847 3652550 HDAC1-H_000158 COC(=O)c1ccc(nc1)C(=O)NCCCCNC(=O)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J08 mock treatment 1270.0 -258.41 -0.2229 1264.0 -253.17 -0.2051 -0.3026 -0.9991 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J09 compound treatment 1622.0 93.589 0.0807 2065.0 547.83 0.4438 0.3709 0.8222 1025079 HDAC1-H_000159 COC(=O)c1ccc(nc1)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J10 mock treatment 2116.0 587.59 0.5068 1356.0 -161.17 -0.1306 0.266 0.5083 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J11 compound treatment 4.0 -1524.4 -1.3147 10.0 -1507.2 -1.221 -1.793 -0.9993 3635106 HDAC1-H_000160 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(COc3ccccc3)CC(O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J12 mock treatment 1684.0 155.59 0.1342 1771.0 253.83 0.2056 0.2403 0.9786 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J13 compound treatment 1627.0 98.589 0.085 1209.0 -308.17 -0.2497 -0.1164 -0.4414 3635115 HDAC1-H_000161 COCC1CC(OC(O1)c2ccc(cc2)C3OC(COC)CC(O3)c4ccc(NC(=O)CCCCCCC(=O)NO)cc4)c5ccc(NC(=O)CCCCCCC(=O)NO)cc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J14 mock treatment 1386.0 -142.41 -0.1228 1651.0 133.83 0.1084 -0.0102 -0.0622 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J15 compound treatment 17.0 -1511.4 -1.3035 9.0 -1508.2 -1.2218 -1.7857 -0.9995 3652551 HDAC1-H_000162 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CC#C)CC(O2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J16 mock treatment 1241.0 -287.41 -0.2479 1595.0 77.831 0.0631 -0.1307 -0.511 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J17 compound treatment 15.0 -1513.4 -1.3053 1.0 -1516.2 -1.2283 -1.7915 -0.9995 3652552 HDAC1-H_000163 COC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2CC(CSc3nc(c(o3)c4ccccc4)c5ccccc5)OC(O2)c6ccc(NC(=O)CCCCCCC(=O)OC)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J18 mock treatment 1254.0 -274.41 -0.2367 1961.0 443.83 0.3596 0.0869 0.2019 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J19 compound treatment 11.0 -1517.4 -1.3087 5.0 -1512.2 -1.225 -1.7916 -0.9995 3215583 HDAC1-H_000164 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CSc3ccccn3)CC(O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J20 mock treatment 836.0 -692.41 -0.5972 1448.0 -69.169 -0.056 -0.4619 -0.7701 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J21 mock treatment 1118.0 -410.41 -0.354 1781.0 263.83 0.2137 -0.0992 -0.2398 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J22 mock treatment 818.0 -710.41 -0.6127 1891.0 373.83 0.3028 -0.2191 -0.3206 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J23 compound treatment 45.0 -1483.4 -1.2794 7.0 -1510.2 -1.2234 -1.7697 -0.9998 3635098 HDAC1-H_000165 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CSc3nc4ccccc4s3)CC(O2)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 J24 mock treatment 796.0 -732.41 -0.6317 1278.0 -239.17 -0.1938 -0.5837 -0.8834 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K01 compound treatment 2466.0 937.59 0.8086 1676.0 158.83 0.1287 0.6628 0.8094 3652553 HDAC1-H_000166 Cc1ccc(cc1)S(=O)(=O)N2CCC[C@H]2Cn3cc(nn3)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K02 compound treatment 324.0 -1204.4 -1.0388 189.0 -1328.2 -1.076 -1.4953 -0.9998 3652555 HDAC1-H_000167 COc1ccc(NCc2ccc(cc2)C(=O)Nc3ccccc3[N+](=O)[O-])cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K03 compound treatment 2117.0 588.59 0.5076 1642.0 124.83 0.1011 0.4305 0.8316 3652556 HDAC1-H_000168 ONC(=O)c1cn(nn1)c2cccc(c2)C(=O)NCCc3c[nH]c4ccccc34 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K04 compound treatment 412.0 -1116.4 -0.9629 176.0 -1341.2 -1.0865 -1.4491 -0.9982 3652557 HDAC1-H_000169 Cc1ccc(NCc2ccc(cc2)C(=O)Nc3ccccc3[N+](=O)[O-])cc1C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K05 compound treatment 2426.0 897.59 0.7741 1667.0 149.83 0.1214 0.6332 0.8081 3652558 HDAC1-H_000170 CC(C)(C)ONC(=O)c1ccc(cc1)n2cc(nn2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K06 compound treatment 97.0 -1431.4 -1.2345 5.0 -1512.2 -1.225 -1.7392 -1.0 3614389 HDAC1-H_000171 ONC(=O)/C=C/c1ccc(OCc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K07 mock treatment 2338.0 809.59 0.6982 1571.0 53.831 0.0436 0.5246 0.7498 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K08 mock treatment 2024.0 495.59 0.4274 1114.0 -403.17 -0.3266 0.0713 0.1325 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K09 compound treatment 2048.0 519.59 0.4481 1210.0 -307.17 -0.2488 0.1409 0.2749 3652484 HDAC1-H_000172 COc1ccc(cc1)n2cc(nn2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K10 compound treatment 30.0 -1498.4 -1.2923 10.0 -1507.2 -1.221 -1.7772 -0.9996 3614392 HDAC1-H_000173 ONC(=O)/C=C/c1ccc(OCc2ccc(Cl)cc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K11 compound treatment 1944.0 415.59 0.3584 1534.0 16.831 0.0136 0.2631 0.7335 3652483 HDAC1-H_000174 COc1cccc(c1)n2cc(nn2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K12 compound treatment 48.0 -1480.4 -1.2768 2.0 -1515.2 -1.2275 -1.7708 -0.9998 3614394 HDAC1-H_000175 Nc1cccc(COc2ccc(/C=C/C(=O)NO)cc2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K13 compound treatment 2024.0 495.59 0.4274 1386.0 -131.17 -0.1063 0.2271 0.5156 3652484 HDAC1-H_000176 COc1ccc(cc1)n2cc(nn2)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K14 compound treatment 439.0 -1089.4 -0.9396 6.0 -1511.2 -1.2242 -1.53 -0.9915 3614396 HDAC1-H_000177 ONC(=O)/C=C/c1ccc(OCCCc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K15 mock treatment 1869.0 340.59 0.2937 1305.0 -212.17 -0.1719 0.0862 0.2532 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K16 mock treatment 1724.0 195.59 0.1687 1386.0 -131.17 -0.1063 0.0441 0.2214 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K17 compound treatment 1928.0 399.59 0.3446 1262.0 -255.17 -0.2067 0.0975 0.2427 3652559 HDAC1-H_000178 CCOc1cc(OCC)cc(c1)C(=O)N[C@H](Cc2ccc(cc2)n3cc(nn3)C(=O)NO)C(=O)OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K18 compound treatment 43.0 -1485.4 -1.2811 7.0 -1510.2 -1.2234 -1.771 -0.9997 3614383 HDAC1-H_000179 ONC(=O)/C=C/c1ccc(OCCc2cccs2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K19 compound treatment 1196.0 -332.41 -0.2867 1180.0 -337.17 -0.2731 -0.3959 -0.9997 3652561 HDAC1-H_000180 COc1ccc(cc1)C(=O)Nc2cccc(c2)n3cc(nn3)C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K20 compound treatment 0.0 -1528.4 -1.3182 6.0 -1511.2 -1.2242 -1.7978 -0.9993 3614398 HDAC1-H_000181 ONC(=O)/C=C/c1ccc(OCCCCc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K21 compound treatment 1182.0 -346.41 -0.2988 1116.0 -401.17 -0.325 -0.4411 -0.9991 3652381 HDAC1-H_000182 COC(=O)[C@@H](NC(=O)Cn1cc(CCC(=O)NO)nn1)c2ccccc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K22 compound treatment 7.0 -1521.4 -1.3122 3.0 -1514.2 -1.2266 -1.7952 -0.9994 3614403 HDAC1-H_000183 ONC(=O)/C=C/c1ccc(OCCn2c3ccccc3c4ccccc24)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K23 mock treatment 1127.0 -401.41 -0.3462 572.0 -945.17 -0.7657 -0.7862 -0.9356 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 K24 mock treatment 880.0 -648.41 -0.5592 1226.0 -291.17 -0.2359 -0.5622 -0.9263 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L01 compound treatment 70.0 -1458.4 -1.2578 8.0 -1509.2 -1.2226 -1.7539 -0.9999 3215593 HDAC1-H_000184 OCCSCC1CC(OC(O1)c2ccc(NC(=O)CCCCCCC(=O)NO)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L02 mock treatment 819.0 -709.41 -0.6118 1891.0 373.83 0.3028 -0.2185 -0.32 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L03 compound treatment 4.0 -1524.4 -1.3147 0.0 -1517.2 -1.2291 -1.7988 -0.9994 3635101 HDAC1-H_000185 CC(C)OCC1CC(OC(O1)c2ccc(NC(=O)CCCCCCC(=O)NO)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L04 mock treatment 1686.0 157.59 0.1359 1652.0 134.83 0.1092 0.1733 0.9941 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L05 compound treatment 17.0 -1511.4 -1.3035 13.0 -1504.2 -1.2185 -1.7834 -0.9994 3652562 HDAC1-H_000186 CNc1ccc(cc1)C(=O)NCCCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L06 mock treatment 1970.0 441.59 0.3809 1648.0 130.83 0.106 0.3442 0.8708 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L07 mock treatment 2324.0 795.59 0.6862 1958.0 440.83 0.3571 0.7377 0.9537 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L08 mock treatment 1667.0 138.59 0.1195 1677.0 159.83 0.1295 0.1761 0.9992 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L09 compound treatment 8.0 -1520.4 -1.3113 0.0 -1517.2 -1.2291 -1.7963 -0.9995 3652563 HDAC1-H_000187 ONC(=O)/C=C/c1ccc(CNc2ccc(cc2)C3OC(CSc4ccncc4)CC(O3)c5ccccc5)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L10 mock treatment 1954.0 425.59 0.3671 1700.0 182.83 0.1481 0.3643 0.9203 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L11 compound treatment 107.0 -1421.4 -1.2259 34.0 -1483.2 -1.2015 -1.7165 -0.9999 3652565 HDAC1-H_000188 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2CC(OC(O2)c3ccncc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L12 mock treatment 2216.0 687.59 0.593 1753.0 235.83 0.191 0.5544 0.8899 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L13 mock treatment 2532.0 1003.6 0.8656 2005.0 487.83 0.3952 0.8915 0.9369 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L14 mock treatment 1311.0 -217.41 -0.1875 1281.0 -236.17 -0.1913 -0.2679 -0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L15 mock treatment 1015.0 -513.41 -0.4428 1741.0 223.83 0.1813 -0.1849 -0.3864 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L16 mock treatment 1608.0 79.589 0.0686 1707.0 189.83 0.1538 0.1573 0.9339 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L17 compound treatment 11.0 -1517.4 -1.3087 47.0 -1470.2 -1.191 -1.7676 -0.9989 3635112 HDAC1-H_000189 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)[C@H]2O[C@@H](CSc3ccncc3)C[C@H](O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L18 mock treatment 1489.0 -39.411 -0.034 1367.0 -150.17 -0.1217 -0.1101 -0.8713 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L19 compound treatment 494.0 -1034.4 -0.8921 243.0 -1274.2 -1.0322 -1.3607 -0.9974 3215595 HDAC1-H_000190 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CSc3ccncc3)CC(O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L20 mock treatment 1156.0 -372.41 -0.3212 1256.0 -261.17 -0.2116 -0.3767 -0.9795 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L21 compound treatment 650.0 -878.41 -0.7576 377.0 -1140.2 -0.9237 -1.1888 -0.9952 3652566 HDAC1-H_000191 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CN3CCNCC3)CC(O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L22 mock treatment 1257.0 -271.41 -0.2341 973.0 -544.17 -0.4408 -0.4772 -0.9561 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L23 mock treatment 1060.0 -468.41 -0.404 1182.0 -335.17 -0.2715 -0.4777 -0.9813 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 L24 mock treatment 858.0 -670.41 -0.5782 908.0 -609.17 -0.4935 -0.7578 -0.9969 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M01 compound treatment 2089.0 560.59 0.4835 2095.0 577.83 0.4681 0.6729 0.9999 3652384 HDAC1-H_000192 CC(C)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCCn2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M02 compound treatment 105.0 -1423.4 -1.2276 0.0 -1517.2 -1.2291 -1.7372 -1.0 3652567 HDAC1-H_000193 C/C(=C\c1ccccc1OCc2ccc(cc2)c3ccncc3)/C=C/C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M03 compound treatment 1843.0 314.59 0.2713 1711.0 193.83 0.157 0.3029 0.9662 3652569 HDAC1-H_000194 COc1ccc(OC)c(NC(=O)Cn2cc(CCC(=O)NO)nn2)c1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M04 compound treatment 259.0 -1269.4 -1.0948 1.0 -1516.2 -1.2283 -1.6427 -0.9984 3652570 HDAC1-H_000195 C/C(=C\c1cccc(OCc2ccc(cc2)c3ccncc3)c1)/C=C/C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M05 compound treatment 2587.0 1058.6 0.913 2064.0 546.83 0.443 0.9588 0.9449 3652572 HDAC1-H_000196 CCOC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cn3cc(CCC(=O)NO)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M06 compound treatment 85.0 -1443.4 -1.2449 0.0 -1517.2 -1.2291 -1.7494 -1.0 3652574 HDAC1-H_000197 CN1C[C@H](COc2ccccc2/C=C(\C)/C=C/C(=O)NO)C=C3[C@H]1Cc4c[nH]c5cccc3c45 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M07 compound treatment 2781.0 1252.6 1.0803 2007.0 489.83 0.3968 1.0445 0.9076 3652576 HDAC1-H_000198 ONC(=O)CCc1cn(CCCNC(=O)Nc2ccccc2)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M08 compound treatment 859.0 -669.41 -0.5773 109.0 -1408.2 -1.1408 -1.2149 -0.9502 3652577 HDAC1-H_000199 C/C(=C\c1ccccc1OC[C@H]2[C@@H](O)CC[C@H]3CN4CCc5c([nH]c6ccccc56)[C@@H]4C[C@H]23)/C=C/C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M09 mock treatment 2301.0 772.59 0.6663 1678.0 160.83 0.1303 0.5633 0.8297 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M10 mock treatment 2097.0 568.59 0.4904 1645.0 127.83 0.1036 0.42 0.838 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M11 compound treatment 1682.0 153.59 0.1325 1211.0 -306.17 -0.248 -0.0817 -0.2906 3652579 HDAC1-H_000200 ONC(=O)CCc1cn(C[C@H](Cc2ccccc2)NC(=O)c3ccccc3)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M12 compound treatment 0.0 -1528.4 -1.3182 1.0 -1516.2 -1.2283 -1.8006 -0.9994 3652581 HDAC1-H_000201 C/C(=C\c1cccc(OC[C@H]2[C@@H](O)CC[C@H]3CN4CCc5c([nH]c6ccccc56)[C@@H]4C[C@H]23)c1)/C=C/C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M13 mock treatment 1347.0 -181.41 -0.1565 1726.0 208.83 0.1692 0.009 0.039 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M14 mock treatment 1660.0 131.59 0.1135 1386.0 -131.17 -0.1063 0.0051 0.0329 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M15 compound treatment 397.0 -1131.4 -0.9758 1476.0 -41.169 -0.0334 -0.7136 -0.7308 3652583 HDAC1-H_000202 ONC(=O)CCc1cn(CCNC(=O)Nc2ccccc2)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M16 compound treatment 29.0 -1499.4 -1.2932 0.0 -1517.2 -1.2291 -1.7835 -0.9997 3652584 HDAC1-H_000203 CCN(CC)CCNc1ccc(COc2ccccc2/C=C(\C)/C=C/C(=O)NO)c3sc4ccccc4c(=O)c13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M17 compound treatment 1959.0 430.59 0.3714 1759.0 241.83 0.1959 0.4011 0.9553 3652586 HDAC1-H_000204 ONC(=O)CCc1cn(CC(=O)N2CCC3(CC2)N(CNC3=O)c4ccccc4)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M18 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3652587 HDAC1-H_000205 CCN(CC)CCNc1ccc(COc2cccc(/C=C(\C)/C=C/C(=O)NO)c2)c3sc4ccccc4c(=O)c13 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M19 compound treatment 1684.0 155.59 0.1342 1488.0 -29.169 -0.0236 0.0782 0.5738 3652589 HDAC1-H_000206 CCOC(=O)[C@H](Cc1ccccc1)NC(=O)Cn2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M20 compound treatment 2.0 -1526.4 -1.3165 1.0 -1516.2 -1.2283 -1.7994 -0.9994 3652591 HDAC1-H_000207 C/C(=C\c1ccccc1OCc2ccc(COc3ccc4ccncc4c3)cc2)/C=C/C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M21 compound treatment 1053.0 -475.41 -0.41 977.0 -540.17 -0.4376 -0.5994 -0.9995 3652593 HDAC1-H_000208 Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)NCCn3cc(CCC(=O)NO)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M22 compound treatment 6.0 -1522.4 -1.313 0.0 -1517.2 -1.2291 -1.7975 -0.9995 3652595 HDAC1-H_000209 C/C(=C\c1cccc(OCc2ccc(COc3ccc4ccncc4c3)cc2)c1)/C=C/C(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M23 compound treatment 561.0 -967.41 -0.8344 1097.0 -420.17 -0.3404 -0.8307 -0.9218 3652597 HDAC1-H_000210 Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)NCCCn3cc(CCC(=O)NO)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 M24 compound treatment 999.0 -529.41 -0.4566 542.0 -975.17 -0.79 -0.8815 -0.966 3562174 HDAC1-H_000211 OCc1ccc(cc1)c2ccncc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N01 compound treatment 74.0 -1454.4 -1.2544 10.0 -1507.2 -1.221 -1.7503 -0.9999 3652599 HDAC1-H_000212 CNCC1CC(OC(O1)c2ccc(NC(=O)CCCCCCC(=O)NO)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N02 mock treatment 1887.0 358.59 0.3093 1899.0 381.83 0.3093 0.4374 1.0 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N03 compound treatment 484.0 -1044.4 -0.9008 30.0 -1487.2 -1.2048 -1.4888 -0.9897 3652600 HDAC1-H_000213 ONC(=O)CCCCCCNC(=O)c1ccc(NCc2cn(Cc3cccc(Cn4cc(CNc5ccc(cc5)C(=O)NCCCCCCC(=O)NO)nn4)c3)nn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N04 mock treatment 2164.0 635.59 0.5482 1751.0 233.83 0.1894 0.5216 0.8993 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N05 compound treatment 228.0 -1300.4 -1.1216 65.0 -1452.2 -1.1764 -1.6249 -0.9997 3634810 HDAC1-H_000214 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C(=O)c2ccc(NC(=O)CCCC#C)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N06 mock treatment 2114.0 585.59 0.505 1574.0 56.831 0.046 0.3897 0.7684 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N07 compound treatment 20.0 -1508.4 -1.3009 15.0 -1502.2 -1.2169 -1.7804 -0.9994 3652601 HDAC1-H_000215 ONC(=O)CCCCCCNC(=O)c1ccc(NCc2cn(Cc3ccc(cc3)C(=O)c4ccc(Cn5cc(CNc6ccc(cc6)C(=O)NCCCCCCC(=O)NO)nn5)cc4)nn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N08 mock treatment 3068.0 1539.6 1.3278 1998.0 480.83 0.3895 1.2144 0.8776 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N09 mock treatment 2192.0 663.59 0.5723 1571.0 53.831 0.0436 0.4355 0.7588 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N10 mock treatment 1676.0 147.59 0.1273 1355.0 -162.17 -0.1314 -0.0029 -0.0158 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N11 compound treatment 14.0 -1514.4 -1.3061 1.0 -1516.2 -1.2283 -1.7921 -0.9995 483 HDAC1-H_000216 CN(C)c1ccc(cc1)C(=O)NCCCCCCC(=O)NO 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N12 mock treatment 2135.0 606.59 0.5232 1836.0 318.83 0.2583 0.5526 0.9471 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N13 mock treatment 2092.0 563.59 0.4861 1994.0 476.83 0.3863 0.6169 0.9935 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N14 mock treatment 2076.0 547.59 0.4723 2535.0 1017.8 0.8246 0.917 0.965 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N15 compound treatment 1927.0 398.59 0.3438 1757.0 239.83 0.1943 0.3805 0.9635 3652602 HDAC1-H_000217 ONC(=O)CCCCCCNC(=O)c1ccc(NCc2cn(Cc3ccc(Cn4cc(CNc5ccc(cc5)C(=O)NCCCCCCC(=O)NO)nn4)cc3)nn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N16 mock treatment 1671.0 142.59 0.123 1101.0 -416.17 -0.3371 -0.1514 -0.422 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N17 compound treatment 3.0 -1525.4 -1.3156 3.0 -1514.2 -1.2266 -1.7976 -0.9994 3652603 HDAC1-H_000218 ONC(=O)CCCCCCC(=O)Nc1ccc(/C=N/O)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N18 mock treatment 1690.0 161.59 0.1394 981.0 -536.17 -0.4344 -0.2086 -0.4573 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N19 compound treatment 4.0 -1524.4 -1.3147 3.0 -1514.2 -1.2266 -1.797 -0.9994 468 HDAC1-H_000219 ONC(=O)CCCCCCC(=O)Nc1ccccc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N20 mock treatment 1570.0 41.589 0.0359 1574.0 56.831 0.046 0.0579 0.9924 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N21 compound treatment 1395.0 -133.41 -0.1151 1164.0 -353.17 -0.2861 -0.2837 -0.9199 3652605 HDAC1-H_000220 COC(=O)CCCCCCNC(=O)c1ccc(NCc2cn(Cc3ccc(cc3)C(=O)c4ccc(Cn5cc(CNc6ccc(cc6)C(=O)NCCCCCCC(=O)OC)nn5)cc4)nn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N22 mock treatment 1456.0 -72.411 -0.0625 1855.0 337.83 0.2737 0.1494 0.5321 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N23 compound treatment 7.0 -1521.4 -1.3122 7.0 -1510.2 -1.2234 -1.7929 -0.9994 3652606 HDAC1-H_000221 ONC(=O)CCCCCCC(=O)Nc1ccc(/C=N/OCc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 N24 mock treatment 1216.0 -312.41 -0.2694 1013.0 -504.17 -0.4084 -0.4793 -0.9796 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O01 compound treatment 1611.0 82.589 0.0712 1333.0 -184.17 -0.1492 -0.0551 -0.3335 3652608 HDAC1-H_000222 ONC(=O)CCc1cn(C[C@H](Cc2ccccc2)NC(=O)Nc3ccccc3)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O02 compound treatment 552.0 -976.41 -0.8421 438.0 -1079.2 -0.8742 -1.2137 -0.9998 3652610 HDAC1-H_000223 OC[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O03 compound treatment 2150.0 621.59 0.5361 1784.0 266.83 0.2162 0.5319 0.9202 3652612 HDAC1-H_000224 ONC(=O)CCc1cn(C[C@@H](Cc2ccccc2)NC(=O)Nc3ccccc3)nn1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O04 compound treatment 9.0 -1519.4 -1.3104 0.0 -1517.2 -1.2291 -1.7957 -0.9995 1105 HDAC1-H_000225 CCN(CC)CCNc1ccc(CO)c2sc3ccccc3c(=O)c12 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O05 compound treatment 2611.0 1082.6 0.9337 779.0 -738.17 -0.598 0.2374 0.2141 3652613 HDAC1-H_000226 Cc1ccc(cc1)S(=O)(=O)N2CCC[C@H]2Cn3cc(CCC(=O)NO)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O06 compound treatment 784.0 -744.41 -0.642 812.0 -705.17 -0.5713 -0.8579 -0.9983 3652615 HDAC1-H_000227 OCc1ccc(COc2ccc3ccncc3c2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O07 compound treatment 721.0 -807.41 -0.6964 450.0 -1067.2 -0.8645 -1.1037 -0.9942 3652616 HDAC1-H_000228 Cc1ccc(cc1)S(=O)(=O)N(c2cccc(c2)n3cc(CCC(=O)NO)nn3)S(=O)(=O)c4ccc(C)cc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O08 compound treatment 5.0 -1523.4 -1.3139 45.0 -1472.2 -1.1926 -1.7724 -0.9988 3652617 HDAC1-H_000229 ONC(=O)/C=C/c1ccc(cc1)C2OC(CSc3ccncc3)CC(O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O09 compound treatment 1761.0 232.59 0.2006 1558.0 40.831 0.0331 0.1652 0.8127 3652619 HDAC1-H_000230 ONC(=O)CCc1cn(nn1)c2cccc(c2)C(=O)O 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O10 compound treatment 4.0 -1524.4 -1.3147 9.0 -1508.2 -1.2218 -1.7936 -0.9993 3652620 HDAC1-H_000231 COc1cc2CCN(CC3CC(OC(O3)c4ccc(NC(=O)CCCCCCC(=O)NO)cc4)c5ccccc5)Cc2cc1OC 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O11 mock treatment 1810.0 281.59 0.2429 1429.0 -88.169 -0.0714 0.1212 0.4789 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O12 mock treatment 1964.0 435.59 0.3757 1566.0 48.831 0.0396 0.2936 0.7773 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O13 compound treatment 2313.0 784.59 0.6767 1242.0 -275.17 -0.2229 0.3209 0.4504 3652621 HDAC1-H_000232 CC(C)(C)ONC(=O)c1cccc(c1)n2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O14 compound treatment 2.0 -1526.4 -1.3165 0.0 -1517.2 -1.2291 -1.8 -0.9994 3652622 HDAC1-H_000233 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CSc3nc(c(o3)c4ccccc4)c5ccccc5)CC(O2)c6ccc(cc6)[N+](=O)[O-] 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O15 compound treatment 1596.0 67.589 0.0583 1159.0 -358.17 -0.2902 -0.164 -0.554 3652387 HDAC1-H_000234 COc1ccc(cc1)n2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O16 compound treatment 91.0 -1437.4 -1.2397 119.0 -1398.2 -1.1327 -1.6775 -0.999 3635093 HDAC1-H_000235 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CSc3ccccc3)CC(O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O17 compound treatment 1184.0 -344.41 -0.297 1533.0 15.831 0.0128 -0.201 -0.6759 3652623 HDAC1-H_000236 COc1cccc(c1)n2cc(CCC(=O)NO)nn2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O18 compound treatment 36.0 -1492.4 -1.2871 42.0 -1475.2 -1.1951 -1.7552 -0.9993 3561878 HDAC1-H_000237 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2CC(CSc3nc(c(o3)c4ccccc4)c5ccccc5)OC(O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O19 compound treatment 1058.0 -470.41 -0.4057 935.0 -582.17 -0.4716 -0.6204 -0.9972 3652624 HDAC1-H_000238 ONC(=O)CCc1cn(nn1)c2ccc(NC(=O)c3ccccc3)cc2 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O20 compound treatment 126.0 -1402.4 -1.2095 74.0 -1443.2 -1.1691 -1.682 -0.9999 3635080 HDAC1-H_000239 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2CC(CSc3nc(c(o3)c4ccccc4)c5ccccc5)OC(O2)c6ccc(NC(=O)CCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O21 compound treatment 1181.0 -347.41 -0.2996 864.0 -653.17 -0.5291 -0.586 -0.9637 3652625 HDAC1-H_000240 ONC(=O)CCc1cn(nn1)c2cccc(c2)C(=O)N3CCC4(CC3)N(CNC4=O)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O22 compound treatment 7.0 -1521.4 -1.3122 0.0 -1517.2 -1.2291 -1.7969 -0.9995 3635109 HDAC1-H_000241 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)[C@@H]2O[C@H](CSc3ccncc3)C[C@@H](O2)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O23 compound treatment 657.0 -871.41 -0.7516 556.0 -961.17 -0.7787 -1.082 -0.9998 3652626 HDAC1-H_000242 COc1ccc(cc1)C(=O)Nc2cccc(c2)n3cc(CCC(=O)NO)nn3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 O24 compound treatment 0.0 -1528.4 -1.3182 0.0 -1517.2 -1.2291 -1.8012 -0.9994 3215599 HDAC1-H_000243 COCC1CC(OC(O1)c2ccc(NC(=O)CCCCCCC(=O)NO)cc2)c3ccccc3 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P01 compound treatment 1242.0 -286.41 -0.247 1064.0 -453.17 -0.3671 -0.4343 -0.9814 3652627 HDAC1-H_000244 COC(=O)CCCCCCC(=O)Nc1ccc(/C=N/OCc2ccccc2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P02 mock treatment 802.0 -726.41 -0.6265 85.0 -1432.2 -1.1602 -1.2634 -0.9582 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P03 compound treatment 76.0 -1452.4 -1.2526 323.0 -1194.2 -0.9674 -1.5698 -0.9918 3652629 HDAC1-H_000245 ONC(=O)CCCCCCNC(=O)c1ccc(NCc2cn(Cc3ccccc3Cn4cc(CNc5ccc(cc5)C(=O)NCCCCCCC(=O)NO)nn4)nn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P04 mock treatment 1321.0 -207.41 -0.1789 1363.0 -154.17 -0.1249 -0.2148 -0.9846 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P05 compound treatment 3.0 -1525.4 -1.3156 3.0 -1514.2 -1.2266 -1.7976 -0.9994 3652630 HDAC1-H_000246 ONC(=O)CCCCCCNC(=O)c1ccc(cc1)N(CC#C)CC#C 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P06 mock treatment 1476.0 -52.411 -0.0452 1374.0 -143.17 -0.116 -0.114 -0.9156 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P07 compound treatment 10.0 -1518.4 -1.3096 6.0 -1511.2 -1.2242 -1.7917 -0.9994 3652631 HDAC1-H_000247 ONC(=O)CCCCCCNC(=O)c1ccc(NCc2cn(Cc3ccccc3)nn2)cc1 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P08 mock treatment 1081.0 -447.41 -0.3859 1305.0 -212.17 -0.1719 -0.3944 -0.9336 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P09 compound treatment 799.0 -729.41 -0.6291 1157.0 -360.17 -0.2918 -0.6511 -0.939 3634807 HDAC1-H_000248 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2CC(OC(O2)c3ccccc3)c4ccccc4 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P10 mock treatment 1319.0 -209.41 -0.1806 1514.0 -3.1692 -0.0026 -0.1295 -0.7171 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P11 mock treatment 1895.0 366.59 0.3162 1328.0 -189.17 -0.1532 0.1152 0.3279 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P12 mock treatment 1625.0 96.589 0.0833 1048.0 -469.17 -0.3801 -0.2099 -0.5393 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P13 compound treatment 703.0 -825.41 -0.7119 387.0 -1130.2 -0.9156 -1.1508 -0.9923 3652632 HDAC1-H_000249 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2CC(OC(O2)c3ccc(Oc4ccccc4)cc3)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P14 mock treatment 1570.0 41.589 0.0359 1289.0 -228.17 -0.1848 -0.1053 -0.5595 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P15 compound treatment 1093.0 -435.41 -0.3755 727.0 -790.17 -0.6401 -0.7182 -0.9677 3652633 HDAC1-H_000250 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2CC(OC(O2)c3cccc(Oc4ccccc4)c3)c5ccccc5 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P16 mock treatment 1217.0 -311.41 -0.2686 1193.0 -324.17 -0.2626 -0.3756 -0.9999 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P17 compound treatment 1389.0 -139.41 -0.1202 1098.0 -419.17 -0.3396 -0.3251 -0.9026 3634674 HDAC1-H_000251 OCc1ccc(cc1)[C@@H]2C[C@H](CSc3nc(c(o3)c4ccccc4)c5ccccc5)OC(O2)c6ccc(NC(=O)CCCCCCC(=O)O)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P18 mock treatment 1555.0 26.589 0.0229 1167.0 -350.17 -0.2837 -0.1844 -0.6478 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P19 compound treatment 66.0 -1462.4 -1.2613 36.0 -1481.2 -1.1999 -1.7403 -0.9997 2027357 HDAC1-H_000252 OCc1ccc(cc1)[C@@H]2C[C@H](CSc3nc(c(o3)c4ccccc4)c5ccccc5)O[C@@H](O2)c6ccc(NC(=O)CCCCCCC(=O)NO)cc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P20 mock treatment 815.0 -713.41 -0.6153 819.0 -698.17 -0.5656 -0.835 -0.9991 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P21 compound treatment 2.0 -1526.4 -1.3165 2.0 -1515.2 -1.2275 -1.7988 -0.9994 3562114 HDAC1-H_000253 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)C2OC(CSc3nc(c(o3)c4ccccc4)c5ccccc5)CC(O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P22 mock treatment 1115.0 -413.41 -0.3565 1288.0 -229.17 -0.1857 -0.3834 -0.9537 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P23 compound treatment 2.0 -1526.4 -1.3165 22.0 -1495.2 -1.2113 -1.7874 -0.9991 3652634 HDAC1-H_000254 ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)[C@H]2O[C@@H](CSc3nc(c(o3)c4ccccc4)c5ccccc5)C[C@H](O2)c6ccccc6 1158.0002 TotalPosAlpha(1158.0002) BetaCellTransdifferentiation1 1158.0002.2467 P24 mock treatment 874.0 -654.41 -0.5644 1301.0 -216.17 -0.1751 -0.5229 -0.8849