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 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A01 compound treatment 0.386 0.334 21.51 0.394 0.342 23.91 32.1164 0.9986 1468351 IFLab1_001057 C1CCc2c(C1)sc3ncnc(Oc4cccnc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A02 compound treatment 0.063 0.0112 0.72 0.062 0.0103 0.72 1.0155 1.0 2066277 IFLab1_001058 Oc1c(/C=N/c2cccnc2)c(=O)oc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A03 compound treatment 0.066 0.0142 0.91 0.068 0.0163 1.14 1.4484 0.9942 1405888 IFLab1_001059 CCOC(=O)c1c(NC(=O)C(C)(C)C)scc1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A04 compound treatment 0.069 0.0172 1.11 0.068 0.0163 1.14 1.585 0.9999 1349352 IFLab1_001060 CC1CCc2sc(NC(=O)Cc3ccccc3)c(C(=O)N)c2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A05 compound treatment 0.063 0.0112 0.72 0.069 0.0173 1.21 1.3613 0.9697 2066278 IFLab1_001061 S=c1[nH]cnc2n(ncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A06 compound treatment 0.064 0.0122 0.78 0.063 0.0113 0.79 1.1104 1.0 1150492 IFLab1_001062 CCSc1nnc(NC(=O)C2(CC3CC4CC(C3)C2)C4)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A07 compound treatment 0.059 0.00719 0.46 0.057 0.00525 0.37 0.5865 0.9934 1504404 IFLab1_001063 CCOC(=O)c1c(oc2ccc(O)c(CN(C)C)c12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A08 compound treatment 0.06 0.00819 0.53 0.072 0.0203 1.41 1.373 0.9095 1715117 IFLab1_001064 COc1cc(OC)cc(c1)C(=O)Nc2nnc(s2)c3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A09 compound treatment 0.058 0.00619 0.4 0.062 0.0103 0.72 0.7879 0.9617 1584865 IFLab1_001065 CCOC(=O)c1c(oc2ccc(O)c(CN3CCN(C)CC3)c12)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A10 compound treatment 0.058 0.00619 0.4 0.059 0.00725 0.51 0.6397 0.9929 2066279 IFLab1_001066 Clc1ccc(cc1)c2nnc(NC(=O)/C=C\c3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A11 compound treatment 0.062 0.0102 0.66 0.066 0.0143 1.0 1.1676 0.9795 1279363 IFLab1_001067 CCOC(=O)COc1ccc2cc(c3nc4ccccc4s3)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A12 compound treatment 0.062 0.0102 0.66 0.06 0.00825 0.58 0.8712 0.9979 1250002 IFLab1_001068 COC(=O)C1=C(CCS1)NC(=O)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A13 compound treatment 0.058 0.00619 0.4 0.058 0.00625 0.44 0.5904 0.9989 1693583 IFLab1_001069 Cc1csc(n1)c2cc3ccc(O)c(CN4CCCC4)c3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A14 compound treatment 0.072 0.0202 1.3 0.098 0.0462 3.23 3.2035 0.9199 1436211 IFLab1_001070 COC(=O)C1=C(CCS1)NC(=O)COc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A15 compound treatment 0.052 1.88E-4 0.01 0.054 0.00225 0.16 0.1197 0.7592 1139829 IFLab1_001071 COc1cccc(OCC(=O)N(C)C2CCS(=O)(=O)C2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A16 compound treatment 0.067 0.0152 0.98 0.059 0.00725 0.51 1.0494 0.9531 1559224 IFLab1_001072 Cc1ccc(cc1)c2nnc(NC(=O)COc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A17 compound treatment 0.052 1.88E-4 0.01 0.051 -7.5E-4 -0.05 -0.0285 -0.5303 1218799 IFLab1_001073 O=C(Nc1sc2CCCc2c1C#N)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A18 compound treatment 0.072 0.0202 1.3 0.061 0.00925 0.65 1.3757 0.948 1248136 IFLab1_001074 CC1(C)CC(=O)c2sc(NC(=O)C3CCCCC3)nc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A19 compound treatment 0.081 0.0292 1.88 0.086 0.0343 2.39 3.0203 0.9928 1169304 IFLab1_001075 O=C(Nc1ccccc1c2nc3ccccc3[nH]2)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A20 compound treatment 0.063 0.0112 0.72 0.061 0.00925 0.65 0.9661 0.9985 1732906 IFLab1_001076 Cc1nc2ccc(NC(=O)c3ccc(cc3)N4C(=O)CCC4=O)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A21 compound treatment 0.057 0.00519 0.33 0.061 0.00925 0.65 0.693 0.9528 1461536 IFLab1_001077 CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A22 compound treatment 0.054 0.00219 0.14 0.059 0.00725 0.51 0.4577 0.8707 2066280 IFLab1_001078 CC(C)(C)Nc1scc(c2ccccc2)[n+]1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A23 mock treatment 0.051 -8.13E-4 -0.05 0.051 -7.5E-4 -0.05 -0.074 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 A24 mock treatment 0.054 0.00219 0.14 0.058 0.00625 0.44 0.4083 0.89 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B01 compound treatment 0.067 0.0152 0.98 0.071 0.0193 1.34 1.6421 0.9877 1359222 IFLab1_001079 Cc1nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B02 compound treatment 0.056 0.00419 0.27 0.062 0.0103 0.72 0.6969 0.9109 1724523 IFLab1_001080 Nc1ccc(cc1N)C(=O)c2ccc3OCCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B03 compound treatment 0.08 0.0282 1.81 0.084 0.0323 2.25 2.876 0.9942 1187088 IFLab1_001081 Clc1ccc(cc1)c2csc(NC(=O)COc3ccccc3)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B04 compound treatment 0.053 0.00119 0.08 0.053 0.00125 0.09 0.1158 0.9978 1137914 IFLab1_001082 COc1ccc(Nc2ccnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B05 compound treatment 0.132 0.0802 5.16 0.163 0.111 7.77 9.1451 0.9802 2066281 IFLab1_001083 CCCC(=O)Nc1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B06 compound treatment 0.056 0.00419 0.27 0.057 0.00525 0.37 0.4499 0.9885 1210687 IFLab1_001084 Cc1ccnc(NC(=O)C2CCCCC2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B07 compound treatment 0.064 0.0122 0.78 0.068 0.0163 1.14 1.3574 0.9837 1334135 IFLab1_001085 O=C(NCc1ccccc1)c2cc3c(ccc4ccccc43)oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B08 compound treatment 0.055 0.00319 0.21 0.056 0.00425 0.3 0.355 0.9837 1983536 IFLab1_001086 CCOC(=O)C(N)CSC1CCCCO1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B09 compound treatment 0.064 0.0122 0.78 0.07 0.0182 1.27 1.4562 0.9728 2066282 IFLab1_001087 COc1ccc(/N=C/2\NC(=O)C(Cc3ccc(C)cc3)S2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B10 compound treatment 0.041 -0.0108 -0.7 0.038 -0.0138 -0.96 -1.1713 -0.9875 2066283 IFLab1_001088 [O-][n+]1onc(C(=O)c2cccs2)c1C(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B11 compound treatment 0.06 0.00819 0.53 0.061 0.00925 0.65 0.8296 0.9949 1403758 IFLab1_001089 O=C(COc1ccccc1)Nc2ncc(Cc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B12 compound treatment 0.052 1.88E-4 0.01 0.055 0.00325 0.23 0.1691 0.7436 1603086 IFLab1_001090 OC(=O)C(NC(=O)c1ccccc1)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B13 compound treatment 0.052 1.88E-4 0.01 0.052 2.5E-4 0.02 0.0209 0.9837 1520010 IFLab1_001091 O=S(=O)(CCOc1ccccc1)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B14 compound treatment 0.052 1.88E-4 0.01 0.055 0.00325 0.23 0.1691 0.7436 2066284 IFLab1_001092 C(Sc1nncn1c2ccccc2)c3cn4ccsc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B15 compound treatment 0.046 -0.00581 -0.37 0.047 -0.00475 -0.33 -0.4992 -0.9982 2066285 IFLab1_001093 CC(C)(C)c1ccc(/C=C/C(=O)O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B16 compound treatment 0.054 0.00219 0.14 0.056 0.00425 0.3 0.3095 0.9419 1656781 IFLab1_001094 CS(=O)(=O)c1ccc2nc(NC(=O)c3ccc(cc3)C(=O)c4ccccc4)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B17 compound treatment 0.06 0.00819 0.53 0.064 0.0123 0.86 0.9778 0.9729 2066286 IFLab1_001095 COC(=O)CCS(=O)(=O)c1ccc(Cl)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B18 compound treatment 0.092 0.0402 2.59 0.09 0.0382 2.67 3.7185 0.9999 1179259 IFLab1_001096 Clc1ccc(Cl)c(Cc2cnc(NC(=O)C3CCCO3)s2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B19 compound treatment 0.053 0.00119 0.08 0.055 0.00325 0.23 0.2146 0.8958 1224001 IFLab1_001097 CCN1CCN(CC1)c2cc3N(C)c4ccccc4Oc3nn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B20 compound treatment 0.049 -0.00281 -0.18 0.054 0.00225 0.16 -0.0169 -0.0703 1349850 IFLab1_001098 COc1ccc(cc1)c2csc(N)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B21 compound treatment 0.048 -0.00381 -0.25 0.048 -0.00375 -0.26 -0.3588 -0.9995 1917751 IFLab1_001099 COC(=O)CCC(=O)c1ccc(Br)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B22 compound treatment 0.054 0.00219 0.14 0.053 0.00125 0.09 0.1613 0.9736 1140317 IFLab1_001100 CC(=O)Nc1ccc(cc1)c2cn3ccsc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B23 mock treatment 0.051 -8.13E-4 -0.05 0.053 0.00125 0.09 0.0248 0.2433 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 B24 mock treatment 0.053 0.00119 0.08 0.05 -0.00175 -0.12 -0.0324 -0.2247 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C01 compound treatment 0.059 0.00719 0.46 0.058 0.00625 0.44 0.6359 0.9996 1223908 IFLab1_001101 Nc1nc(cs1)c2ccc3OCCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C02 compound treatment 0.058 0.00619 0.4 0.063 0.0113 0.79 0.8373 0.9504 1149446 IFLab1_001102 Clc1ccc(cc1)C2=C(C#N)C(=O)Nc3ccccc3S2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C03 compound treatment 0.054 0.00219 0.14 0.053 0.00125 0.09 0.1613 0.9736 1273996 IFLab1_001103 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)N2CCN(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C04 compound treatment 0.056 0.00419 0.27 0.06 0.00825 0.58 0.5981 0.9401 1668048 IFLab1_001104 COc1ccc(cc1OC)C(=O)Nc2sc3CCC(C)Cc3c2C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C05 compound treatment 0.054 0.00219 0.14 0.062 0.0103 0.72 0.6059 0.8302 1663578 IFLab1_001105 CN1CCCN(CC1)c2nc(C)nc3sc4CCCc4c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C06 compound treatment 0.053 0.00119 0.08 0.053 0.00125 0.09 0.1158 0.9978 1541981 IFLab1_001106 CCSc1nnc(NC(=O)c2ccc(cc2)c3ccccc3)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C07 compound treatment 0.192 0.14 9.02 0.209 0.157 10.99 14.1482 0.9952 1728326 IFLab1_001107 COc1ccc2oc(c(C(=O)N)c2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C08 compound treatment 0.059 0.00719 0.46 0.06 0.00825 0.58 0.7347 0.9941 1403107 IFLab1_001108 COc1ccccc1C(=O)Nc2nnc(s2)c3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C09 compound treatment 0.082 0.0302 1.94 0.084 0.0323 2.25 2.967 0.9973 1458750 IFLab1_001109 CC(C)OC(=O)c1c(C)oc2ccc(OC(=O)C(C)C)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C10 compound treatment 0.057 0.00519 0.33 0.068 0.0163 1.14 1.0388 0.8779 1170894 IFLab1_001110 COC(=O)C1=C(CCS1)NC(=O)C2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C11 compound treatment 0.052 1.88E-4 0.01 0.053 0.00125 0.09 0.0703 0.7973 1702141 IFLab1_001111 CCc1cc(C(=O)Cn2cnc3ccccc23)c(O)cc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C12 compound treatment 0.078 0.0262 1.69 0.072 0.0203 1.41 2.1922 0.9962 1529753 IFLab1_001112 CCc1nnc(NC(=O)c2cc3ccccc3cc2OC)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C13 compound treatment 0.057 0.00519 0.33 0.052 2.5E-4 0.02 0.2484 0.7431 2066287 IFLab1_001113 COC(=O)NC1(Oc2cc(Cl)c(Cl)cc2O1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C14 compound treatment 0.081 0.0292 1.88 0.082 0.0302 2.11 2.8227 0.9983 1223344 IFLab1_001114 COC(=O)C1=C(CCS1)NC(=O)c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C15 compound treatment 0.051 -8.13E-4 -0.05 0.052 2.5E-4 0.02 -0.0246 -0.4467 1602437 IFLab1_001115 COc1cccc(OCC(=O)NCC(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C16 compound treatment 0.056 0.00419 0.27 0.057 0.00525 0.37 0.4499 0.9885 1667248 IFLab1_001116 Fc1ccc(cc1)c2nnc(NC(=O)COc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C17 compound treatment 0.056 0.00419 0.27 0.057 0.00525 0.37 0.4499 0.9885 2066288 IFLab1_001117 Brc1ccc(s1)C(=O)NCC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C18 compound treatment 0.054 0.00219 0.14 0.056 0.00425 0.3 0.3095 0.9419 2066289 IFLab1_001118 Cn1c(=NC(=O)C2CCCCC2)sc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C19 compound treatment 0.116 0.0642 4.13 0.157 0.105 7.35 8.1205 0.9628 1119499 IFLab1_001119 Brc1ccc(NC(=O)C2CC2)c(c1)C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C20 compound treatment 0.056 0.00419 0.27 0.059 0.00725 0.51 0.5487 0.9564 1148237 IFLab1_001120 Fc1ccc(cc1)c2csc(NC(=O)c3ccc(cc3)N4C(=O)CCC4=O)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C21 compound treatment 0.643 0.591 38.05 0.677 0.625 43.68 57.793 0.9976 1505492 IFLab1_001121 CCOCN1C(=O)c2cccc3cccc1c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C22 compound treatment 0.05 -0.00181 -0.12 0.057 0.00525 0.37 0.1768 0.4595 2066290 IFLab1_001122 COc1ccc(cc1)c2csc(Nc3ccccc3)[n+]2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C23 mock treatment 0.053 0.00119 0.08 0.05 -0.00175 -0.12 -0.0324 -0.2247 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 C24 mock treatment 0.051 -8.13E-4 -0.05 0.05 -0.00175 -0.12 -0.1234 -0.9282 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D01 compound treatment 0.061 0.00919 0.59 0.06 0.00825 0.58 0.8257 0.9999 1171021 IFLab1_001123 CCOC(=O)c1sc(NC(=O)COc2ccc(Cl)cc2)nc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D02 compound treatment 0.056 0.00419 0.27 0.051 -7.5E-4 -0.05 0.1535 0.5592 1127343 IFLab1_001124 CC1(CC2(C)CC3(CC(=O)O)C1)CC(CC(=O)O)(C2)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D03 compound treatment 0.078 0.0262 1.69 0.079 0.0273 1.9 2.538 0.9982 1413469 IFLab1_001125 CCOC(=O)c1sc(NC(=O)COc2ccccc2)nc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D04 compound treatment 0.055 0.00319 0.21 0.062 0.0103 0.72 0.6514 0.8745 1079544 IFLab1_001126 FC(F)(F)S(=O)(=O)c1ccc(Br)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D05 compound treatment 0.056 0.00419 0.27 0.067 0.0153 1.07 0.9439 0.8589 1600969 IFLab1_001127 CC(NC(=O)C(c1ccccc1)c2ccccc2)C(=O)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D06 compound treatment 0.057 0.00519 0.33 0.056 0.00425 0.3 0.446 0.9983 1138171 IFLab1_001128 Fc1ccc(NC(=O)c2cc3cc(Cl)ccc3oc2=N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D07 compound treatment 0.062 0.0102 0.66 0.057 0.00525 0.37 0.723 0.9623 1108481 IFLab1_001129 O=C(Nc1ccccc1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D08 compound treatment 0.052 1.88E-4 0.01 0.062 0.0103 0.72 0.5149 0.7189 2066291 IFLab1_001130 FC(F)(F)C(=O)Nc1cccc(c1)C(=O)Nc2cccc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D09 compound treatment 0.061 0.00919 0.59 0.07 0.0182 1.27 1.3197 0.939 2066292 IFLab1_001131 COc1ccc(CC2S/C(=N/c3ccc(Br)cc3)/NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D10 compound treatment 0.054 0.00219 0.14 0.057 0.00525 0.37 0.3589 0.9136 1342742 IFLab1_001132 Cc1ccc(cc1)S(=O)(=O)N2CCN(Cc3cc(ccc3O)c4ccccc4)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D11 compound treatment 0.105 0.0532 3.42 0.16 0.108 7.56 7.7681 0.9358 1650769 IFLab1_001133 COc1ccccc1OCC(=O)Nc2ncc(Cc3ccc(F)cc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D12 compound treatment 0.06 0.00819 0.53 0.054 0.00225 0.16 0.4838 0.8797 1985468 IFLab1_001134 CSc1nnc(o1)c2ccccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D13 compound treatment 0.052 1.88E-4 0.01 0.057 0.00525 0.37 0.2679 0.73 2066293 IFLab1_001135 Cc1ccc(cc1)n2c(C)nc3ccccc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D14 compound treatment 0.058 0.00619 0.4 0.057 0.00525 0.37 0.541 0.9992 2066294 IFLab1_001136 Cc1csc2nc(CSc3nnnn3c4ccccc4)cn12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D15 compound treatment 0.063 0.0112 0.72 0.063 0.0113 0.79 1.0649 0.999 1604901 IFLab1_001137 O=C(NCCc1c[nH]c2ccccc12)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D16 compound treatment 0.074 0.0222 1.43 0.066 0.0143 1.0 1.7137 0.9844 1740346 IFLab1_001138 CS(=O)(=O)c1ccc2nc(NC(=O)c3ccccc3Oc4ccccc4)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D17 compound treatment 0.052 1.88E-4 0.01 0.051 -7.5E-4 -0.05 -0.0285 -0.5303 1286122 IFLab1_001139 CC(=O)Nc1ccc(cc1N)S(=O)(=O)c2ccc(N)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D18 compound treatment 0.057 0.00519 0.33 0.058 0.00625 0.44 0.5448 0.9912 1548282 IFLab1_001140 OC(=O)COc1ccc2c(c1)oc(=O)c3ccccc32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D19 compound treatment 0.057 0.00519 0.33 0.055 0.00325 0.23 0.3966 0.9823 1379754 IFLab1_001141 CC(C)Sc1nc2ccccc2n1CC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D20 compound treatment 0.074 0.0222 1.43 0.076 0.0243 1.69 2.2077 0.9964 1016070 IFLab1_001142 CC(=O)Nc1nc(cs1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D21 compound treatment 0.05 -0.00181 -0.12 0.051 -7.5E-4 -0.05 -0.1195 -0.9347 1385217 IFLab1_001143 Oc1c(CN2CCOCC2)cc(cc1CN3CCOCC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D22 compound treatment 0.051 -8.13E-4 -0.05 0.048 -0.00375 -0.26 -0.2222 -0.8318 1576299 IFLab1_001144 Cn1ccnc1SCC(=O)c2ccc(O)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D23 mock treatment 0.051 -8.13E-4 -0.05 0.051 -7.5E-4 -0.05 -0.074 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 D24 mock treatment 0.056 0.00419 0.27 0.053 0.00125 0.09 0.2523 0.8906 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E01 compound treatment 0.061 0.00919 0.59 0.06 0.00825 0.58 0.8257 0.9999 1253521 IFLab1_001145 OCCN(CCO)c1ncnc2sc3CCCCc3c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E02 compound treatment 0.103 0.0512 3.29 0.115 0.0633 4.42 5.4541 0.9895 2066295 IFLab1_001146 CC(=O)Sc1[nH]c(nc1S(=O)(=O)c2ccccc2)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E03 compound treatment 0.053 0.00119 0.08 0.062 0.0103 0.72 0.5604 0.7782 2066296 IFLab1_001147 Cc1nnc2c3cnn(c4ccccc4)c3nc(C)n12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E04 compound treatment 0.081 0.0292 1.88 0.08 0.0283 1.97 2.7239 0.9997 1399682 IFLab1_001148 Cc1ccc(cc1)C(=O)Nc2nc(cs2)c3ccc(C#N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E05 compound treatment 0.081 0.0292 1.88 0.092 0.0403 2.81 3.3167 0.9808 1296769 IFLab1_001149 O=C(CC(=O)c1ccccc1)Nc2ccc3OCCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E06 compound treatment 0.057 0.00519 0.33 0.057 0.00525 0.37 0.4954 0.9989 1738796 IFLab1_001150 CCSc1nnc(NC(=O)c2ccc(cc2)C(=O)c3ccccc3)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E07 compound treatment 0.688 0.636 40.95 0.708 0.656 45.85 61.3724 0.9984 2066297 IFLab1_001151 CCOC(=O)c1c(oc2ccc(OC)cc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E08 compound treatment 0.059 0.00719 0.46 0.055 0.00325 0.23 0.4877 0.9463 1715253 IFLab1_001152 Clc1ccccc1c2nnc(NC(=O)Cc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E09 compound treatment 0.092 0.0402 2.59 0.099 0.0473 3.3 4.1631 0.9927 1190551 IFLab1_001153 Oc1ccc2c(=O)c(coc2c1)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E10 compound treatment 0.068 0.0162 1.04 0.062 0.0103 0.72 1.2431 0.9833 1703708 IFLab1_001154 COC(=O)C1=C(CCS1)NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E11 compound treatment 0.071 0.0192 1.24 0.094 0.0423 2.95 2.9604 0.9252 1160900 IFLab1_001155 COc1ccc2cc(c3nc4ccccc4s3)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E12 compound treatment 0.07 0.0182 1.17 0.075 0.0233 1.62 1.9763 0.9871 1709683 IFLab1_001156 O=C(Cc1cccc2ccccc12)Nc3nnc(s3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E13 compound treatment 0.056 0.00419 0.27 0.059 0.00725 0.51 0.5487 0.9564 1528674 IFLab1_001157 CCN(CC)S(=O)(=O)c1cccc2c(cccc12)S(=O)(=O)N(CC)CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E14 compound treatment 0.052 1.88E-4 0.01 0.058 0.00625 0.44 0.3173 0.7264 1423396 IFLab1_001158 Cc1nnc(NC(=O)COc2ccc(Cl)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E15 compound treatment 0.052 1.88E-4 0.01 0.059 0.00725 0.51 0.3667 0.7238 1592334 IFLab1_001159 CC(C)CCOc1cccc(OCC(=O)NCC(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E16 compound treatment 0.056 0.00419 0.27 0.056 0.00425 0.3 0.4005 0.9988 2066298 IFLab1_001160 CCSc1nnc(NC(=O)c2cccc(c2)C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E17 compound treatment 0.491 0.439 28.27 0.528 0.476 33.27 43.5147 0.9967 1224629 IFLab1_001161 CCOc1ccc2nc(NC(=O)C3CC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E18 compound treatment 0.058 0.00619 0.4 0.054 0.00225 0.16 0.3928 0.9173 1720680 IFLab1_001162 Oc1ccc(NC(=O)C2CCCCC2)cc1c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E19 compound treatment 0.054 0.00219 0.14 0.051 -7.5E-4 -0.05 0.0625 0.4161 2066299 IFLab1_001163 O=C(/C(=C/1\Nc2ccccc2S1)/C#N)c3ccc(C#N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E20 compound treatment 0.056 0.00419 0.27 0.054 0.00225 0.16 0.3017 0.967 1124258 IFLab1_001164 O=C(Nc1nc(cs1)c2cccs2)c3ccc(cc3)N4C(=O)CCC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E21 compound treatment 0.051 -8.13E-4 -0.05 0.056 0.00425 0.3 0.173 0.5737 1674690 IFLab1_001165 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)N4CCN(C)CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E22 compound treatment 0.056 0.00419 0.27 0.058 0.00625 0.44 0.4993 0.9731 1007668 IFLab1_001166 Nc1ccc(NC(=O)CCC(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E23 mock treatment 0.051 -8.13E-4 -0.05 0.049 -0.00275 -0.19 -0.1728 -0.868 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 E24 mock treatment 0.052 1.88E-4 0.01 0.052 2.5E-4 0.02 0.0209 0.9837 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F01 compound treatment 0.059 0.00719 0.46 0.06 0.00825 0.58 0.7347 0.9941 2066300 IFLab1_001167 CC1CCc2sc(NC(=O)COc3ccc(Cl)cc3)c(C(=O)N)c2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F02 compound treatment 0.076 0.0242 1.56 0.074 0.0222 1.55 2.2 1.0 1215594 IFLab1_001168 Cc1cc(nc2cc(nn12)C(=O)NCC3CCCO3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F03 compound treatment 0.257 0.205 13.21 0.226 0.174 12.17 17.9463 0.9992 1361013 IFLab1_001169 O=C(COc1ccccc1)Nc2nc(cs2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F04 compound treatment 0.056 0.00419 0.27 0.056 0.00425 0.3 0.4005 0.9988 2066301 IFLab1_001170 CCC(=O)c1ccc2OCCOc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F05 compound treatment 0.06 0.00819 0.53 0.058 0.00625 0.44 0.6814 0.9956 1404125 IFLab1_001171 CC(NC(=O)C(c1ccccc1)c2ccccc2)C(=O)Nc3ccc(Br)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F06 compound treatment 0.053 0.00119 0.08 0.051 -7.5E-4 -0.05 0.017 0.1834 1414687 IFLab1_001172 CC1(C)C(OC(=O)C(C)(C)C1=O)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F07 compound treatment 0.054 0.00219 0.14 0.055 0.00325 0.23 0.2601 0.9736 1329870 IFLab1_001173 CCN(CC)c1ccc2cc(C(=O)Nc3ccccc3)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F08 compound treatment 0.162 0.11 7.09 0.188 0.136 9.52 11.7455 0.9895 2066302 IFLab1_001174 CCCCC1(C)Cc2ccccc2C(=O)N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F09 compound treatment 0.068 0.0162 1.04 0.072 0.0203 1.41 1.7371 0.9887 2066303 IFLab1_001175 COc1ccc(CC2S/C(=N/c3ccccn3)/NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F10 compound treatment 0.048 -0.00381 -0.25 0.048 -0.00375 -0.26 -0.3588 -0.9995 2066304 IFLab1_001176 Clc1ccc(C(=O)Cn2ccnc2)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F11 compound treatment 0.049 -0.00281 -0.18 0.051 -7.5E-4 -0.05 -0.1651 -0.8758 2066305 IFLab1_001177 COc1ccc(/N=C/c2ccc(o2)c3ccc(F)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F12 compound treatment 0.056 0.00419 0.27 0.064 0.0123 0.86 0.7957 0.8869 2066306 IFLab1_001178 S=C/1SC(=C\C1=C/Nc2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F13 compound treatment 0.053 0.00119 0.08 0.05 -0.00175 -0.12 -0.0324 -0.2247 1538947 IFLab1_001179 CCCC(NS(=O)(=O)c1ccc(C)cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F14 compound treatment 0.044 -0.00781 -0.5 0.045 -0.00675 -0.47 -0.689 -0.9995 2066307 IFLab1_001180 Clc1ccccc1/N=C/c2ccc(OC(=O)c3cccnc3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F15 compound treatment 0.038 -0.0138 -0.89 0.039 -0.0127 -0.89 -1.2585 -1.0 1619951 IFLab1_001181 Clc1ccc(cc1Cl)C(=O)Oc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F16 compound treatment 0.059 0.00719 0.46 0.061 0.00925 0.65 0.7841 0.9866 2066308 IFLab1_001182 CS(=O)(=O)c1ccc2nc(NC(=O)c3cccc(c3)C(F)(F)F)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F17 compound treatment 0.052 1.88E-4 0.01 0.079 0.0273 1.9 1.3546 0.7116 1518504 IFLab1_001183 CC(CO)NC(=O)c1cc2ccccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F18 compound treatment 0.063 0.0112 0.72 0.064 0.0123 0.86 1.1143 0.9963 1864906 IFLab1_001184 OC(=O)c1ccccc1NS(=O)(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F19 compound treatment 0.052 1.88E-4 0.01 0.052 2.5E-4 0.02 0.0209 0.9837 1026952 IFLab1_001185 NC(=O)c1ccc(Oc2ccc(cc2)C(=O)N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F20 compound treatment 0.045 -0.00681 -0.44 0.045 -0.00675 -0.47 -0.6435 -0.9993 1172465 IFLab1_001186 O=C1OC(Nc2nccs2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F21 compound treatment 0.051 -8.13E-4 -0.05 0.051 -7.5E-4 -0.05 -0.074 -1.0 2066309 IFLab1_001187 O=C/1OC(=C\C1=C/Nc2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F22 compound treatment 0.055 0.00319 0.21 0.056 0.00425 0.3 0.355 0.9837 2066310 IFLab1_001188 COc1cc(/C=C\2/N=C(SCC(=O)c3ccccc3)N(C2=O)c4ccccc4)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F23 mock treatment 0.052 1.88E-4 0.01 0.051 -7.5E-4 -0.05 -0.0285 -0.5303 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 F24 mock treatment 0.051 -8.13E-4 -0.05 0.052 2.5E-4 0.02 -0.0246 -0.4467 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G01 compound treatment 0.056 0.00419 0.27 0.06 0.00825 0.58 0.5981 0.9401 1647190 IFLab1_001189 Oc1ccc2ccccc2c1CN3CCN(Cc4ccccc4)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G02 compound treatment 0.065 0.0132 0.85 0.063 0.0113 0.79 1.1559 0.9993 2066311 IFLab1_001190 CN1CCN(CC1)C(=O)/C=C/c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G03 compound treatment 0.052 1.88E-4 0.01 0.054 0.00225 0.16 0.1197 0.7592 1731764 IFLab1_001191 O=C(CCN1CCN(Cc2ccccc2)CC1)Nc3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G04 compound treatment 0.155 0.103 6.64 0.159 0.107 7.49 9.9943 0.9982 2066312 IFLab1_001192 CCSc1nnc(NC(=O)C(C)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G05 compound treatment 1.076 1.02 65.92 1.011 0.959 67.01 93.9991 1.0 2066313 IFLab1_001193 Cc1nc2c(nn(c3ccccc3)c2s1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G06 compound treatment 0.052 1.88E-4 0.01 0.056 0.00425 0.3 0.2185 0.7352 1566011 IFLab1_001194 CC(=O)Nc1nnc(s1)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G07 compound treatment 0.396 0.344 22.15 0.305 0.253 17.69 28.1751 0.9938 1342241 IFLab1_001195 COc1ccc2oc(c(C(=O)N(C)C)c2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G08 compound treatment 0.064 0.0122 0.78 0.075 0.0233 1.62 1.7032 0.9443 2066314 IFLab1_001196 CC(C)C(=O)Nc1nnc(s1)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G09 compound treatment 0.079 0.0272 1.75 0.085 0.0333 2.32 2.8799 0.9903 1459250 IFLab1_001197 CC(=O)Oc1ccc2c(=O)c(c3nc4ccccc4s3)c(C)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G10 compound treatment 0.175 0.123 7.93 0.199 0.147 10.29 12.8805 0.9917 1410281 IFLab1_001198 CCCCC(=O)NC1=C(SCC1)C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G11 compound treatment 0.121 0.0692 4.45 0.133 0.0813 5.68 7.1625 0.9928 1501543 IFLab1_001199 Cc1oc2cc(O)ccc2c(=O)c1c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G12 compound treatment 0.056 0.00419 0.27 0.054 0.00225 0.16 0.3017 0.967 1544488 IFLab1_001200 COc1ccc(cc1OC)C(=O)Nc2nnc(s2)c3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G13 compound treatment 0.051 -8.13E-4 -0.05 0.057 0.00525 0.37 0.2224 0.6002 1156157 IFLab1_001201 Cc1ccccc1Nc2ncc(s2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G14 compound treatment 0.057 0.00519 0.33 0.059 0.00725 0.51 0.5942 0.9796 1219723 IFLab1_001202 CCc1nnc(NC(=O)COc2ccc(Cl)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G15 compound treatment 0.055 0.00319 0.21 0.055 0.00325 0.23 0.3056 0.9987 1693047 IFLab1_001203 CC(C)COc1cccc(OCC(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G16 compound treatment 0.068 0.0162 1.04 0.069 0.0173 1.21 1.5889 0.9974 1615637 IFLab1_001204 Cc1cccc(c1)c2nnc(NC(=O)c3c(F)cccc3F)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G17 compound treatment 0.053 0.00119 0.08 0.05 -0.00175 -0.12 -0.0324 -0.2247 1629230 IFLab1_001205 NS(=O)(=O)c1ccc2nc(NC(=O)C3CC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G18 compound treatment 0.105 0.0532 3.42 0.082 0.0302 2.11 3.915 0.9731 1601099 IFLab1_001206 CSc1nc2ccc(NC(=O)C3CCCCC3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G19 compound treatment 0.06 0.00819 0.53 0.061 0.00925 0.65 0.8296 0.9949 2066315 IFLab1_001207 COc1cc(cc(OC)c1OC)C(=O)/C(=C/2\Nc3ccccc3S2)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G20 compound treatment 0.069 0.0172 1.11 0.089 0.0372 2.6 2.6223 0.9274 1166131 IFLab1_001208 O=C(OCc1nc2ccccc2s1)c3ccc(cc3)N4C(=O)CCC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G21 compound treatment 0.053 0.00119 0.08 0.049 -0.00275 -0.19 -0.0818 -0.3956 1514992 IFLab1_001209 CN(C)c1ccc(cc1)C(Nc2nccs2)c3ccc4cccnc4c3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G22 compound treatment 0.056 0.00419 0.27 0.051 -7.5E-4 -0.05 0.1535 0.5592 1617268 IFLab1_001210 COC(=O)Cc1csc(=Nc2ccccc2)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G23 mock treatment 0.048 -0.00381 -0.25 0.05 -0.00175 -0.12 -0.26 -0.9482 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 G24 mock treatment 0.051 -8.13E-4 -0.05 0.053 0.00125 0.09 0.0248 0.2433 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H01 compound treatment 0.074 0.0222 1.43 0.072 0.0203 1.41 2.0101 1.0 1738700 IFLab1_001211 CCOc1ccc2nc(NC(=O)COc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H02 compound treatment 0.052 1.88E-4 0.01 0.057 0.00525 0.37 0.2679 0.73 1640509 IFLab1_001212 CCCC1(CC2CC3CC(N)(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H03 compound treatment 0.053 0.00119 0.08 0.059 0.00725 0.51 0.4122 0.8047 1352697 IFLab1_001213 O=C(COc1ccccc1)Nc2sc3CCCc3c2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H04 compound treatment 0.056 0.00419 0.27 0.061 0.00925 0.65 0.6475 0.9248 1609850 IFLab1_001214 Oc1ccc(cc1CN2CCN(CC2)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H05 compound treatment 0.073 0.0212 1.36 0.063 0.0113 0.79 1.52 0.9657 1353666 IFLab1_001215 COc1ccc(NC(=O)C(C)NC(=O)C(c2ccccc2)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H06 compound treatment 0.076 0.0242 1.56 0.085 0.0333 2.32 2.7433 0.9811 1006846 IFLab1_001216 COc1ccc(cc1OC)C(=O)c2ccc(OC)c(OC)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H07 compound treatment 0.06 0.00819 0.53 0.054 0.00225 0.16 0.4838 0.8797 1563664 IFLab1_001217 Cc1cccc(NC(=O)c2cc3c(ccc4ccccc43)oc2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H08 compound treatment 0.052 1.88E-4 0.01 0.056 0.00425 0.3 0.2185 0.7352 1379899 IFLab1_001218 CC1(C)CC(CC(C)(C)N1)OC(=O)c2ccccc2C(=O)OC3CC(C)(C)NC(C)(C)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H09 compound treatment 0.061 0.00919 0.59 0.063 0.0113 0.79 0.9739 0.9902 2066316 IFLab1_001219 FC(F)(F)c1cccc(CC2S/C(=N/c3ccccc3)/NC2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H10 compound treatment 0.056 0.00419 0.27 0.059 0.00725 0.51 0.5487 0.9564 1579704 IFLab1_001220 OC(=O)CC(Cc1ccc(Cl)cc1)C(=O)NCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H11 compound treatment 0.069 0.0172 1.11 0.065 0.0133 0.93 1.4368 0.9961 2066317 IFLab1_001221 COc1ccc(/N=C/c2ccc(o2)c3ccc(OC)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H12 compound treatment 0.078 0.0262 1.69 0.087 0.0352 2.46 2.9332 0.9829 2066318 IFLab1_001222 FC(F)(F)c1cccc(c1)c2ccc(/C=C\3/SC(=S)NC3=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H13 compound treatment 0.054 0.00219 0.14 0.055 0.00325 0.23 0.2601 0.9736 1457186 IFLab1_001223 CC1(C)CC(CC(C)(C)N1)OC(=O)CC(=O)OC2CC(C)(C)NC(C)(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H14 compound treatment 0.049 -0.00281 -0.18 0.053 0.00125 0.09 -0.0663 -0.3297 1007502 IFLab1_001224 OC(=O)CCC(=O)Nc1ccc(Cl)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H15 compound treatment 0.052 1.88E-4 0.01 0.052 2.5E-4 0.02 0.0209 0.9837 1265036 IFLab1_001225 CC(C)c1ccc(O)c(CN2CCN(CC2)c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H16 compound treatment 0.043 -0.00881 -0.57 0.044 -0.00775 -0.54 -0.7839 -0.9997 1539446 IFLab1_001226 CCOC(=O)Cc1csc(NC(=O)c2sc3ccccc3c2Cl)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H17 compound treatment 0.048 -0.00381 -0.25 0.055 0.00325 0.23 -0.013 -0.0388 2066319 IFLab1_001227 CN(Cc1cccs1)C(=S)S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H18 compound treatment 0.049 -0.00281 -0.18 0.05 -0.00175 -0.12 -0.2145 -0.9817 2066320 IFLab1_001228 OC(=O)/C=C/c1ccc(cc1)S(=O)(=O)Nc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H19 compound treatment 1.072 1.02 65.66 1.094 1.04 72.81 97.9171 0.9987 1384687 IFLab1_001229 CCOc1ccc2NC(C)(C)c3ssc(=S)c3-c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H20 compound treatment 0.047 -0.00481 -0.31 0.048 -0.00375 -0.26 -0.4043 -0.9965 1681924 IFLab1_001230 COc1ccc2C(Nc3ccccn3)OC(=O)c2c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H21 compound treatment 0.109 0.0572 3.68 0.108 0.0563 3.93 5.3814 0.9995 2066321 IFLab1_001231 COC(=O)CSc1nnc(o1)c2ccc(Cl)cc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H22 compound treatment 0.055 0.00319 0.21 0.057 0.00525 0.37 0.4044 0.9623 1191458 IFLab1_001232 O=C(Nc1nc(cs1)c2cc3ccccc3oc2=O)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H23 mock treatment 0.054 0.00219 0.14 0.053 0.00125 0.09 0.1613 0.9736 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 H24 mock treatment 0.052 1.88E-4 0.01 0.054 0.00225 0.16 0.1197 0.7592 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I01 compound treatment 0.18 0.128 8.25 0.125 0.0732 5.12 9.4526 0.9736 2066322 IFLab1_001233 OC(=O)CCCSc1ncnc2sc3CCCCc3c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I02 compound treatment 0.333 0.281 18.1 0.212 0.16 11.2 20.7137 0.9733 1333100 IFLab1_001234 CC1CCc2sc(NC(=O)C)c(C(=O)N)c2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I03 compound treatment 0.417 0.365 23.51 0.525 0.473 33.06 39.9985 0.986 2066323 IFLab1_001235 CCOC(=O)CCSc1ncnc2sc3CCCc3c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I04 compound treatment 0.103 0.0512 3.29 0.116 0.0643 4.49 5.5035 0.9884 2066324 IFLab1_001236 CCSc1nnc(NC(=O)CC)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I05 compound treatment 0.062 0.0102 0.66 0.054 0.00225 0.16 0.5748 0.8525 2066325 IFLab1_001237 Cc1ccc(NC(=O)CSc2nnc3ccccn23)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I06 compound treatment 0.056 0.00419 0.27 0.057 0.00525 0.37 0.4499 0.9885 1280967 IFLab1_001238 CC(C)C(=O)Nc1nnc(s1)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I07 compound treatment 0.08 0.0282 1.81 0.08 0.0283 1.97 2.6784 0.9991 1445143 IFLab1_001239 Oc1ccc2oc(c(C(=O)N3CCCCC3)c2c1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I08 compound treatment 0.056 0.00419 0.27 0.057 0.00525 0.37 0.4499 0.9885 2066326 IFLab1_001240 CC(=O)Nc1nnc(s1)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I09 compound treatment 0.067 0.0152 0.98 0.064 0.0123 0.86 1.2964 0.9978 1400911 IFLab1_001241 CC(=O)Oc1ccc2c(=O)c(coc2c1)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I10 compound treatment 0.095 0.0432 2.78 0.1 0.0483 3.37 4.3491 0.9954 1316483 IFLab1_001242 COC(=O)C1=C(CCS1)NC(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I11 compound treatment 0.055 0.00319 0.21 0.058 0.00625 0.44 0.4538 0.9407 1614124 IFLab1_001243 COc1ccc2cc(c3nc4ccccc4n3C)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I12 compound treatment 0.056 0.00419 0.27 0.058 0.00625 0.44 0.4993 0.9731 1419025 IFLab1_001244 Cc1ccc(cc1)c2nnc(NC(=O)C3CCCCC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I13 compound treatment 0.161 0.109 7.03 0.195 0.143 10.01 12.0458 0.985 1128737 IFLab1_001245 COc1ccccc1Nc2ncc(s2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I14 compound treatment 0.059 0.00719 0.46 0.065 0.0133 0.93 0.9817 0.9486 1438184 IFLab1_001246 CC(C)c1nnc(NC(=O)COc2ccc(Cl)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I15 compound treatment 0.053 0.00119 0.08 0.059 0.00725 0.51 0.4122 0.8047 1286322 IFLab1_001247 Cc1ccc(OCC(=O)OC2CCS(=O)(=O)C2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I16 compound treatment 0.047 -0.00481 -0.31 0.052 2.5E-4 0.02 -0.2067 -0.6662 1188871 IFLab1_001248 COc1ccc2nc(NC(=O)C3CCCCC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I17 compound treatment 0.428 0.376 24.21 0.41 0.358 25.03 34.8183 0.9999 1680962 IFLab1_001249 Clc1cccc2sc(NC(=O)C3CC3)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I18 compound treatment 0.397 0.345 22.22 0.121 0.0693 4.84 19.1313 0.8414 1152746 IFLab1_001250 O=C(Nc1nc(cs1)c2ccc(C#N)cc2)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I19 compound treatment 0.059 0.00719 0.46 0.062 0.0103 0.72 0.8335 0.9777 2066327 IFLab1_001251 NS(=O)(=O)c1ccc2nc(NC(=O)c3cccc(c3)C(F)(F)F)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I20 compound treatment 0.052 1.88E-4 0.01 0.053 0.00125 0.09 0.0703 0.7973 1317436 IFLab1_001252 CC(=O)Nc1nc(CC(=O)c2ccccc2)cs1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I21 compound treatment 0.068 0.0162 1.04 0.087 0.0352 2.46 2.478 0.9267 1486508 IFLab1_001253 Oc1c(ccc2cccnc12)C(Nc3ccccc3)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I22 compound treatment 0.053 0.00119 0.08 0.054 0.00225 0.16 0.1652 0.9451 1648546 IFLab1_001254 OC(=O)CCC(=O)Nc1cccc(c1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I23 mock treatment 0.052 1.88E-4 0.01 0.054 0.00225 0.16 0.1197 0.7592 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 I24 mock treatment 0.053 0.00119 0.08 0.051 -7.5E-4 -0.05 0.017 0.1834 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J01 compound treatment 0.066 0.0142 0.91 0.07 0.0182 1.27 1.5472 0.9866 1384521 IFLab1_001255 Clc1ccc2nc(NC(=O)COc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J02 compound treatment 0.054 0.00219 0.14 0.062 0.0103 0.72 0.6059 0.8302 1346891 IFLab1_001256 Oc1ccc(cc1)c2cnc(nc2)c3ccc(O)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J03 compound treatment 0.051 -8.13E-4 -0.05 0.049 -0.00275 -0.19 -0.1728 -0.868 1222630 IFLab1_001257 O=C(COc1ccccc1)OCc2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J04 compound treatment 0.056 0.00419 0.27 0.06 0.00825 0.58 0.5981 0.9401 1270037 IFLab1_001258 Cc1cc(Cc2cc(C)c(N)c(C)c2)cc(C)c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J05 compound treatment 0.076 0.0242 1.56 0.09 0.0382 2.67 2.9903 0.9669 1379503 IFLab1_001259 CCOc1cccc2cc(C(=O)OC)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J06 compound treatment 0.048 -0.00381 -0.25 0.048 -0.00375 -0.26 -0.3588 -0.9995 1568728 IFLab1_001260 Cc1ccc(cc1)S(=O)(=O)c2cc(C)ccc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J07 compound treatment 0.057 0.00519 0.33 0.055 0.00325 0.23 0.3966 0.9823 1195296 IFLab1_001261 CCOc1cccc2cc(C(=O)Nc3ccc(Cl)cc3Cl)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J08 compound treatment 0.058 0.00619 0.4 0.061 0.00925 0.65 0.7385 0.973 1723897 IFLab1_001262 CCN(CC)C(=O)c1ccc(Oc2ccc(cc2)C(=O)N(CC)CC)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J09 compound treatment 0.263 0.211 13.59 0.271 0.219 15.32 20.4423 0.9982 2066328 IFLab1_001263 CC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J10 compound treatment 0.038 -0.0138 -0.89 0.04 -0.0118 -0.82 -1.2091 -0.9992 1072056 IFLab1_001264 OC(=O)c1cc(Br)c2ccccc2c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J11 compound treatment 0.079 0.0272 1.75 0.078 0.0262 1.83 2.5341 0.9997 1659159 IFLab1_001265 O=C(C1CCCCC1)N2CC(=O)N(CCc3ccccc3)C(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J12 compound treatment 0.094 0.0422 2.72 0.095 0.0432 3.02 4.0566 0.9986 2066329 IFLab1_001266 OC(=O)/C=C/c1ccc(o1)c2cccc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J13 compound treatment 0.049 -0.00281 -0.18 0.057 0.00525 0.37 0.1313 0.3211 2066330 IFLab1_001267 Clc1cccc(/C=C/2\N=C(OC2=O)c3ccco3)c1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J14 compound treatment 0.059 0.00719 0.46 0.063 0.0113 0.79 0.8829 0.9681 2066331 IFLab1_001268 Clc1ccc2nc(nc(c3ccccc3)c2c1)N4CCNCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J15 compound treatment 0.04 -0.0118 -0.76 0.04 -0.0118 -0.82 -1.1181 -0.9993 1161341 IFLab1_001269 Brc1ccc(cc1)C(=O)n2c(=O)oc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J16 compound treatment 0.049 -0.00281 -0.18 0.046 -0.00575 -0.4 -0.412 -0.9352 1593267 IFLab1_001270 CCOC(=O)c1csc(NC(=O)c2sc3ccccc3c2Cl)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J17 compound treatment 0.053 0.00119 0.08 0.048 -0.00375 -0.26 -0.1312 -0.4808 1359955 IFLab1_001271 CCOC(=O)c1cnc2c3nsnc3ccc2c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J18 compound treatment 0.07 0.0182 1.17 0.07 0.0182 1.27 1.7293 0.9991 1360581 IFLab1_001272 O=S(=O)(N1CCCCC1)c2cccc3cccnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J19 compound treatment 0.072 0.0202 1.3 0.076 0.0243 1.69 2.1167 0.9914 1702645 IFLab1_001273 CCOC(=O)c1c(OCC)[nH]c2c1cc(O)c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J20 compound treatment 0.051 -8.13E-4 -0.05 0.047 -0.00475 -0.33 -0.2716 -0.8086 1220831 IFLab1_001274 O=C1OC(Nc2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J21 compound treatment 0.055 0.00319 0.21 0.057 0.00525 0.37 0.4044 0.9623 1186914 IFLab1_001275 NC(=O)CSc1nc2ccccc2c(=O)[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J22 compound treatment 0.073 0.0212 1.36 0.055 0.00325 0.23 1.1248 0.8136 1219595 IFLab1_001276 CC(C)C(=O)Nc1nc(cs1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J23 mock treatment 0.054 0.00219 0.14 0.051 -7.5E-4 -0.05 0.0625 0.4161 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 J24 mock treatment 0.054 0.00219 0.14 0.049 -0.00275 -0.19 -0.0363 -0.1523 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K01 compound treatment 0.059 0.00719 0.46 0.058 0.00625 0.44 0.6359 0.9996 1786302 IFLab1_001277 OC(=O)CCc1nc2sc3CCCCc3c2c(=O)[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K02 compound treatment 0.713 0.661 42.56 0.706 0.654 45.71 62.4114 0.9994 1436253 IFLab1_001278 CC(C)C(=O)Nc1sc2CCC(C)Cc2c1C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K03 compound treatment 0.049 -0.00281 -0.18 0.054 0.00225 0.16 -0.0169 -0.0703 1477975 IFLab1_001279 CN1CCN(CC1)S(=O)(=O)c2ccc3OCCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K04 compound treatment 0.061 0.00919 0.59 0.07 0.0182 1.27 1.3197 0.939 1116592 IFLab1_001280 CCSc1nnc(NC(=O)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K05 compound treatment 0.056 0.00419 0.27 0.059 0.00725 0.51 0.5487 0.9564 1067361 IFLab1_001281 OC(=O)c1ccccc1C(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K06 compound treatment 0.07 0.0182 1.17 0.068 0.0163 1.14 1.6305 0.9999 2066332 IFLab1_001282 Cc1cccc(c1)c2nnc(NC(=O)C(C)(C)C)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K07 compound treatment 0.064 0.0122 0.78 0.056 0.00425 0.3 0.7646 0.9116 1444429 IFLab1_001283 CN(C)C(=O)c1c(oc2ccc(O)cc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K08 compound treatment 0.042 -0.00981 -0.63 0.04 -0.0118 -0.82 -1.027 -0.9916 2066333 IFLab1_001284 Clc1ccc(cc1)c2nnc(NC(=O)CBr)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K09 compound treatment 0.052 1.88E-4 0.01 0.053 0.00125 0.09 0.0703 0.7973 1922320 IFLab1_001285 CCc1cc2c(=O)c(c3nc4ccccc4n3C)c(oc2cc1O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K10 compound treatment 0.561 0.509 32.77 0.604 0.552 38.58 50.4548 0.9967 1461478 IFLab1_001286 COC(=O)C1=C(CCS1)NC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K11 compound treatment 0.055 0.00319 0.21 0.054 0.00225 0.16 0.2562 0.9913 1163362 IFLab1_001287 CCc1cc(c2n[nH]cc2c3nc4ccccc4n3C)c(O)cc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K12 compound treatment 0.052 1.88E-4 0.01 0.053 0.00125 0.09 0.0703 0.7973 1511522 IFLab1_001288 Fc1cccc(c1)C(=O)Nc2nnc(s2)c3ccc(Cl)cc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K13 compound treatment 0.055 0.00319 0.21 0.053 0.00125 0.09 0.2068 0.9276 2066334 IFLab1_001289 OC(=O)CSc1nnc(COc2ccccc2)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K14 compound treatment 0.096 0.0442 2.84 0.091 0.0393 2.74 3.95 0.9998 2066335 IFLab1_001290 CC(C)c1nnc(NC(=O)c2c(F)cccc2F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K15 compound treatment 0.053 0.00119 0.08 0.054 0.00225 0.16 0.1652 0.9451 1728810 IFLab1_001291 CC(NC(=O)COc1ccc(C)cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K16 compound treatment 0.097 0.0452 2.91 0.083 0.0313 2.18 3.6003 0.99 1588522 IFLab1_001292 Clc1ccc2nc(NC(=O)C3CCCCC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K17 compound treatment 0.213 0.161 10.37 0.189 0.137 9.59 14.116 0.9992 1371960 IFLab1_001293 O=C(Nc1nc2c(ccc3ccccc23)s1)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K18 compound treatment 0.139 0.0872 5.61 0.13 0.0783 5.47 7.8336 0.9999 1606388 IFLab1_001294 CCOC(=O)c1csc(NC(=O)C2CCCCC2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K19 compound treatment 0.055 0.00319 0.21 0.049 -0.00275 -0.19 0.0092 0.0328 1213849 IFLab1_001295 Cc1cccc2nc(CNc3ccc(I)cc3)cn12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K20 compound treatment 0.062 0.0102 0.66 0.06 0.00825 0.58 0.8712 0.9979 1483792 IFLab1_001296 CC(=O)Nc1ccc2nc(NC(=O)c3cc(Cl)ccc3Cl)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K21 compound treatment 0.055 0.00319 0.21 0.055 0.00325 0.23 0.3056 0.9987 1687669 IFLab1_001297 Fc1ccc(cc1)c2ncc3ccccn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K22 compound treatment 0.052 1.88E-4 0.01 0.051 -7.5E-4 -0.05 -0.0285 -0.5303 1233139 IFLab1_001298 Cc1cccc(NC(=O)CCC(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K23 mock treatment 0.051 -8.13E-4 -0.05 0.055 0.00325 0.23 0.1236 0.5303 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 K24 mock treatment 0.05 -0.00181 -0.12 0.055 0.00325 0.23 0.0781 0.3058 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L01 compound treatment 0.095 0.0432 2.78 0.096 0.0442 3.09 4.1515 0.9986 1476952 IFLab1_001299 O=C(COc1ccccc1)Nc2nc3CCCCc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L02 compound treatment 0.314 0.262 16.88 0.323 0.271 18.95 25.3322 0.9983 1522785 IFLab1_001300 CCc1ccc(OCC(=O)NCCc2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L03 compound treatment 0.07 0.0182 1.17 0.072 0.0203 1.41 1.8281 0.9956 1687354 IFLab1_001301 CCCC(=O)Nc1ccccc1c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L04 compound treatment 0.052 1.88E-4 0.01 0.056 0.00425 0.3 0.2185 0.7352 1616457 IFLab1_001302 CC1(C)CC(=O)C=C(C1)NCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L05 compound treatment 0.066 0.0142 0.91 0.058 0.00625 0.44 0.9545 0.943 1539653 IFLab1_001303 CCN(CC)c1ccc2cc(C#N)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L06 compound treatment 0.045 -0.00681 -0.44 0.045 -0.00675 -0.47 -0.6435 -0.9993 2066336 IFLab1_001304 Brc1ccc(/C=C/2\N=C(OC2=O)c3ccco3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L07 compound treatment 0.062 0.0102 0.66 0.06 0.00825 0.58 0.8712 0.9979 1508244 IFLab1_001305 CCOc1cccc2cc(c3nc4ccccc4[nH]3)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L08 compound treatment 0.053 0.00119 0.08 0.058 0.00625 0.44 0.3628 0.8184 2066337 IFLab1_001306 Cc1c(Cl)cccc1N/C=C/2\N=C(OC2=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L09 compound treatment 0.227 0.175 11.28 0.218 0.166 11.61 16.1858 0.9999 2066338 IFLab1_001307 CC(=O)Nc1ncc(Cc2ccc(C)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L10 compound treatment 0.058 0.00619 0.4 0.051 -7.5E-4 -0.05 0.2446 0.6088 1779852 IFLab1_001308 C/C(=C\C(=O)O)/C=C/c1cccnc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L11 compound treatment 0.057 0.00519 0.33 0.051 -7.5E-4 -0.05 0.199 0.5889 1229167 IFLab1_001309 C(Cn1c(NCc2cccs2)nc3ccccc13)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L12 compound treatment 0.053 0.00119 0.08 0.058 0.00625 0.44 0.3628 0.8184 2066339 IFLab1_001310 OC(=O)/C=C/c1ccc(o1)c2cccc(c2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L13 compound treatment 0.054 0.00219 0.14 0.055 0.00325 0.23 0.2601 0.9736 1686133 IFLab1_001311 Oc1cc(O)cc(c1)C(=O)Nc2cccc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L14 compound treatment 0.05 -0.00181 -0.12 0.05 -0.00175 -0.12 -0.1689 -0.9997 1683189 IFLab1_001312 CC(=O)Nc1nc2ccc(cc2s1)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L15 compound treatment 0.066 0.0142 0.91 0.059 0.00725 0.51 1.0039 0.9613 1570094 IFLab1_001313 CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)Nc2cccc(F)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L16 compound treatment 0.048 -0.00381 -0.25 0.049 -0.00275 -0.19 -0.3094 -0.9927 2066340 IFLab1_001314 Clc1c(sc2ccccc12)/C(=C\3/Nc4ccccc4S3)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L17 compound treatment 0.104 0.0522 3.36 0.097 0.0452 3.16 4.6105 0.9995 1600394 IFLab1_001315 COc1cccc(c1)C(=O)Nc2cccc(c2)c3nc4ncccc4o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L18 compound treatment 0.055 0.00319 0.21 0.055 0.00325 0.23 0.3056 0.9987 1478136 IFLab1_001316 OC(=O)c1ccc(cc1)S(=O)(=O)N2CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L19 compound treatment 0.053 0.00119 0.08 0.05 -0.00175 -0.12 -0.0324 -0.2247 1426498 IFLab1_001317 CCOC(=O)C1C(C(C(=O)OCC)C(C)(O)CC1=O)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L20 compound treatment 0.061 0.00919 0.59 0.065 0.0133 0.93 1.0727 0.9766 1625442 IFLab1_001318 COc1ccc(cc1)c2nc3SCCn3c2N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L21 compound treatment 0.05 -0.00181 -0.12 0.049 -0.00275 -0.19 -0.2183 -0.9714 2066341 IFLab1_001319 CC(=O)N/C(=C\c1ccccc1)/C(=O)Nc2cc(C)cc(C)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L22 compound treatment 0.057 0.00519 0.33 0.059 0.00725 0.51 0.5942 0.9796 1524726 IFLab1_001320 Fc1cccc(F)c1C(=O)Nc2nc(cs2)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L23 mock treatment 0.051 -8.13E-4 -0.05 0.056 0.00425 0.3 0.173 0.5737 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 L24 mock treatment 0.048 -0.00381 -0.25 0.049 -0.00275 -0.19 -0.3094 -0.9927 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M01 compound treatment 0.067 0.0152 0.98 0.062 0.0103 0.72 1.1976 0.9883 1138428 IFLab1_001321 COc1ccccc1C(=O)Nc2ncnc3sc4CCCCc4c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M02 compound treatment 0.077 0.0252 1.62 0.077 0.0253 1.76 2.3937 0.9991 1292616 IFLab1_001322 COc1ccccc1C(=O)Nc2sc3CCC(C)Cc3c2C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M03 compound treatment 0.057 0.00519 0.33 0.058 0.00625 0.44 0.5448 0.9912 2066342 IFLab1_001323 Cc1cccc(NC(=O)CSc2nnnn2c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M04 compound treatment 0.063 0.0112 0.72 0.071 0.0193 1.34 1.4601 0.9572 1124649 IFLab1_001324 CCSc1nnc(NC(=O)c2ccc(OC)cc2OC)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M05 compound treatment 0.056 0.00419 0.27 0.058 0.00625 0.44 0.4993 0.9731 1293606 IFLab1_001325 COc1ccc(cc1OC)C(=O)NCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M06 compound treatment 0.062 0.0102 0.66 0.064 0.0123 0.86 1.0688 0.9914 1195031 IFLab1_001326 Cc1cccc(c1)c2nnc(NC(=O)Cc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M07 compound treatment 0.126 0.0742 4.78 0.129 0.0772 5.4 7.1925 0.9981 1371174 IFLab1_001327 CCOC(=O)c1c(C)oc2ccc(OC(=O)c3ccco3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M08 compound treatment 0.059 0.00719 0.46 0.055 0.00325 0.23 0.4877 0.9463 2066343 IFLab1_001328 CCC(=O)Nc1nnc(s1)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M09 compound treatment 0.053 0.00119 0.08 0.056 0.00425 0.3 0.264 0.8611 1220572 IFLab1_001329 CC(=O)Oc1ccc2cc(c3nc4ccccc4s3)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M10 compound treatment 0.152 0.1 6.45 0.147 0.0953 6.65 9.265 0.9999 2066344 IFLab1_001330 COC(=O)C1=C(CCS1)NC(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M11 compound treatment 0.074 0.0222 1.43 0.071 0.0193 1.34 1.9607 0.9995 2066345 IFLab1_001331 Oc1ccc(c2n[nH]cc2c3nc4ccccc4s3)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M12 compound treatment 0.06 0.00819 0.53 0.053 0.00125 0.09 0.4344 0.8132 1147068 IFLab1_001332 CCSc1nnc(NC(=O)COc2ccc(Cl)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M13 compound treatment 0.062 0.0102 0.66 0.057 0.00525 0.37 0.723 0.9623 1384402 IFLab1_001333 OC(=O)CNC(=O)COc1ccc(Oc2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M14 compound treatment 0.07 0.0182 1.17 0.07 0.0182 1.27 1.7293 0.9991 1628487 IFLab1_001334 CCC(CC)C(=O)Nc1nnc(s1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M15 compound treatment 0.042 -0.00981 -0.63 0.044 -0.00775 -0.54 -0.8294 -0.9971 2066346 IFLab1_001335 COc1ccc(cc1)C(=O)/C(=C/2\Nc3ccccc3S2)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M16 compound treatment 0.06 0.00819 0.53 0.063 0.0113 0.79 0.9284 0.9811 1582551 IFLab1_001336 Cc1ccc2nc(NC(=O)C3CCCCC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M17 compound treatment 0.069 0.0172 1.11 0.065 0.0133 0.93 1.4368 0.9961 1348132 IFLab1_001337 CCOC(=O)c1sc(NC(=O)C2CC2)nc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M18 compound treatment 0.052 1.88E-4 0.01 0.052 2.5E-4 0.02 0.0209 0.9837 1493938 IFLab1_001338 COc1ccc(NC(=O)C2CCCCC2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M19 compound treatment 0.052 1.88E-4 0.01 0.054 0.00225 0.16 0.1197 0.7592 1502606 IFLab1_001339 Cc1cccc2nc(CSc3ccccc3N)cn12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M20 compound treatment 0.088 0.0362 2.33 0.093 0.0413 2.88 3.6847 0.9944 2066347 IFLab1_001340 Clc1ccc(Cl)c(c1)C(=O)OCc2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M21 compound treatment 0.07 0.0182 1.17 0.053 0.00125 0.09 0.8895 0.7577 1684460 IFLab1_001341 Cc1cccn2cc(COc3ccc(Cl)cc3)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M22 compound treatment 0.053 0.00119 0.08 0.05 -0.00175 -0.12 -0.0324 -0.2247 2066348 IFLab1_001342 Oc1nc(c2ccccc2)c3cc(Cl)ccc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M23 mock treatment 0.052 1.88E-4 0.01 0.052 2.5E-4 0.02 0.0209 0.9837 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 M24 mock treatment 0.054 0.00219 0.14 0.05 -0.00175 -0.12 0.0131 0.0703 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N01 compound treatment 0.066 0.0142 0.91 0.06 0.00825 0.58 1.0533 0.9754 1657252 IFLab1_001343 Cn1c(=NC(=O)COc2ccccc2)sc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N02 compound treatment 0.054 0.00219 0.14 0.059 0.00725 0.51 0.4577 0.8707 1537341 IFLab1_001344 OC(=O)CCCN1CCS(=O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N03 compound treatment 0.101 0.0492 3.17 0.102 0.0503 3.51 4.7209 0.9987 2066349 IFLab1_001345 CCCC(=O)Nc1nc(cs1)c2ccc(Cl)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N04 compound treatment 0.052 1.88E-4 0.01 0.052 2.5E-4 0.02 0.0209 0.9837 1983568 IFLab1_001346 CCN(CC)c1ccc2ccc(O)cc2[o+]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N05 compound treatment 0.088 0.0362 2.33 0.091 0.0393 2.74 3.5859 0.9967 1386125 IFLab1_001347 CCOc1cccc2cc(C#N)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N06 compound treatment 0.051 -8.13E-4 -0.05 0.055 0.00325 0.23 0.1236 0.5303 1561072 IFLab1_001348 COc1ccc(cc1)C(=O)NC2=C(C)N(C)N(C2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N07 compound treatment 0.142 0.0902 5.8 0.133 0.0813 5.68 8.1183 0.9999 1489044 IFLab1_001349 c1ccc2oc(nc2c1)c3ccnc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N08 compound treatment 0.063 0.0112 0.72 0.065 0.0133 0.93 1.1637 0.9923 1721659 IFLab1_001350 CCOC(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N09 compound treatment 0.066 0.0142 0.91 0.068 0.0163 1.14 1.4484 0.9942 2066350 IFLab1_001351 CC(C)C(=O)Nc1ncc(Cc2ccc(Cl)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N10 compound treatment 0.05 -0.00181 -0.12 0.055 0.00325 0.23 0.0781 0.3058 1285926 IFLab1_001352 CCC1(CC2CC3CC(N)(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N11 compound treatment 0.058 0.00619 0.4 0.053 0.00125 0.09 0.3434 0.8421 1697548 IFLab1_001353 Nc1ccc(c2nc3ccccc3[nH]2)c(N)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N12 compound treatment 0.056 0.00419 0.27 0.059 0.00725 0.51 0.5487 0.9564 1782504 IFLab1_001354 Fc1ccc(cc1)c2ccc(/C=C(\C#N)/c3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N13 compound treatment 0.051 -8.13E-4 -0.05 0.055 0.00325 0.23 0.1236 0.5303 1628850 IFLab1_001355 COc1ccc2[nH]c3C(C)NCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N14 compound treatment 0.055 0.00319 0.21 0.056 0.00425 0.3 0.355 0.9837 1372885 IFLab1_001356 CS(=O)(=O)c1ccc2nc(NC(=O)C3CC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N15 compound treatment 0.235 0.183 11.79 0.244 0.192 13.43 17.8342 0.9979 1326463 IFLab1_001357 COc1ccccc1Nc2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N16 compound treatment 0.045 -0.00681 -0.44 0.047 -0.00475 -0.33 -0.5447 -0.9906 1781991 IFLab1_001358 O=S(=O)(/C=C/c1ccccc1)n2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N17 compound treatment 0.064 0.0122 0.78 0.048 -0.00375 -0.26 0.3694 0.4467 1258045 IFLab1_001359 CC(C)(C)c1cc(CN2CCOCC2)c(O)c(CN3CCOCC3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N18 compound treatment 0.047 -0.00481 -0.31 0.051 -7.5E-4 -0.05 -0.2561 -0.8151 1016773 IFLab1_001360 CCOC(=O)CSc1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N19 compound treatment 0.609 0.557 35.86 0.483 0.431 30.13 46.6623 0.9962 1141026 IFLab1_001361 CC(C)c1ccc(C)c(Oc2cc(Cl)nc(N)n2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N20 compound treatment 0.05 -0.00181 -0.12 0.052 2.5E-4 0.02 -0.0701 -0.5946 2066351 IFLab1_001362 O=C(Cn1c(c[n+]2ccsc12)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N21 compound treatment 0.141 0.0892 5.74 0.044 -0.00775 -0.54 3.6763 0.6376 1585073 IFLab1_001363 CCc1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N22 compound treatment 0.054 0.00219 0.14 0.056 0.00425 0.3 0.3095 0.9419 1287641 IFLab1_001364 O=C(Nc1nc(cs1)c2cc3ccccc3oc2=O)C4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N23 mock treatment 0.052 1.88E-4 0.01 0.05 -0.00175 -0.12 -0.0779 -0.6342 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 N24 mock treatment 0.05 -0.00181 -0.12 0.053 0.00125 0.09 -0.0207 -0.1424 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O01 compound treatment 0.055 0.00319 0.21 0.058 0.00625 0.44 0.4538 0.9407 1381740 IFLab1_001365 O=S(=O)(N1CCN(Cc2ccccc2)CC1)c3ccc4OCCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O02 compound treatment 0.153 0.101 6.51 0.138 0.0862 6.03 8.8659 0.9992 1226038 IFLab1_001366 CC1CCc2sc(NC(=O)c3cccs3)c(C(=O)N)c2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O03 compound treatment 0.053 0.00119 0.08 0.056 0.00425 0.3 0.264 0.8611 2066352 IFLab1_001367 CCOC(=O)c1c(NC(=O)/C=C/c2ccco2)scc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O04 compound treatment 0.198 0.146 9.41 0.177 0.125 8.75 12.8406 0.9993 1257242 IFLab1_001368 CCSc1nnc(NC(=O)c2ccccc2Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O05 compound treatment 0.054 0.00219 0.14 0.05 -0.00175 -0.12 0.0131 0.0703 1432965 IFLab1_001369 CCOC(=O)c1c(oc2ccc(OC(=O)CC)cc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O06 compound treatment 0.058 0.00619 0.4 0.062 0.0103 0.72 0.7879 0.9617 1555885 IFLab1_001370 COc1ccccc1C(=O)Nc2nnc(s2)c3cccc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O07 compound treatment 0.053 0.00119 0.08 0.054 0.00225 0.16 0.1652 0.9451 1315017 IFLab1_001371 CCOC(=O)c1c(oc2ccc(O)c(CN3CCOCC3)c12)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O08 compound treatment 0.046 -0.00581 -0.37 0.047 -0.00475 -0.33 -0.4992 -0.9982 1634705 IFLab1_001372 Clc1ccc(cc1)c2nnc(NC(=O)C3CCCCC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O09 compound treatment 0.053 0.00119 0.08 0.053 0.00125 0.09 0.1158 0.9978 1422999 IFLab1_001373 CN(C)Cc1c(O)ccc2cc(c3nc4ccccc4[nH]3)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O10 compound treatment 0.191 0.139 8.96 0.173 0.121 8.47 12.3244 0.9996 1133059 IFLab1_001374 COC(=O)C1=C(CCS1)NC(=O)Cc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O11 compound treatment 0.052 1.88E-4 0.01 0.053 0.00125 0.09 0.0703 0.7973 1235738 IFLab1_001375 CCC1CCCCN1Cc2c(O)ccc3cc(c4nc(C)cs4)c(=O)oc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O12 compound treatment 0.204 0.152 9.8 0.148 0.0963 6.72 11.6811 0.9832 2066353 IFLab1_001376 COC(=O)C1=C(CCS1)NC(=O)CCCCl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O13 compound treatment 0.076 0.0242 1.56 0.072 0.0203 1.41 2.1012 0.9989 1711670 IFLab1_001377 COc1cccc(OCC(=O)Oc2ccc(cc2)C(=O)c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O14 compound treatment 0.059 0.00719 0.46 0.058 0.00625 0.44 0.6359 0.9996 2066354 IFLab1_001378 FC(F)(F)c1cccc(c1)C(=O)Nc2nnc(s2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O15 compound treatment 0.56 0.508 32.71 0.272 0.22 15.39 34.0091 0.9408 1178511 IFLab1_001379 CCOC(=O)c1c(NC(=O)C2CC2)sc3CCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O16 compound treatment 0.058 0.00619 0.4 0.057 0.00525 0.37 0.541 0.9992 1518941 IFLab1_001380 NS(=O)(=O)c1ccc2nc(NC(=O)C3CCCCC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O17 compound treatment 0.17 0.118 7.61 0.049 -0.00275 -0.19 5.2432 0.689 1584919 IFLab1_001381 COc1ccc(NC(=O)C2CC2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O18 compound treatment 0.052 1.88E-4 0.01 0.054 0.00225 0.16 0.1197 0.7592 1713763 IFLab1_001382 Brc1ccc2nc(NC(=O)c3ccc(cc3)N4C(=O)CCC4=O)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O19 compound treatment 0.483 0.431 27.75 0.446 0.394 27.54 39.0999 1.0 2066355 IFLab1_001383 COc1ccc(cc1)C(=O)OCc2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O20 compound treatment 0.051 -8.13E-4 -0.05 0.049 -0.00275 -0.19 -0.1728 -0.868 2066356 IFLab1_001384 Cc1csc(Nc2ccccc2)[n+]1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O21 compound treatment 0.054 0.00219 0.14 0.057 0.00525 0.37 0.3589 0.9136 1177653 IFLab1_001385 C(SC1=NCCS1)c2cn3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O22 compound treatment 0.051 -8.13E-4 -0.05 0.057 0.00525 0.37 0.2224 0.6002 2066357 IFLab1_001386 Oc1nc(c2ccccc2)c3cc(Br)ccc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O23 mock treatment 0.05 -0.00181 -0.12 0.048 -0.00375 -0.26 -0.2677 -0.9336 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 O24 mock treatment 0.049 -0.00281 -0.18 0.052 2.5E-4 0.02 -0.1157 -0.6359 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P01 compound treatment 0.061 0.00919 0.59 0.061 0.00925 0.65 0.8751 0.999 1566344 IFLab1_001387 CSc1nc2ccc(NC(=O)COc3ccccc3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P02 compound treatment 0.055 0.00319 0.21 0.055 0.00325 0.23 0.3056 0.9987 1915775 IFLab1_001388 OC(=O)CN(CCCc1ccccc1)CC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P03 compound treatment 0.076 0.0242 1.56 0.086 0.0343 2.39 2.7927 0.9783 2066358 IFLab1_001389 CCCC(=O)Nc1nc2CCC(C)Cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P04 compound treatment 0.058 0.00619 0.4 0.056 0.00425 0.3 0.4916 0.9895 2066359 IFLab1_001390 CC(NC(=O)C(C)(C)C)C1CC2CCC1C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P05 compound treatment 0.064 0.0122 0.78 0.068 0.0163 1.14 1.3574 0.9837 1328544 IFLab1_001391 COc1ccccc1NC(=O)c2cc3ccccc3oc2=N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P06 compound treatment 0.064 0.0122 0.78 0.065 0.0133 0.93 1.2092 0.9966 1163900 IFLab1_001392 CCOC(=O)c1ccc2nc(NC(=O)C3CCCCC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P07 compound treatment 0.058 0.00619 0.4 0.062 0.0103 0.72 0.7879 0.9617 2066360 IFLab1_001393 CCOc1ccc(CC2SC(=N)NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P08 compound treatment 0.059 0.00719 0.46 0.061 0.00925 0.65 0.7841 0.9866 1221857 IFLab1_001394 O=C1CN(CC(=O)N1CCc2ccccc2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P09 compound treatment 0.091 0.0392 2.52 0.092 0.0403 2.81 3.7718 0.9985 1360916 IFLab1_001395 COc1ccc(Cc2cnc(NC(=O)Cc3ccccc3)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P10 compound treatment 0.085 0.0332 2.14 0.088 0.0362 2.53 3.3011 0.9964 2066361 IFLab1_001396 CC(=C)C(=O)Nc1ccc(cc1)c2nc3cc(NC(=O)C(=C)C)ccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P11 compound treatment 0.062 0.0102 0.66 0.06 0.00825 0.58 0.8712 0.9979 1140011 IFLab1_001397 Cc1ccc(OCC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P12 compound treatment 0.058 0.00619 0.4 0.055 0.00325 0.23 0.4422 0.9645 1782503 IFLab1_001398 COc1ccc(cc1)c2ccc(/C=C(\C#N)/c3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P13 compound treatment 0.056 0.00419 0.27 0.055 0.00325 0.23 0.3511 0.9964 2066362 IFLab1_001399 O=S1(=O)N=C(NCc2ccccc2)c3ccccc31 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P14 compound treatment 0.052 1.88E-4 0.01 0.051 -7.5E-4 -0.05 -0.0285 -0.5303 1139871 IFLab1_001400 Cc1ccc(cc1)C(=O)Nc2nc3ccc(cc3s2)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P15 compound treatment 0.054 0.00219 0.14 0.054 0.00225 0.16 0.2107 0.9985 1041788 IFLab1_001401 CN1CCCC1c2cccnc2N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P16 compound treatment 0.051 -8.13E-4 -0.05 0.054 0.00225 0.16 0.0742 0.4477 2066363 IFLab1_001402 CS(=O)(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P17 compound treatment 0.054 0.00219 0.14 0.052 2.5E-4 0.02 0.1119 0.7888 1395261 IFLab1_001403 CC1(C)CC(CC(C)(C)N1)NC(=O)CNc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P18 compound treatment 0.071 0.0192 1.24 0.064 0.0123 0.86 1.4784 0.9839 1645376 IFLab1_001404 CCOC(=O)c1c(oc2ccc(OC(C)C(=O)OC)cc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P19 compound treatment 0.051 -8.13E-4 -0.05 0.051 -7.5E-4 -0.05 -0.074 -1.0 1343506 IFLab1_001405 Cc1ccc(NC(=O)c2ccccc2C(=O)O)cc1Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P20 compound treatment 0.054 0.00219 0.14 0.051 -7.5E-4 -0.05 0.0625 0.4161 1100932 IFLab1_001406 C1Cn2cc(nc2S1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P21 compound treatment 0.049 -0.00281 -0.18 0.048 -0.00375 -0.26 -0.3132 -0.9837 1705627 IFLab1_001407 CC(=O)Oc1ccc(cc1)C(=O)Nc2cc(Cl)ccc2OC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P22 compound treatment 0.051 -8.13E-4 -0.05 0.052 2.5E-4 0.02 -0.0246 -0.4467 1577296 IFLab1_001408 CCCC(=O)Nc1nc(cs1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P23 mock treatment 0.055 0.00319 0.21 0.053 0.00125 0.09 0.2068 0.9276 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1415 P24 mock treatment 0.052 1.88E-4 0.01 0.048 -0.00375 -0.26 -0.1767 -0.6738 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A01 compound treatment 0.077 0.0269 1.73 0.081 0.0271 1.9 2.5633 0.999 1743162 IFLab1_001409 CN(C)c1ccc(cc1)C(=O)Nc2nc3ccc(Cl)cc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A02 compound treatment 0.058 0.00788 0.51 0.063 0.00913 0.64 0.8094 0.9935 2066364 IFLab1_001410 CC(=O)Nc1nc(cs1)c2cc(Cl)sc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A03 compound treatment 0.128 0.0779 5.01 0.063 0.00913 0.64 3.9953 0.7907 1275248 IFLab1_001411 CC(=O)Nc1ccc2nc(NC(=O)CCOc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A04 compound treatment 0.067 0.0169 1.09 0.094 0.0401 2.8 2.7503 0.9148 2066365 IFLab1_001412 COc1ccc(/C=C\2/SC(=S)N(C(C)C(=O)O)C2=O)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A05 compound treatment 0.059 0.00887 0.57 0.064 0.0101 0.71 0.9043 0.9944 1150681 IFLab1_001413 CCOc1ccc(OCC)c(c1)S(=O)(=O)NCc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A06 compound treatment 0.063 0.0129 0.83 0.063 0.00913 0.64 1.0369 0.9916 2066366 IFLab1_001414 Clc1ccccc1NC(=O)CN2C(=O)S/C(=C/c3ccccc3)/C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A07 compound treatment 0.066 0.0159 1.02 0.074 0.0201 1.41 1.7169 0.9877 2066367 IFLab1_001415 CCN1C(=O)/C(=C\C=C\c2ccccc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A08 compound treatment 0.057 0.00688 0.44 0.064 0.0101 0.71 0.8133 0.9744 2066368 IFLab1_001416 CC(C)(C)NC(=O)CN1C(=O)S/C(=C\c2ccccc2)/C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A09 compound treatment 0.061 0.0109 0.7 0.079 0.0251 1.76 1.7363 0.9187 1157814 IFLab1_001417 Fc1ccccc1NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A10 compound treatment 0.059 0.00887 0.57 0.072 0.0181 1.27 1.2995 0.9353 2066369 IFLab1_001418 CCC(=O)Nc1c2CSCc2nn1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A11 compound treatment 0.052 0.00187 0.12 0.06 0.00613 0.43 0.3881 0.8724 2066370 IFLab1_001419 O/N=C/c1cn(CCC#N)nc1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A12 compound treatment 0.073 0.0229 1.47 0.083 0.0291 2.03 2.48 0.9874 1130107 IFLab1_001420 COc1ccc(cc1)n2nc3CSCc3c2NC(=O)C4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A13 compound treatment 0.059 0.00887 0.57 0.064 0.0101 0.71 0.9043 0.9944 1258421 IFLab1_001421 CSCCC(N1C(=O)CSC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A14 compound treatment 0.367 0.317 20.4 0.548 0.494 34.52 38.8311 0.9685 1742527 IFLab1_001422 CC(=O)Oc1ccc2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A15 compound treatment 0.055 0.00488 0.31 0.056 0.00213 0.15 0.327 0.9418 2066371 IFLab1_001423 CN1CCN(CC1)C(=O)CCN2C(=O)S/C(=C/c3ccc(C)cc3)/C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A16 compound treatment 0.057 0.00688 0.44 0.074 0.0201 1.41 1.3072 0.8868 1561178 IFLab1_001424 Fc1ccc(COc2ccc3ccc(=O)oc3c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A17 compound treatment 0.056 0.00588 0.38 0.061 0.00713 0.5 0.6196 0.9908 2066372 IFLab1_001425 COc1cccc(/C=C/2\SC(=O)N(CCC(=O)O)C2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A18 compound treatment 0.05 -1.25E-4 -0.01 0.054 1.29E-4 0.01 7.0E-4 0.0567 1347239 IFLab1_001426 COC(=O)C(C)Oc1ccc2c(C)cc(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A19 compound treatment 0.064 0.0139 0.89 0.071 0.0171 1.2 1.4776 0.9896 2066373 IFLab1_001427 CCCC(N1C(=O)/C(=C/c2ccccc2Cl)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A20 compound treatment 0.727 0.677 43.57 0.734 0.68 47.51 64.4038 0.9991 2066374 IFLab1_001428 CCCc1cc(=O)oc2cc(OC)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A21 compound treatment 0.058 0.00788 0.51 0.054 1.29E-4 0.01 0.3648 0.7196 1647010 IFLab1_001429 Oc1c(CN2CCCC2=O)cc(Cl)c3cccnc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A22 compound treatment 0.092 0.0419 2.7 0.107 0.0531 3.71 4.5303 0.9877 1718551 IFLab1_001430 CC(=O)Oc1ccc2c(cc(=O)oc2c1C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A23 mock treatment 0.052 0.00187 0.12 0.055 0.00113 0.08 0.1411 0.9787 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 A24 mock treatment 0.053 0.00288 0.19 0.055 0.00113 0.08 0.1866 0.9277 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B01 compound treatment 0.068 0.0179 1.15 0.084 0.0301 2.1 2.3019 0.9596 1417741 IFLab1_001431 CCOc1cc2oc(=O)cc(c3ccccc3)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B02 compound treatment 0.054 0.00388 0.25 0.056 0.00213 0.15 0.2815 0.9695 1377384 IFLab1_001432 O=C(Nc1nc(cs1)c2ccccc2)c3cc(=O)c4ccccc4o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B03 compound treatment 0.068 0.0179 1.15 0.067 0.0131 0.92 1.4621 0.9937 1250399 IFLab1_001433 Oc1cc(O)c2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B04 compound treatment 0.063 0.0129 0.83 0.062 0.00813 0.57 0.9875 0.983 1678427 IFLab1_001434 CCOC(=O)c1ccc(NC(=O)c2cc(=O)c3ccccc3o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B05 compound treatment 0.064 0.0139 0.89 0.07 0.0161 1.13 1.4282 0.9934 1662612 IFLab1_001435 O=C(COc1ccc2c3CCCc3c(=O)oc2c1)OCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B06 compound treatment 0.056 0.00588 0.38 0.06 0.00613 0.43 0.5702 0.9981 1730696 IFLab1_001436 CC(C)(CO)NC(=O)c1ccccc1F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B07 compound treatment 0.067 0.0169 1.09 0.068 0.0141 0.99 1.466 0.9989 1373454 IFLab1_001437 CC(Oc1cc(C)cc2oc(=O)c3CCCCc3c12)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B08 compound treatment 0.047 -0.00313 -0.2 0.053 -8.71E-4 -0.06 -0.1853 -0.8816 2066375 IFLab1_001438 CC(C)CCn1c(CO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B09 compound treatment 0.052 0.00187 0.12 0.072 0.0181 1.27 0.9809 0.771 1469532 IFLab1_001439 CN(C)Cc1c(O)ccc2c(cc(=O)oc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B10 compound treatment 0.051 8.75E-4 0.06 0.049 -0.00487 -0.34 -0.2008 -0.5822 1327495 IFLab1_001440 CCn1c(COc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B11 compound treatment 0.061 0.0109 0.7 0.059 0.00513 0.36 0.7483 0.9516 1278001 IFLab1_001441 Cc1c(O)c(CN2CCCC2)cc3c4CCCCc4c(=O)oc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B12 compound treatment 0.051 8.75E-4 0.06 0.05 -0.00387 -0.27 -0.1514 -0.5481 1002093 IFLab1_001442 CC(=O)Oc1ccc2c(C)cc(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B13 compound treatment 0.067 0.0169 1.09 0.061 0.00713 0.5 1.1202 0.9375 1675366 IFLab1_001443 CC(=C)COc1ccc2c3CCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B14 compound treatment 0.053 0.00288 0.19 0.06 0.00613 0.43 0.4336 0.9296 1264606 IFLab1_001444 Cc1ccc(NC(=O)CSc2nnc(NC(=O)c3cccs3)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B15 compound treatment 0.069 0.0189 1.21 0.091 0.0371 2.59 2.6932 0.9403 1184152 IFLab1_001445 N#CC(=C1C=C(Oc2ccccc12)c3ccccc3)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B16 compound treatment 0.055 0.00488 0.31 0.056 0.00213 0.15 0.327 0.9418 2066376 IFLab1_001446 Fc1ccccc1NC(=O)CSc2nnc(NC(=O)c3cccs3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B17 compound treatment 0.16 0.11 7.07 0.396 0.342 23.9 21.9013 0.8787 2066377 IFLab1_001447 O=c1cc(oc-2c1Cc3ccccc32)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B18 compound treatment 0.05 -1.25E-4 -0.01 0.051 -0.00287 -0.2 -0.1475 -0.7349 1726638 IFLab1_001448 CCCC(=O)Nc1nnc(SCC(=O)N2CCc3ccccc23)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B19 compound treatment 0.054 0.00388 0.25 0.052 -0.00187 -0.13 0.0839 0.2981 1180953 IFLab1_001449 CCN(CC)c1ccc2cc(c3nnc(o3)c4cccs4)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B20 compound treatment 0.053 0.00288 0.19 0.052 -0.00187 -0.13 0.0384 0.1696 1721660 IFLab1_001450 CCC(=O)Nc1nnc(SCc2cccc(F)c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B21 compound treatment 0.052 0.00187 0.12 0.058 0.00413 0.29 0.2893 0.9252 1403641 IFLab1_001451 O=C(N1CCc2ccccc12)c3ccc(cc3)N4C(=O)CCC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B22 compound treatment 0.049 -0.00112 -0.07 0.054 1.29E-4 0.01 -0.0448 -0.6143 1575463 IFLab1_001452 CCOC(=O)CSc1nnc(NC(=O)CC)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B23 mock treatment 0.05 -1.25E-4 -0.01 0.049 -0.00487 -0.34 -0.2463 -0.7236 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 B24 mock treatment 0.056 0.00588 0.38 0.053 -8.71E-4 -0.06 0.2244 0.5858 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C01 compound treatment 0.071 0.0209 1.34 0.084 0.0301 2.1 2.4384 0.9765 1728261 IFLab1_001453 CSc1nc2ccc(NC(=O)c3ccc(cc3)N(C)C)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C02 compound treatment 0.066 0.0159 1.02 0.061 0.00713 0.5 1.0747 0.9454 2066378 IFLab1_001454 CCOc1ccc2C(=O)/C(=C\c3ccccc3O)/Sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C03 compound treatment 0.077 0.0269 1.73 0.084 0.0301 2.1 2.7115 0.9953 1133641 IFLab1_001455 COc1ccc(cc1)c2csc(NC(=O)CCOc3ccccc3)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C04 compound treatment 0.073 0.0229 1.47 0.078 0.0241 1.69 2.233 0.9977 2066379 IFLab1_001456 COc1cccc(c1)N2C(=O)/C(=C/c3cccc(O)c3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C05 compound treatment 0.052 0.00187 0.12 0.061 0.00713 0.5 0.4375 0.8537 2066380 IFLab1_001457 O=S(=O)(NCCCN1CCOCC1)c2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C06 compound treatment 0.053 0.00288 0.19 0.059 0.00513 0.36 0.3842 0.9527 2066381 IFLab1_001458 CCCCc1nnc(NC(=O)CCCN2C(=O)/C(=C/c3ccccc3)/SC2=S)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C07 compound treatment 0.056 0.00588 0.38 0.06 0.00613 0.43 0.5702 0.9981 2066382 IFLab1_001459 CC(C)N1C(=O)/C(=C\c2ccc(cc2)C(F)(F)F)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C08 compound treatment 0.063 0.0129 0.83 0.065 0.0111 0.78 1.1357 0.9995 2066383 IFLab1_001460 CC(N1C(=O)/C(=C\c2ccco2)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C09 compound treatment 0.072 0.0219 1.41 0.084 0.0301 2.1 2.4839 0.9809 1258028 IFLab1_001461 Fc1ccc(NC(=O)c2ccc3ccccc3c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C10 compound treatment 0.051 8.75E-4 0.06 0.061 0.00713 0.5 0.392 0.7821 1469046 IFLab1_001462 CC(C)C(=O)Nc1c2CSCc2nn1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C11 compound treatment 0.663 0.613 39.45 0.622 0.568 39.69 55.9584 1.0 2066384 IFLab1_001463 Cc1ccc(o1)c2nn(cc2C#N)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C12 compound treatment 0.067 0.0169 1.09 0.068 0.0141 0.99 1.466 0.9989 1320609 IFLab1_001464 CC(C)(C)n1nc2CSCc2c1NC(=O)COc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C13 compound treatment 0.071 0.0209 1.34 0.066 0.0121 0.85 1.5492 0.9753 1922484 IFLab1_001465 OC(=O)CN1C(=O)/C(=C/c2ccccc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C14 compound treatment 0.981 0.931 59.92 0.751 0.697 48.7 76.8038 0.9947 1454292 IFLab1_001466 COc1ccc2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C15 compound treatment 0.054 0.00388 0.25 0.058 0.00413 0.29 0.3803 0.9974 2066385 IFLab1_001467 COc1ccccc1/C=C\2/SC(=O)N(CCC(=O)Nc3ccccc3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C16 compound treatment 0.069 0.0189 1.21 0.079 0.0251 1.76 2.1004 0.9838 1301535 IFLab1_001468 Clc1ccc(COc2ccc3ccc(=O)oc3c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C17 compound treatment 0.067 0.0169 1.09 0.084 0.0301 2.1 2.2564 0.9526 2066386 IFLab1_001469 CCN(CC)C(=O)CCCN1C(=O)/C(=C/c2ccc(OC)cc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C18 compound treatment 0.054 0.00388 0.25 0.055 0.00113 0.08 0.2321 0.8874 1329720 IFLab1_001470 Cc1cc(=O)oc2cc(OCC(=O)N)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C19 compound treatment 0.056 0.00588 0.38 0.057 0.00313 0.22 0.422 0.9661 2066387 IFLab1_001471 CCCC(N1C(=O)/C(=C/c2ccc(C)cc2)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C20 compound treatment 0.881 0.831 53.48 0.829 0.775 54.15 76.1056 1.0 2066388 IFLab1_001472 CCCc1cc(=O)oc2cc(OCC)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C21 compound treatment 0.048 -0.00213 -0.14 0.049 -0.00487 -0.34 -0.3373 -0.9198 1207391 IFLab1_001473 Cc1[nH]c2ccccc2c1C(Nc3ccccn3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C22 compound treatment 0.065 0.0149 0.96 0.14 0.0861 6.02 4.9316 0.8094 1609929 IFLab1_001474 CCOc1ccc2c(cc(=O)oc2c1C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C23 mock treatment 0.047 -0.00313 -0.2 0.054 1.29E-4 0.01 -0.1359 -0.6747 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 C24 mock treatment 0.049 -0.00112 -0.07 0.049 -0.00487 -0.34 -0.2918 -0.8388 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D01 compound treatment 0.059 0.00887 0.57 0.075 0.0211 1.48 1.4477 0.9147 1275473 IFLab1_001475 COC(=O)COc1cc2oc(=O)cc(c3ccccc3)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D02 compound treatment 0.06 0.00987 0.64 0.06 0.00613 0.43 0.7522 0.9815 1507053 IFLab1_001476 Clc1cccc(NC(=O)c2cc(=O)c3ccccc3o2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D03 compound treatment 0.049 -0.00112 -0.07 0.053 -8.71E-4 -0.06 -0.0942 -0.9963 1548289 IFLab1_001477 CC(=O)Oc1cc(OC(=O)C)c2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D04 compound treatment 0.055 0.00488 0.31 0.057 0.00313 0.22 0.3764 0.9844 1731317 IFLab1_001478 Brc1ccc(NC(=O)c2cc(=O)c3ccccc3o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D05 compound treatment 0.112 0.0619 3.98 0.119 0.0651 4.55 6.0334 0.9978 1184556 IFLab1_001479 CCOC(=O)C(C)Oc1ccc2c3CCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D06 compound treatment 0.099 0.0489 3.15 0.058 0.00413 0.29 2.4284 0.7687 1549066 IFLab1_001480 CC(C)(CO)NC(=O)c1ccc(Cl)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D07 compound treatment 0.057 0.00688 0.44 0.067 0.0131 0.92 0.9615 0.9441 1407462 IFLab1_001481 Cc1cc(OCC(=O)N)c2c3CCCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D08 compound treatment 0.053 0.00288 0.19 0.055 0.00113 0.08 0.1866 0.9277 2066389 IFLab1_001482 CCCn1c(CO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D09 compound treatment 0.053 0.00288 0.19 0.053 -8.71E-4 -0.06 0.0878 0.4509 1222573 IFLab1_001483 CN1CCN(Cc2c(O)ccc3c(cc(=O)oc23)c4ccccc4)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D10 compound treatment 0.049 -0.00112 -0.07 0.05 -0.00387 -0.27 -0.2424 -0.8659 2066390 IFLab1_001484 CC(C)n1c(COc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D11 compound treatment 0.059 0.00887 0.57 0.074 0.0201 1.41 1.3983 0.9212 1596779 IFLab1_001485 Cc1c(O)c(CN2CCOCC2)cc3c(cc(=O)oc13)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D12 compound treatment 0.056 0.00588 0.38 0.058 0.00413 0.29 0.4714 0.9911 1247768 IFLab1_001486 CC(=O)Nc1nnc(SCC(=O)Nc2ccccc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D13 compound treatment 0.059 0.00887 0.57 0.059 0.00513 0.36 0.6573 0.9748 1379272 IFLab1_001487 O=C(COc1ccc2c3CCCc3c(=O)oc2c1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D14 compound treatment 0.057 0.00688 0.44 0.059 0.00513 0.36 0.5663 0.9945 1659161 IFLab1_001488 Cc1ccc(NC(=O)CSc2nnc(NC(=O)C3CCCCC3)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D15 compound treatment 0.055 0.00488 0.31 0.055 0.00113 0.08 0.2776 0.8582 1413686 IFLab1_001489 N#CC(=C1C=C(Sc2ccccc12)c3ccccc3)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D16 compound treatment 0.057 0.00688 0.44 0.065 0.0111 0.78 0.8627 0.9643 2066391 IFLab1_001490 CC(C)(C)C(=O)Nc1nnc(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D17 compound treatment 0.05 -1.25E-4 -0.01 0.057 0.00313 0.22 0.1489 0.6806 1685836 IFLab1_001491 c1cnc2ccc(cc2c1)c3ccc4ncccc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D18 compound treatment 0.051 8.75E-4 0.06 0.082 0.0281 1.97 1.4294 0.7271 1651045 IFLab1_001492 O=C(CSc1nnc(NC(=O)C2CCCCC2)s1)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D19 compound treatment 0.054 0.00388 0.25 0.052 -0.00187 -0.13 0.0839 0.2981 2066392 IFLab1_001493 OC(=O)c1cc(=O)[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D20 compound treatment 0.109 0.0589 3.79 0.141 0.0871 6.09 6.9836 0.974 1332183 IFLab1_001494 CC(C)C(=O)Nc1nnc(SCc2cccc(F)c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D21 compound treatment 0.053 0.00288 0.19 0.064 0.0101 0.71 0.6312 0.863 1205400 IFLab1_001495 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)N2CCc3ccccc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D22 compound treatment 0.05 -1.25E-4 -0.01 0.053 -8.71E-4 -0.06 -0.0487 -0.7937 1310468 IFLab1_001496 CCOC(=O)CSc1nnc(NC(=O)C(C)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D23 mock treatment 0.049 -0.00112 -0.07 0.053 -8.71E-4 -0.06 -0.0942 -0.9963 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 D24 mock treatment 0.053 0.00288 0.19 0.057 0.00313 0.22 0.2854 0.9966 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E01 compound treatment 0.294 0.244 15.7 0.272 0.218 15.24 21.8747 0.9999 1152420 IFLab1_001497 CN(C)c1ccc(cc1)C(=O)Nc2nc(cs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E02 compound treatment 0.055 0.00488 0.31 0.055 0.00113 0.08 0.2776 0.8582 2066393 IFLab1_001498 Fc1ccccc1OCC(=O)Nc2cc(ccc2Cl)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E03 compound treatment 0.054 0.00388 0.25 0.056 0.00213 0.15 0.2815 0.9695 1125027 IFLab1_001499 Cc1cc(NC(=O)CCOc2ccccc2)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E04 compound treatment 0.053 0.00288 0.19 0.067 0.0131 0.92 0.7794 0.833 2066394 IFLab1_001500 COc1cccc(c1)N2C(=O)/C(=C/c3ccco3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E05 compound treatment 0.256 0.206 13.25 0.197 0.143 10.0 16.4403 0.9904 1350022 IFLab1_001501 Fc1ccc(cc1)C(=O)N2CCCC3C=CC=CC32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E06 compound treatment 0.054 0.00388 0.25 0.061 0.00713 0.5 0.5285 0.9489 2066395 IFLab1_001502 COc1ccc(/C=C/2\SC(=S)N(CCC(=O)Nc3ccc(C)cc3)C2=O)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E07 compound treatment 0.057 0.00688 0.44 0.055 0.00113 0.08 0.3687 0.8202 2066396 IFLab1_001503 Clc1c(CSc2nncn2c3ccccc3)nc4ncccn14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E08 compound treatment 0.045 -0.00513 -0.33 0.059 0.00513 0.36 0.0201 0.0413 2066397 IFLab1_001504 CC(N1C(=O)/C(=C\c2ccc(Br)cc2)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E09 compound treatment 0.058 0.00788 0.51 0.072 0.0181 1.27 1.254 0.9192 2066398 IFLab1_001505 CC(=O)NC1=NC(=O)CS1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E10 compound treatment 0.054 0.00388 0.25 0.055 0.00113 0.08 0.2321 0.8874 1210816 IFLab1_001506 CC(C)(C)n1nc2CSCc2c1NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E11 compound treatment 0.072 0.0219 1.41 0.083 0.0291 2.03 2.4345 0.9838 2066399 IFLab1_001507 O=c1oc2ccccc2cc1c3nn(cc3C#N)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E12 compound treatment 0.071 0.0209 1.34 0.076 0.0221 1.55 2.0432 0.9976 1584875 IFLab1_001508 CCCC(=O)Nc1c2CSCc2nn1c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E13 compound treatment 0.088 0.0379 2.44 0.082 0.0281 1.97 3.1133 0.9943 1913451 IFLab1_001509 OC(=O)CCN1C(=O)/C(=C/c2ccccc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E14 compound treatment 0.946 0.896 57.66 0.595 0.541 37.8 67.5048 0.979 1289218 IFLab1_001510 CCCOc1ccc2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E15 compound treatment 0.102 0.0519 3.34 0.138 0.0841 5.88 6.5168 0.9641 2066400 IFLab1_001511 CCOC(=O)CCCN1C(=O)/C(=C/c2ccc(OC)cc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E16 compound treatment 0.13 0.0799 5.14 0.123 0.0691 4.83 7.0502 0.9995 1682566 IFLab1_001512 Cc1cccc(COc2ccc3ccc(=O)oc3c2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E17 compound treatment 0.071 0.0209 1.34 0.076 0.0221 1.55 2.0432 0.9976 2066401 IFLab1_001513 Cc1ccc(/C=C/2\SC(=S)N(CCCC(=O)O)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E18 compound treatment 0.05 -1.25E-4 -0.01 0.053 -8.71E-4 -0.06 -0.0487 -0.7937 1411884 IFLab1_001514 CCOc1cc2oc(=O)cc(C)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E19 compound treatment 0.113 0.0629 4.05 0.108 0.0541 3.78 5.5355 0.9994 2066402 IFLab1_001515 CCOc1cc(/C=C/2\SC(=S)N(C(C(C)C)C(=O)O)C2=O)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E20 compound treatment 0.061 0.0109 0.7 0.06 0.00613 0.43 0.7977 0.9722 1476798 IFLab1_001516 CCCc1cc(=O)oc2cc(OCC(=O)O)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E21 compound treatment 0.055 0.00488 0.31 0.059 0.00513 0.36 0.4752 0.9978 1428720 IFLab1_001517 OCCN1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E22 compound treatment 0.066 0.0159 1.02 0.06 0.00613 0.43 1.0253 0.9254 1122185 IFLab1_001518 CCc1cc2c(cc(=O)oc2cc1O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E23 mock treatment 0.049 -0.00112 -0.07 0.049 -0.00487 -0.34 -0.2918 -0.8388 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 E24 mock treatment 0.05 -1.25E-4 -0.01 0.059 0.00513 0.36 0.2477 0.6911 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F01 compound treatment 0.054 0.00388 0.25 0.057 0.00313 0.22 0.3309 0.9978 1303820 IFLab1_001519 CCOC(=O)COc1cc2oc(=O)cc(c3ccccc3)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F02 compound treatment 0.063 0.0129 0.83 0.277 0.223 15.59 11.6082 0.7436 1326772 IFLab1_001520 COc1ccccc1NC(=O)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F03 compound treatment 0.09 0.0399 2.57 0.075 0.0211 1.48 2.8586 0.9655 1206227 IFLab1_001521 COc1cc(OC)c2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F04 compound treatment 0.052 0.00187 0.12 0.056 0.00213 0.15 0.1905 0.9946 1464242 IFLab1_001522 O=C(N1CCc2ccccc12)c3cc(=O)c4ccccc4o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F05 compound treatment 0.054 0.00388 0.25 0.064 0.0101 0.71 0.6767 0.902 1225694 IFLab1_001523 CC(Oc1ccc2c3CCCc3c(=O)oc2c1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F06 compound treatment 0.055 0.00488 0.31 0.049 -0.00487 -0.34 -0.0187 -0.0405 1584088 IFLab1_001524 CC(C)(CO)NC(=O)C(c1ccccc1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F07 compound treatment 0.129 0.0789 5.08 0.132 0.0781 5.46 7.4493 0.9993 1220389 IFLab1_001525 COc1cc(OC)c2c3CCCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F08 compound treatment 0.049 -0.00112 -0.07 0.053 -8.71E-4 -0.06 -0.0942 -0.9963 2066403 IFLab1_001526 OCc1nc2ccccc2n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F09 compound treatment 0.048 -0.00213 -0.14 0.05 -0.00387 -0.27 -0.2879 -0.9501 1176846 IFLab1_001527 Oc1ccc2c(cc(=O)oc2c1CN3CCOCC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F10 compound treatment 0.055 0.00488 0.31 0.051 -0.00287 -0.2 0.0801 0.215 2066404 IFLab1_001528 Cn1c(COc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F11 compound treatment 0.054 0.00388 0.25 0.065 0.0111 0.78 0.7261 0.8893 1208562 IFLab1_001529 CCN(CC)Cc1cc2c(cc(=O)oc2c(C)c1O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F12 compound treatment 0.054 0.00388 0.25 0.059 0.00513 0.36 0.4297 0.9843 1287153 IFLab1_001530 CCC(=O)Nc1nnc(SCC(=O)Nc2ccccc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F13 compound treatment 0.104 0.0539 3.47 0.115 0.0611 4.27 5.4717 0.9947 1590271 IFLab1_001531 CC1=CC(C=C(O1)c2ccccc2)C(C#N)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F14 compound treatment 0.052 0.00187 0.12 0.05 -0.00387 -0.27 -0.1059 -0.3576 1707654 IFLab1_001532 Cc1ccc(C)c(NC(=O)CSc2nnc(NC(=O)c3ccccc3F)s2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F15 compound treatment 0.047 -0.00313 -0.2 0.05 -0.00387 -0.27 -0.3334 -0.9894 2066405 IFLab1_001533 CCCC[n+]1c(C)sc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F16 compound treatment 0.069 0.0189 1.21 0.054 1.29E-4 0.01 0.8654 0.7123 2066406 IFLab1_001534 CCCC(=O)Nc1nnc(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F17 compound treatment 0.057 0.00688 0.44 0.07 0.0161 1.13 1.1096 0.9166 1592207 IFLab1_001535 CCOCC(=O)NC1(CC2CC3CC(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F18 compound treatment 0.052 0.00187 0.12 0.052 -0.00187 -0.13 -0.0071 -0.0398 1686691 IFLab1_001536 O=C(CSc1nnc(NC(=O)c2ccccc2)s1)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F19 compound treatment 0.088 0.0379 2.44 0.103 0.0491 3.43 4.1507 0.986 1559933 IFLab1_001537 Oc1ccc2cc(C(=O)Nc3ccc(F)cc3)c(=N)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F20 compound treatment 0.057 0.00688 0.44 0.053 -8.71E-4 -0.06 0.2699 0.6042 1507214 IFLab1_001538 Fc1cccc(CSc2nnc(NC(=O)COc3ccccc3)s2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F21 compound treatment 0.063 0.0129 0.83 0.07 0.0161 1.13 1.3827 0.9886 1148185 IFLab1_001539 O=C(N1CCc2ccccc2C1)c3ccc(cc3)S(=O)(=O)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F22 compound treatment 0.053 0.00288 0.19 0.054 1.29E-4 0.01 0.1372 0.7407 1244303 IFLab1_001540 CCOC(=O)CSc1nnc(NC(=O)C2(CC3CC4CC(C3)C2)C4)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F23 mock treatment 0.052 0.00187 0.12 0.055 0.00113 0.08 0.1411 0.9787 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 F24 mock treatment 0.048 -0.00213 -0.14 0.054 1.29E-4 0.01 -0.0903 -0.6591 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G01 compound treatment 0.056 0.00588 0.38 0.07 0.0161 1.13 1.0641 0.8953 1682851 IFLab1_001541 CN(C)c1ccc(cc1)C(=O)Nc2cc(C)on2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G02 compound treatment 0.057 0.00688 0.44 0.058 0.00413 0.29 0.5169 0.9785 2066407 IFLab1_001542 CC(N)(C(=O)O)c1cccc(OCc2ccccc2F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G03 compound treatment 0.053 0.00288 0.19 0.056 0.00213 0.15 0.236 0.9941 1599345 IFLab1_001543 NC(=O)c1c(NC(=O)CCOc2ccccc2)sc3CCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G04 compound treatment 0.051 8.75E-4 0.06 0.055 0.00113 0.08 0.0956 0.9864 2066408 IFLab1_001544 COC(=O)c1ccc(/C=C/2\SC(=S)N(C2=O)c3cccc(OC)c3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G05 compound treatment 0.051 8.75E-4 0.06 0.05 -0.00387 -0.27 -0.1514 -0.5481 1224648 IFLab1_001545 O=C(N1CCN(Cc2ccccc2)CC1)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G06 compound treatment 0.053 0.00288 0.19 0.057 0.00313 0.22 0.2854 0.9966 2066409 IFLab1_001546 Oc1ccc(cc1)N2C(=O)S/C(=C\c3ccccc3)/C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G07 compound treatment 0.25 0.2 12.86 0.195 0.141 9.86 16.0684 0.9914 1557893 IFLab1_001547 O=C(Nc1nc(cs1)c2ccccc2)C3CCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G08 compound treatment 0.062 0.0119 0.76 0.063 0.00913 0.64 0.9914 0.9959 2066410 IFLab1_001548 Cc1ccc(/C=C/2\SC(=S)N(C(CCC(=O)O)C(=O)O)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G09 compound treatment 0.056 0.00588 0.38 0.056 0.00213 0.15 0.3726 0.9169 2066411 IFLab1_001549 O=C(NC1=NC(=O)CS1)C2CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G10 compound treatment 0.071 0.0209 1.34 0.071 0.0171 1.2 1.7962 0.9983 1332028 IFLab1_001550 O=C(Nc1c2CSCc2nn1c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G11 compound treatment 0.133 0.0829 5.33 0.143 0.0891 6.23 8.1747 0.997 2066412 IFLab1_001551 N#Cc1cn(nc1c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G12 compound treatment 0.056 0.00588 0.38 0.057 0.00313 0.22 0.422 0.9661 2066413 IFLab1_001552 CCC(CC)C(=O)Nc1c2CSCc2nn1c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G13 compound treatment 0.068 0.0179 1.15 0.064 0.0101 0.71 1.3139 0.9727 2066414 IFLab1_001553 CC(C)C(N1C(=O)/C(=C\2/C(=O)Nc3ccccc23)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G14 compound treatment 0.103 0.0529 3.4 0.113 0.0591 4.13 5.3274 0.9954 1337075 IFLab1_001554 COC(=O)COc1ccc2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G15 compound treatment 0.055 0.00488 0.31 0.06 0.00613 0.43 0.5246 0.9883 2066415 IFLab1_001555 CN1CCN(CC1)C(=O)CN2C(=O)/C(=C/c3ccc(C)cc3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G16 compound treatment 0.122 0.0719 4.63 0.115 0.0611 4.27 6.2909 0.9992 1232944 IFLab1_001556 Cc1ccc(COc2ccc3ccc(=O)oc3c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G17 compound treatment 0.067 0.0169 1.09 0.073 0.0191 1.34 1.713 0.9947 2066416 IFLab1_001557 OC(=O)CN1C(=O)S/C(=C\c2ccccc2Cl)/C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G18 compound treatment 0.049 -0.00112 -0.07 0.048 -0.00587 -0.41 -0.3412 -0.8193 1653969 IFLab1_001558 COC(=O)COc1cc2oc(=O)cc(C)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G19 compound treatment 0.075 0.0249 1.6 0.075 0.0211 1.48 2.1759 0.9992 2066417 IFLab1_001559 CCOc1cc(/C=C/2\SC(=S)N(C(C)C(=O)O)C2=O)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G20 compound treatment 0.122 0.0719 4.63 0.147 0.0931 6.51 7.8717 0.986 1702937 IFLab1_001560 CCCOc1ccc2c(C)c(CCC)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G21 compound treatment 0.046 -0.00413 -0.27 0.048 -0.00587 -0.41 -0.4778 -0.9778 2066418 IFLab1_001561 CC1=CC(=O)/C(=C\c2c(O)cc(C)oc2=O)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G22 compound treatment 0.083 0.0329 2.12 0.127 0.0731 5.11 5.1087 0.9239 1172857 IFLab1_001562 CCCc1cc2c(cc(=O)oc2cc1OC(=O)C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G23 mock treatment 0.045 -0.00513 -0.33 0.05 -0.00387 -0.27 -0.4245 -0.9951 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 G24 mock treatment 0.054 0.00388 0.25 0.054 1.29E-4 0.01 0.1827 0.7322 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H01 compound treatment 0.057 0.00688 0.44 0.062 0.00813 0.57 0.7145 0.9924 1534948 IFLab1_001563 CCOC(=O)C(C)Oc1cc2oc(=O)cc(c3ccccc3)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H02 compound treatment 0.072 0.0219 1.41 0.083 0.0291 2.03 2.4345 0.9838 1297509 IFLab1_001564 COc1cccc(NC(=O)c2cc(=O)c3ccccc3o2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H03 compound treatment 0.081 0.0309 1.99 0.105 0.0511 3.57 3.9309 0.9617 1220421 IFLab1_001565 CCOc1cc(OCC)c2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H04 compound treatment 0.053 0.00288 0.19 0.05 -0.00387 -0.27 -0.0604 -0.1842 1413645 IFLab1_001566 CC(NC(=O)C(c1ccccc1)c2ccccc2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H05 compound treatment 0.061 0.0109 0.7 0.068 0.0141 0.99 1.1929 0.9858 1632768 IFLab1_001567 O=c1oc2cc(OCc3ccccc3)ccc2c4CCCc41 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H06 compound treatment 0.05 -1.25E-4 -0.01 0.048 -0.00587 -0.41 -0.2957 -0.7208 2066419 IFLab1_001568 CCCn1c(CC)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H07 compound treatment 0.055 0.00488 0.31 0.053 -8.71E-4 -0.06 0.1789 0.5596 2066420 IFLab1_001569 CCC(NCc1c(O)ccc2c3CCCc3c(=O)oc12)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H08 compound treatment 0.05 -1.25E-4 -0.01 0.054 1.29E-4 0.01 7.0E-4 0.0567 2066421 IFLab1_001570 CC(C)Cn1c(CO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H09 compound treatment 0.053 0.00288 0.19 0.052 -0.00187 -0.13 0.0384 0.1696 1583196 IFLab1_001571 CN1CCN(Cc2c(O)cc(C)c3c4ccccc4c(=O)oc23)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H10 compound treatment 0.051 8.75E-4 0.06 0.053 -8.71E-4 -0.06 -0.0032 -0.0386 2066422 IFLab1_001572 CC(C)n1c(CO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H11 compound treatment 0.055 0.00488 0.31 0.055 0.00113 0.08 0.2776 0.8582 1588833 IFLab1_001573 Cc1cc2oc(=O)cc(c3ccccc3)c2c(O)c1CN4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H12 compound treatment 0.056 0.00588 0.38 0.067 0.0131 0.92 0.9159 0.9232 1590861 IFLab1_001574 CC(C)C(=O)Nc1nnc(SCC(=O)Nc2ccccc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H13 compound treatment 0.06 0.00987 0.64 0.058 0.00413 0.29 0.6534 0.9361 1060778 IFLab1_001575 O=C(CC(C1CCCCC1=O)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H14 compound treatment 0.051 8.75E-4 0.06 0.059 0.00513 0.36 0.2932 0.8083 1392262 IFLab1_001576 CCCC(=O)Nc1nnc(SCC(=O)Nc2ccc(C)cc2C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H15 compound treatment 0.063 0.0129 0.83 0.072 0.0181 1.27 1.4815 0.9789 2066423 IFLab1_001577 CC(C)(C)c1ccc2ccccc2[o+]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H16 compound treatment 0.059 0.00887 0.57 0.067 0.0131 0.92 1.0525 0.974 1536325 IFLab1_001578 Cc1ccc(cc1)C(=O)Nc2nnc(SCC(=O)N3CCCCC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H17 compound treatment 0.07 0.0199 1.28 0.075 0.0211 1.48 1.9483 0.9975 1514764 IFLab1_001579 COC(=O)c1cc(Br)ccc1OC(=O)c2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H18 compound treatment 0.052 0.00187 0.12 0.058 0.00413 0.29 0.2893 0.9252 2066424 IFLab1_001580 CC(=O)Nc1nnc(SCc2ccc(cc2)C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H19 compound treatment 0.167 0.117 7.52 0.226 0.172 12.02 13.8222 0.9745 2066425 IFLab1_001581 CCCOC(=O)c1ccc(NC(=O)C(F)(F)F)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H20 compound treatment 0.057 0.00688 0.44 0.059 0.00513 0.36 0.5663 0.9945 1426131 IFLab1_001582 Fc1cccc(CSc2nnc(NC(=O)Cc3ccccc3)s2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H21 compound treatment 0.054 0.00388 0.25 0.06 0.00613 0.43 0.4791 0.9669 1540083 IFLab1_001583 O=C(N1CCc2ccccc2C1)c3ccc(cc3)N4C(=O)CCC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H22 compound treatment 0.066 0.0159 1.02 0.075 0.0211 1.48 1.7663 0.9839 1462660 IFLab1_001584 CCOC(=O)CSc1nnc(NC(=O)C2CCCCC2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H23 mock treatment 0.052 0.00187 0.12 0.051 -0.00287 -0.2 -0.0565 -0.2413 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 H24 mock treatment 0.051 8.75E-4 0.06 0.057 0.00313 0.22 0.1944 0.8612 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I01 compound treatment 0.058 0.00788 0.51 0.061 0.00713 0.5 0.7106 1.0 1191498 IFLab1_001585 Brc1ccc2nc(NC(=O)CCOc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I02 compound treatment 0.056 0.00588 0.38 0.071 0.0171 1.2 1.1135 0.8873 1337876 IFLab1_001586 NC(=O)c1cc(Br)c(O)c(Br)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I03 compound treatment 0.052 0.00187 0.12 0.097 0.0431 3.01 2.2158 0.7348 1403897 IFLab1_001587 Cc1csc(NC(=O)CCCC(=O)O)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I04 compound treatment 0.059 0.00887 0.57 0.06 0.00613 0.43 0.7067 0.9899 2066426 IFLab1_001588 CCN(CC)c1ccc(cc1)N2C(=O)/C(=C/c3ccccc3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I05 compound treatment 0.093 0.0429 2.76 0.067 0.0131 0.92 2.5999 0.894 2066427 IFLab1_001589 CCN1C(=O)/C(=C/c2ccccc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I06 compound treatment 0.061 0.0109 0.7 0.064 0.0101 0.71 0.9953 1.0 2066428 IFLab1_001590 Oc1ccc(/N=C/2\S/C(=C\c3ccccc3)/C(=O)N2c4ccc(O)cc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I07 compound treatment 0.052 0.00187 0.12 0.051 -0.00287 -0.2 -0.0565 -0.2413 1519257 IFLab1_001591 Cc1ccc(cc1)S(=O)(=O)NC(CC(=O)O)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I08 compound treatment 0.051 8.75E-4 0.06 0.067 0.0131 0.92 0.6884 0.7491 2066429 IFLab1_001592 CC(N1C(=O)/C(=C/c2cccc3ccccc23)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I09 compound treatment 0.08 0.0299 1.92 0.086 0.0321 2.24 2.9468 0.997 1918681 IFLab1_001593 OC(=O)c1cn(nc1c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I10 compound treatment 0.074 0.0239 1.54 0.06 0.00613 0.43 1.3894 0.871 2066430 IFLab1_001594 O=C(Nc1c2CSCc2nn1c3ccccc3)/C=C/c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I11 compound treatment 0.084 0.0339 2.18 0.089 0.0351 2.45 3.2771 0.9983 2066431 IFLab1_001595 CCc1ccc(cc1)c2nn(cc2C#N)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I12 compound treatment 0.058 0.00788 0.51 0.06 0.00613 0.43 0.6612 0.9965 2066432 IFLab1_001596 CC(C)CC(=O)Nc1c2CSCc2nn1c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I13 compound treatment 0.041 -0.00912 -0.59 0.051 -0.00287 -0.2 -0.5571 -0.8977 1916983 IFLab1_001597 CC(C)C(N1C(=O)/C(=C/c2ccccc2)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I14 compound treatment 0.053 0.00288 0.19 0.054 1.29E-4 0.01 0.1372 0.7407 1176011 IFLab1_001598 OC(=O)COc1ccc2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I15 compound treatment 0.065 0.0149 0.96 0.061 0.00713 0.5 1.0292 0.9536 2066433 IFLab1_001599 Oc1ccccc1NC(=O)CCCN2C(=O)/C(=C/c3ccccc3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I16 compound treatment 0.048 -0.00213 -0.14 0.052 -0.00187 -0.13 -0.1891 -0.9997 1641566 IFLab1_001600 CCOC(=O)COc1ccc2ccc(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I17 compound treatment 0.058 0.00788 0.51 0.063 0.00913 0.64 0.8094 0.9935 2066434 IFLab1_001601 CCC(N1C(=O)/C(=C/c2ccccc2)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I18 compound treatment 0.047 -0.00313 -0.2 0.051 -0.00287 -0.2 -0.284 -1.0 1136950 IFLab1_001602 CCOC(=O)COc1cc2oc(=O)cc(C)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I19 compound treatment 0.059 0.00887 0.57 0.056 0.00213 0.15 0.5091 0.8625 2066435 IFLab1_001603 O=C(CCN1C(=O)/C(=C/c2ccccc2)/SC1=S)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I20 compound treatment 0.077 0.0269 1.73 0.09 0.0361 2.52 3.0079 0.983 1634155 IFLab1_001604 CCCc1c(C)c2ccc(OCC(=O)OC)cc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I21 compound treatment 0.061 0.0109 0.7 0.06 0.00613 0.43 0.7977 0.9722 1631732 IFLab1_001605 Oc1c(CN2CCc3ccccc3C2)cc(Cl)c4cccnc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I22 compound treatment 0.074 0.0239 1.54 0.079 0.0251 1.76 2.328 0.9978 1657318 IFLab1_001606 CCCc1cc2c(cc(=O)oc2cc1O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I23 mock treatment 0.052 0.00187 0.12 0.057 0.00313 0.22 0.2399 0.9608 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 I24 mock treatment 0.051 8.75E-4 0.06 0.057 0.00313 0.22 0.1944 0.8612 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J01 compound treatment 0.12 0.0699 4.5 0.163 0.109 7.62 8.571 0.9683 1497163 IFLab1_001607 Cc1cc(O)c2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J02 compound treatment 0.064 0.0139 0.89 0.07 0.0161 1.13 1.4282 0.9934 1339908 IFLab1_001608 COc1ccc(NC(=O)c2cc(=O)c3ccccc3o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J03 compound treatment 0.058 0.00788 0.51 0.068 0.0141 0.99 1.0564 0.952 1456924 IFLab1_001609 CCOc1ccc2c3CCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J04 compound treatment 0.057 0.00688 0.44 0.067 0.0131 0.92 0.9615 0.9441 2066436 IFLab1_001610 COC(=O)c1ccc(Cl)c(N)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J05 compound treatment 0.059 0.00887 0.57 0.053 -8.71E-4 -0.06 0.3609 0.6282 1269936 IFLab1_001611 COc1cc2oc(=O)c3CCCc3c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J06 compound treatment 0.05 -1.25E-4 -0.01 0.052 -0.00187 -0.13 -0.0981 -0.7492 2066437 IFLab1_001612 C(Cn1cnc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J07 compound treatment 0.052 0.00187 0.12 0.053 -8.71E-4 -0.06 0.0423 0.3131 1348555 IFLab1_001613 CCCc1cc(=O)oc2c(CN3CCCCC3)c(O)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J08 compound treatment 0.047 -0.00313 -0.2 0.052 -0.00187 -0.13 -0.2347 -0.9782 1316654 IFLab1_001614 OCc1nc2ccccc2n1Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J09 compound treatment 0.048 -0.00213 -0.14 0.049 -0.00487 -0.34 -0.3373 -0.9198 1437457 IFLab1_001615 CCC1CCCCN1Cc2c(O)cc(C)c3c4ccccc4c(=O)oc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J10 compound treatment 0.071 0.0209 1.34 0.064 0.0101 0.71 1.4504 0.9551 2066438 IFLab1_001616 Fc1c(F)c(F)c(c(F)c1F)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J11 compound treatment 0.051 8.75E-4 0.06 0.059 0.00513 0.36 0.2932 0.8083 1552348 IFLab1_001617 COC(=O)c1ccc(Oc2coc3cc(OC)ccc3c2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J12 compound treatment 0.053 0.00288 0.19 0.098 0.0441 3.08 2.3108 0.7482 1577132 IFLab1_001618 O=C(CSc1nnc(NC(=O)Cc2ccccc2)s1)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J13 compound treatment 0.039 -0.0111 -0.72 0.042 -0.0119 -0.83 -1.0927 -0.9973 1667612 IFLab1_001619 Cc1cc(O)c(C(=O)c2ccccc2)c(=O)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J14 compound treatment 0.053 0.00288 0.19 0.062 0.00813 0.57 0.5324 0.8914 1605777 IFLab1_001620 CC(C)C(=O)Nc1nnc(SCC(=O)Nc2cc(C)cc(C)c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J15 compound treatment 0.662 0.612 39.38 0.586 0.532 37.17 54.1345 0.9996 2066439 IFLab1_001621 Nc1ccc2C(=O)/C(=C/c3ccco3)/Cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J16 compound treatment 0.057 0.00688 0.44 0.055 0.00113 0.08 0.3687 0.8202 1258313 IFLab1_001622 CC(C)C(=O)Nc1nnc(SCC(=O)N2CCCc3ccccc23)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J17 compound treatment 0.051 8.75E-4 0.06 0.057 0.00313 0.22 0.1944 0.8612 1295217 IFLab1_001623 CCOC(=O)c1cccc(n1)C(=O)Oc2ccc3cc(Br)ccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J18 compound treatment 0.051 8.75E-4 0.06 0.059 0.00513 0.36 0.2932 0.8083 2066440 IFLab1_001624 CCC(=O)Nc1nnc(SCc2ccc(cc2)C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J19 compound treatment 0.139 0.0889 5.72 0.113 0.0591 4.13 6.9658 0.9872 2066441 IFLab1_001625 Fc1ccc2nc(NC(=O)c3ccccc3Br)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J20 compound treatment 0.056 0.00588 0.38 0.068 0.0141 0.99 0.9653 0.9133 1180168 IFLab1_001626 Fc1cccc(CSc2nnc(NC(=O)C3CCCCC3)s2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J21 compound treatment 0.052 0.00187 0.12 0.05 -0.00387 -0.27 -0.1059 -0.3576 1724026 IFLab1_001627 CC1CC(C)CN(C1)C(=O)c2ccc(C#N)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J22 compound treatment 0.048 -0.00213 -0.14 0.051 -0.00287 -0.2 -0.2385 -0.9826 1141491 IFLab1_001628 CCOC(=O)CSc1nnc(NC(=O)c2ccccc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J23 mock treatment 0.052 0.00187 0.12 0.059 0.00513 0.36 0.3387 0.8958 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 J24 mock treatment 0.051 8.75E-4 0.06 0.053 -8.71E-4 -0.06 -0.0032 -0.0386 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K01 compound treatment 0.063 0.0129 0.83 0.068 0.0141 0.99 1.2839 0.9962 1200027 IFLab1_001629 CC1(C)CC(=O)c2sc(NC(=O)CCOc3ccccc3)nc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K02 compound treatment 0.043 -0.00713 -0.46 0.041 -0.0129 -0.9 -0.9601 -0.9512 2066442 IFLab1_001630 COC(=O)c1cc(Br)c(O)c(Br)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K03 compound treatment 0.061 0.0109 0.7 0.058 0.00413 0.29 0.6989 0.9232 2066443 IFLab1_001631 Clc1cccc(Cl)c1C(=O)n2nnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K04 compound treatment 0.043 -0.00713 -0.46 0.039 -0.0149 -1.04 -1.0589 -0.9324 2066444 IFLab1_001632 Cc1cccc(N2C(=O)/C(=C/c3ccc(O)c(O)c3)/SC2=S)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K05 compound treatment 0.122 0.0719 4.63 0.113 0.0591 4.13 6.1921 0.9984 2066445 IFLab1_001633 CCN1C(=O)/C(=C/c2cccc(OC)c2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K06 compound treatment 0.069 0.0189 1.21 0.056 0.00213 0.15 0.9642 0.7878 2066446 IFLab1_001634 CC(C)(C)NC(=O)CCN1C(=O)/C(=C/c2ccccc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K07 compound treatment 0.067 0.0169 1.09 0.058 0.00413 0.29 0.972 0.8649 1472427 IFLab1_001635 O=C(Nc1nc2sc3CCCCc3c2c(=O)s1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K08 compound treatment 0.076 0.0259 1.67 0.065 0.0111 0.78 1.7274 0.9398 1148757 IFLab1_001636 Clc1ccc2c(c1)c(nc3nnnn32)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K09 compound treatment 0.051 8.75E-4 0.06 0.053 -8.71E-4 -0.06 -0.0032 -0.0386 2066447 IFLab1_001637 CCN1C(=O)/C(=C/c2cn(CCC#N)nc2c3ccc(F)cc3)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K10 compound treatment 0.065 0.0149 0.96 0.06 0.00613 0.43 0.9798 0.9342 1492715 IFLab1_001638 O=C(Cc1ccccc1)Nc2c3CSCc3nn2c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K11 compound treatment 0.055 0.00488 0.31 0.061 0.00713 0.5 0.574 0.9752 2066448 IFLab1_001639 N#CCCn1cc(C#N)c(n1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K12 compound treatment 0.06 0.00987 0.64 0.059 0.00513 0.36 0.7028 0.9632 2066449 IFLab1_001640 O=C(Nc1c2CSCc2nn1c3ccccc3)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K13 compound treatment 0.047 -0.00313 -0.2 0.049 -0.00487 -0.34 -0.3828 -0.9685 2066450 IFLab1_001641 COc1ccccc1/C=C/2\SC(=O)N(CCC(=O)O)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K14 compound treatment 0.067 0.0169 1.09 0.067 0.0131 0.92 1.4166 0.9965 1364279 IFLab1_001642 COC(=O)C(C)Oc1ccc2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K15 compound treatment 0.051 8.75E-4 0.06 0.052 -0.00187 -0.13 -0.0526 -0.3696 2066451 IFLab1_001643 OC(=O)c1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccccc3)/SC2=S)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K16 compound treatment 0.048 -0.00213 -0.14 0.047 -0.00687 -0.48 -0.4361 -0.8738 1703933 IFLab1_001644 CCOC(=O)C(C)Oc1ccc2ccc(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K17 compound treatment 0.052 0.00187 0.12 0.056 0.00213 0.15 0.1905 0.9946 2066452 IFLab1_001645 CC(N1C(=O)/C(=C/c2ccccc2Cl)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K18 compound treatment 0.047 -0.00313 -0.2 0.048 -0.00587 -0.41 -0.4322 -0.9462 1602155 IFLab1_001646 Cc1cc(=O)oc2cc(OCC(=O)O)c(Cl)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K19 compound treatment 0.171 0.121 7.78 0.05 -0.00387 -0.27 5.3102 0.6821 2066453 IFLab1_001647 O=C(CN1C(=O)/C(=C/c2ccccc2)/SC1=S)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K20 compound treatment 0.059 0.00887 0.57 0.081 0.0271 1.9 1.7441 0.8811 1677944 IFLab1_001648 CCCc1c(C)c2ccc(OCC(=O)O)cc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K21 compound treatment 0.064 0.0139 0.89 0.062 0.00813 0.57 1.0331 0.9761 1482253 IFLab1_001649 Oc1c(ccc2cccnc12)C(Nc3nccs3)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K22 compound treatment 0.07 0.0199 1.28 0.087 0.0331 2.31 2.5411 0.9609 1118351 IFLab1_001650 Oc1ccc2c(cc(=O)oc2c1O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K23 mock treatment 0.047 -0.00313 -0.2 0.047 -0.00687 -0.48 -0.4816 -0.9254 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 K24 mock treatment 0.049 -0.00112 -0.07 0.056 0.00213 0.15 0.054 0.3262 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L01 compound treatment 0.126 0.0759 4.88 0.151 0.0971 6.79 8.2513 0.987 1380521 IFLab1_001651 CC(=O)Oc1cc(C)cc2oc(=O)cc(c3ccccc3)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L02 compound treatment 0.056 0.00588 0.38 0.07 0.0161 1.13 1.0641 0.8953 1492849 IFLab1_001652 CCOc1ccc(NC(=O)c2cc(=O)c3ccccc3o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L03 compound treatment 0.057 0.00688 0.44 0.053 -8.71E-4 -0.06 0.2699 0.6042 1194526 IFLab1_001653 CCCOc1ccc2c3CCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L04 compound treatment 0.052 0.00187 0.12 0.054 1.29E-4 0.01 0.0917 0.7578 2066454 IFLab1_001654 O=C(CCC1CCCCC1)NC2=NCCS2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L05 compound treatment 0.075 0.0249 1.6 0.071 0.0171 1.2 1.9783 0.9897 1618364 IFLab1_001655 COc1cc(OC)c2c3CCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L06 compound treatment 0.049 -0.00112 -0.07 0.047 -0.00687 -0.48 -0.3906 -0.8047 2066455 IFLab1_001656 Cc1nc2ccccc2n1CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L07 compound treatment 0.051 8.75E-4 0.06 0.054 1.29E-4 0.01 0.0462 0.81 1550371 IFLab1_001657 CCCc1cc(=O)oc2c(CN3CCN(C)CC3)c(O)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L08 compound treatment 0.051 8.75E-4 0.06 0.061 0.00713 0.5 0.392 0.7821 1546436 IFLab1_001658 OCc1nc2ccccc2n1CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L09 compound treatment 0.055 0.00488 0.31 0.058 0.00413 0.29 0.4258 0.9991 1059295 IFLab1_001659 CN1CCN(Cc2c(O)ccc3c4CCCCc4c(=O)oc23)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L10 compound treatment 0.162 0.112 7.2 0.143 0.0891 6.23 9.4946 0.9974 2066456 IFLab1_001660 O=C1CC(SC(C1)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L11 compound treatment 0.058 0.00788 0.51 0.058 0.00413 0.29 0.5624 0.9643 1271679 IFLab1_001661 CCCc1cc(=O)oc2cc(OC(=O)C)cc(OC(=O)C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L12 compound treatment 0.054 0.00388 0.25 0.055 0.00113 0.08 0.2321 0.8874 1531292 IFLab1_001662 O=C(CSc1nnc(NC(=O)C2CC2)s1)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L13 compound treatment 0.144 0.0939 6.04 0.127 0.0731 5.11 7.885 0.9965 1605587 IFLab1_001663 COc1ccc(cc1)c2cc(=O)c3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L14 compound treatment 0.052 0.00187 0.12 0.055 0.00113 0.08 0.1411 0.9787 2066457 IFLab1_001664 CCCC(=O)Nc1nnc(SCC(=O)Nc2ccccc2C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L15 compound treatment 0.045 -0.00513 -0.33 0.053 -8.71E-4 -0.06 -0.2763 -0.8236 2066458 IFLab1_001665 COc1ccc(/C=N/c2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L16 compound treatment 0.055 0.00488 0.31 0.056 0.00213 0.15 0.327 0.9418 1570815 IFLab1_001666 O=C(Cc1ccccc1)Nc2nnc(SCC(=O)N3CCCc4ccccc34)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L17 compound treatment 0.053 0.00288 0.19 0.06 0.00613 0.43 0.4336 0.9296 2066459 IFLab1_001667 O=c1[nH]c(cs1)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L18 compound treatment 0.065 0.0149 0.96 0.079 0.0251 1.76 1.9183 0.9594 2066460 IFLab1_001668 CC(=O)Nc1nnc(SCc2cccc(c2)C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L19 compound treatment 0.064 0.0139 0.89 0.076 0.0221 1.55 1.7246 0.966 1424203 IFLab1_001669 COc1ccc(cc1)C(=O)Nc2nc3ccc(F)cc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L20 compound treatment 0.071 0.0209 1.34 0.062 0.00813 0.57 1.3516 0.9266 1427510 IFLab1_001670 Fc1cccc(CSc2nnc(NC(=O)c3ccccc3)s2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L21 compound treatment 0.047 -0.00313 -0.2 0.049 -0.00487 -0.34 -0.3828 -0.9685 2066461 IFLab1_001671 CC1CC(C)CN(C1)C(=O)c2sc3ccccc3c2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L22 compound treatment 0.05 -1.25E-4 -0.01 0.056 0.00213 0.15 0.0995 0.6679 1180987 IFLab1_001672 CN(C(=O)C(C)(C)C)c1nnc(s1)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L23 mock treatment 0.052 0.00187 0.12 0.053 -8.71E-4 -0.06 0.0423 0.3131 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 L24 mock treatment 0.05 -1.25E-4 -0.01 0.053 -8.71E-4 -0.06 -0.0487 -0.7937 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M01 compound treatment 0.067 0.0169 1.09 0.067 0.0131 0.92 1.4166 0.9965 1654772 IFLab1_001673 Cc1cc(C)c2nc(NC(=O)CCOc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M02 compound treatment 0.058 0.00788 0.51 0.055 0.00113 0.08 0.4142 0.8074 2066462 IFLab1_001674 COc1cc(/C=C/2\SC(=S)N(C2=O)c3cccc(c3)C(F)(F)F)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M03 compound treatment 0.074 0.0239 1.54 0.075 0.0211 1.48 2.1304 0.9998 1141643 IFLab1_001675 COc1cc(F)ccc1S(=O)(=O)N2CCCCC2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M04 compound treatment 0.083 0.0329 2.12 0.084 0.0301 2.1 2.9846 1.0 2066463 IFLab1_001676 OC(=O)C(Cc1ccccc1)N2C(=O)/C(=C/c3ccccc3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M05 compound treatment 0.125 0.0749 4.82 0.112 0.0581 4.06 6.2793 0.9964 2066464 IFLab1_001677 CCN1C(=O)/C(=C/c2ccccc2O)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M06 compound treatment 0.064 0.0139 0.89 0.077 0.0231 1.62 1.774 0.9609 2066465 IFLab1_001678 CCOC(=O)CCN1C(=O)/C(=C/c2ccc(C)cc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M07 compound treatment 0.092 0.0419 2.7 0.093 0.0391 2.73 3.8388 1.0 1158506 IFLab1_001679 Cc1oc2cc(O)ccc2c(=O)c1c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M08 compound treatment 0.052 0.00187 0.12 0.052 -0.00187 -0.13 -0.0071 -0.0398 2066466 IFLab1_001680 CC(=O)Nc1c2CSCc2nn1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M09 compound treatment 0.384 0.334 21.49 0.311 0.257 17.96 27.8974 0.996 2066467 IFLab1_001681 Cc1ccc(o1)c2nn(cc2/C=N/O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M10 compound treatment 0.049 -0.00112 -0.07 0.06 0.00613 0.43 0.2516 0.5793 1301858 IFLab1_001682 Clc1ccc(cc1)n2nc3CSCc3c2NC(=O)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M11 compound treatment 0.057 0.00688 0.44 0.056 0.00213 0.15 0.4181 0.8955 2066468 IFLab1_001683 O/N=C/c1cn(nc1c2cccnc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M12 compound treatment 0.058 0.00788 0.51 0.058 0.00413 0.29 0.5624 0.9643 1392605 IFLab1_001684 CCC(CC)C(=O)Nc1c2CSCc2nn1c3cccc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M13 compound treatment 0.058 0.00788 0.51 0.054 1.29E-4 0.01 0.3648 0.7196 2066469 IFLab1_001685 CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccc(Cl)cc3)/SC2=S)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M14 compound treatment 0.057 0.00688 0.44 0.061 0.00713 0.5 0.6651 0.9983 1403471 IFLab1_001686 NC(=O)COc1ccc2c(cc(=O)oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M15 compound treatment 0.087 0.0369 2.37 0.087 0.0331 2.31 3.3148 0.9999 2066470 IFLab1_001687 O=C(CCCN1C(=O)/C(=C/c2ccccc2)/SC1=S)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M16 compound treatment 0.052 0.00187 0.12 0.051 -0.00287 -0.2 -0.0565 -0.2413 1545368 IFLab1_001688 CC(Oc1ccc2ccc(=O)oc2c1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M17 compound treatment 0.056 0.00588 0.38 0.064 0.0101 0.71 0.7677 0.9569 2066471 IFLab1_001689 OC(=O)c1cccc(c1)N2C(=O)/C(=C/c3ccccc3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M18 compound treatment 0.056 0.00588 0.38 0.054 1.29E-4 0.01 0.2738 0.7238 1517439 IFLab1_001690 COC(=O)c1ccc(COc2cc3oc(=O)cc(C)c3cc2Cl)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M19 compound treatment 0.042 -0.00813 -0.52 0.041 -0.0129 -0.9 -1.0056 -0.9667 2066472 IFLab1_001691 CSCCC(N1C(=O)/C(=C/c2ccc(C)cc2)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M20 compound treatment 0.065 0.0149 0.96 0.074 0.0201 1.41 1.6713 0.9824 1576198 IFLab1_001692 CCCc1c(C)c2c(OCC)cc(OCC)cc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M21 compound treatment 0.148 0.0979 6.3 0.126 0.0721 5.04 8.0176 0.9939 2066473 IFLab1_001693 Fc1ccc(cc1)C(CC(=O)c2ccco2)SCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M22 compound treatment 0.065 0.0149 0.96 0.071 0.0171 1.2 1.5232 0.9939 1673658 IFLab1_001694 Oc1cc2oc(=O)cc(c3ccccc3)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M23 mock treatment 0.045 -0.00513 -0.33 0.048 -0.00587 -0.41 -0.5233 -0.9942 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 M24 mock treatment 0.049 -0.00112 -0.07 0.054 1.29E-4 0.01 -0.0448 -0.6143 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N01 compound treatment 0.125 0.0749 4.82 0.144 0.0901 6.3 7.86 0.9913 1303158 IFLab1_001695 COc1cc(C)cc2oc(=O)cc(c3ccccc3)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N02 compound treatment 0.061 0.0109 0.7 0.064 0.0101 0.71 0.9953 1.0 1311259 IFLab1_001696 CCOc1cccc(NC(=O)c2cc(=O)c3ccccc3o2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N03 compound treatment 0.099 0.0489 3.15 0.083 0.0291 2.03 3.6634 0.9778 1359118 IFLab1_001697 COC(=O)COc1ccc2c3CCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N04 compound treatment 0.066 0.0159 1.02 0.071 0.0171 1.2 1.5687 0.9969 1267907 IFLab1_001698 COC(=O)c1ccccc1NC(=O)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N05 compound treatment 0.227 0.177 11.38 0.35 0.296 20.69 22.6784 0.9604 1594889 IFLab1_001699 CCOc1cc(OCC)c2c3CCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N06 compound treatment 0.053 0.00288 0.19 0.057 0.00313 0.22 0.2854 0.9966 1617261 IFLab1_001700 OCCCc1nc2ccccc2n1CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N07 compound treatment 0.051 8.75E-4 0.06 0.052 -0.00187 -0.13 -0.0526 -0.3696 1481154 IFLab1_001701 CCCc1cc(=O)oc2c(CN3CCOCC3)c(O)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N08 compound treatment 0.048 -0.00213 -0.14 0.05 -0.00387 -0.27 -0.2879 -0.9501 2066474 IFLab1_001702 CCCn1c(COc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N09 compound treatment 0.052 0.00187 0.12 0.054 1.29E-4 0.01 0.0917 0.7578 1059294 IFLab1_001703 Oc1ccc2c3CCCCc3c(=O)oc2c1CN4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N10 compound treatment 0.067 0.0169 1.09 0.074 0.0201 1.41 1.7624 0.9919 1313591 IFLab1_001704 Cc1ccc(cc1)C2CC(=O)CC(S2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N11 compound treatment 0.05 -1.25E-4 -0.01 0.05 -0.00387 -0.27 -0.1969 -0.7278 1335067 IFLab1_001705 CCCc1cc(=O)oc2cc(O)cc(O)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N12 compound treatment 0.055 0.00488 0.31 0.057 0.00313 0.22 0.3764 0.9844 1360502 IFLab1_001706 O=C(CSc1nnc(NC(=O)c2ccccc2)s1)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N13 compound treatment 0.213 0.163 10.48 0.226 0.172 12.02 15.9158 0.9977 2066475 IFLab1_001707 Clc1ccc2c(=O)cc(oc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N14 compound treatment 0.052 0.00187 0.12 0.059 0.00513 0.36 0.3387 0.8958 1544143 IFLab1_001708 Fc1ccc(NC(=O)CSc2nnc(NC(=O)C3CCCCC3)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N15 compound treatment 0.038 -0.0121 -0.78 0.039 -0.0149 -1.04 -1.2864 -0.9901 2066476 IFLab1_001709 Fc1ccc(/C=C/C(=O)\C=C\c2ccc(F)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N16 compound treatment 0.055 0.00488 0.31 0.081 0.0271 1.9 1.562 0.8131 1568818 IFLab1_001710 Cc1ccc(cc1)C(=O)Nc2nnc(SCC(=O)N3CCCc4ccccc34)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N17 compound treatment 0.049 -0.00112 -0.07 0.048 -0.00587 -0.41 -0.3412 -0.8193 1624156 IFLab1_001711 Nc1ccc(cc1)c2cc(C(=O)O)c3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N18 compound treatment 0.054 0.00388 0.25 0.069 0.0151 1.06 0.9237 0.8506 1732206 IFLab1_001712 CCC(=O)Nc1nnc(SCc2ccc(Br)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N19 compound treatment 0.056 0.00588 0.38 0.053 -8.71E-4 -0.06 0.2244 0.5858 1231750 IFLab1_001713 COc1cccc(c1)C(=O)Nc2nc3ccc(F)cc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N20 compound treatment 0.056 0.00588 0.38 0.058 0.00413 0.29 0.4714 0.9911 1231846 IFLab1_001714 COc1ccccc1C(=O)Nc2nnc(SCc3cccc(F)c3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N21 compound treatment 0.882 0.832 53.54 0.813 0.759 53.03 75.3608 1.0 2066477 IFLab1_001715 CCOC(=O)c1sc(cc1N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N22 compound treatment 0.053 0.00288 0.19 0.171 0.117 8.18 5.9168 0.7229 2066478 IFLab1_001716 COC(=O)c1ccccc1N/C=C\2/SC(=S)NC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N23 mock treatment 0.05 -1.25E-4 -0.01 0.055 0.00113 0.08 0.0501 0.6317 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 N24 mock treatment 0.049 -0.00112 -0.07 0.051 -0.00287 -0.2 -0.193 -0.9052 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O01 compound treatment 0.059 0.00887 0.57 0.061 0.00713 0.5 0.7561 0.9977 1672421 IFLab1_001717 Oc1ccc(NC(=O)CCOc2ccccc2)cc1c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O02 compound treatment 0.053 0.00288 0.19 0.051 -0.00287 -0.2 -0.011 -0.0402 2066479 IFLab1_001718 FC(F)(F)c1cccc(c1)N2C(=O)/C(=C/c3cccs3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O03 compound treatment 0.073 0.0229 1.47 0.081 0.0271 1.9 2.3812 0.9922 1634906 IFLab1_001719 COc1ccc(Cl)cc1S(=O)(=O)N2CCCCC2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O04 compound treatment 0.056 0.00588 0.38 0.053 -8.71E-4 -0.06 0.2244 0.5858 2066480 IFLab1_001720 CN1C(=O)/C(=C/2\SC(=S)N(C2=O)c3ccc(C)cc3)/c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O05 compound treatment 0.064 0.0139 0.89 0.058 0.00413 0.29 0.8355 0.8902 2066481 IFLab1_001721 CCN1C(=O)/C(=C\c2ccc(C)o2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O06 compound treatment 0.073 0.0229 1.47 0.08 0.0261 1.83 2.3318 0.9943 2066482 IFLab1_001722 CCOC(=O)CCN1C(=O)/C(=C/c2ccccc2OC)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O07 compound treatment 0.059 0.00887 0.57 0.062 0.00813 0.57 0.8055 1.0 2066483 IFLab1_001723 CCc1ccc(cc1)c2cn3ccsc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O08 compound treatment 0.051 8.75E-4 0.06 0.051 -0.00287 -0.2 -0.102 -0.4896 2066484 IFLab1_001724 CC(=O)Nc1c2CSCc2nn1C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O09 compound treatment 0.35 0.3 19.3 0.04 -0.0139 -0.97 12.963 0.6708 2066485 IFLab1_001725 O/N=C/c1cn(nc1c2cccs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O10 compound treatment 0.084 0.0339 2.18 0.076 0.0221 1.55 2.6349 0.9858 1543452 IFLab1_001726 COc1ccc(cc1)n2nc3CSCc3c2NC(=O)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O11 compound treatment 0.056 0.00588 0.38 0.052 -0.00187 -0.13 0.175 0.4373 2066486 IFLab1_001727 O=C(CN1C(=O)/C(=C/c2ccccc2)/SC1=S)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O12 compound treatment 0.073 0.0229 1.47 0.069 0.0151 1.06 1.7885 0.9868 1172810 IFLab1_001728 Cc1cccc(c1)n2nc3CSCc3c2NC(=O)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O13 compound treatment 0.06 0.00987 0.64 0.059 0.00513 0.36 0.7028 0.9632 2066487 IFLab1_001729 Cc1ccc(/C=C\2/SC(=O)N(CCC(=O)O)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O14 compound treatment 0.057 0.00688 0.44 0.065 0.0111 0.78 0.8627 0.9643 1256406 IFLab1_001730 Fc1ccccc1COc2ccc3ccc(=O)oc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O15 compound treatment 0.045 -0.00513 -0.33 0.043 -0.0109 -0.76 -0.7703 -0.9303 1064179 IFLab1_001731 FC(F)(F)c1cccc(c1)N2C(=O)CSC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O16 compound treatment 0.058 0.00788 0.51 0.073 0.0191 1.34 1.3034 0.9119 1377440 IFLab1_001732 Cc1cc(=O)oc2cc(OCc3ccccc3F)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O17 compound treatment 0.071 0.0209 1.34 0.085 0.0311 2.17 2.4878 0.9732 2066488 IFLab1_001733 CCCOC(=O)C(C)N1C(=O)/C(=C/c2ccc(OC)cc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O18 compound treatment 0.208 0.158 10.16 0.229 0.175 12.23 15.8364 0.9957 1140550 IFLab1_001734 CCCc1cc(=O)oc2cc(OC(=O)C)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O19 compound treatment 0.053 0.00288 0.19 0.056 0.00213 0.15 0.236 0.9941 2066489 IFLab1_001735 CSCCC(N1C(=O)/C(=C/c2ccc(O)cc2)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O20 compound treatment 0.086 0.0359 2.31 0.121 0.0671 4.69 4.9488 0.9467 1240833 IFLab1_001736 Cc1c(O)ccc2c(cc(=O)oc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O21 compound treatment 0.05 -1.25E-4 -0.01 0.055 0.00113 0.08 0.0501 0.6317 2066490 IFLab1_001737 Nc1nc(cs1)c2cc(Cl)sc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O22 compound treatment 0.055 0.00488 0.31 0.057 0.00313 0.22 0.3764 0.9844 1616603 IFLab1_001738 CC(=O)Oc1cc2oc(=O)cc(c3ccccc3)c2cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O23 mock treatment 0.046 -0.00413 -0.27 0.279 0.225 15.73 10.9333 0.6951 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 O24 mock treatment 0.049 -0.00112 -0.07 0.073 0.0191 1.34 0.8937 0.6678 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P01 compound treatment 0.062 0.0119 0.76 0.071 0.0171 1.2 1.3866 0.9766 1366445 IFLab1_001739 COC(=O)C(C)Oc1cc(C)cc2oc(=O)cc(c3ccccc3)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P02 compound treatment 0.059 0.00887 0.57 0.06 0.00613 0.43 0.7067 0.9899 1677477 IFLab1_001740 CCOc1ccccc1NC(=O)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P03 compound treatment 0.055 0.00488 0.31 0.06 0.00613 0.43 0.5246 0.9883 1298345 IFLab1_001741 CCOC(=O)COc1ccc2c3CCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P04 compound treatment 0.055 0.00488 0.31 0.058 0.00413 0.29 0.4258 0.9991 1358453 IFLab1_001742 COC(=O)c1ccc(C)c(NC(=O)C(C)NC(=O)C(c2ccccc2)c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P05 compound treatment 0.055 0.00488 0.31 0.062 0.00813 0.57 0.6234 0.9609 1377920 IFLab1_001743 Cc1c(OCC(=O)N)ccc2c3CCCCc3c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P06 compound treatment 0.053 0.00288 0.19 0.059 0.00513 0.36 0.3842 0.9527 1170966 IFLab1_001744 CC(O)c1nc2ccccc2n1CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P07 compound treatment 0.054 0.00388 0.25 0.056 0.00213 0.15 0.2815 0.9695 1377722 IFLab1_001745 CCCc1cc(=O)oc2c(CN3CCCC3)c(O)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P08 compound treatment 0.051 8.75E-4 0.06 0.055 0.00113 0.08 0.0956 0.9864 1735834 IFLab1_001746 CC(C)Cn1c(COc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P09 compound treatment 0.055 0.00488 0.31 0.059 0.00513 0.36 0.4752 0.9978 1545681 IFLab1_001747 Oc1ccc2c3CCCc3c(=O)oc2c1CN4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P10 compound treatment 0.056 0.00588 0.38 0.064 0.0101 0.71 0.7677 0.9569 1175371 IFLab1_001748 CC1(O)CC(SC(C1)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P11 compound treatment 0.061 0.0109 0.7 0.07 0.0161 1.13 1.2917 0.9738 1588913 IFLab1_001749 CC(=CCOc1ccc2c(c1)oc(=O)c3ccccc32)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P12 compound treatment 0.055 0.00488 0.31 0.055 0.00113 0.08 0.2776 0.8582 1684952 IFLab1_001750 CC(C)CC(=O)Nc1nnc(SCC(=O)Nc2ccc(C)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P13 compound treatment 0.054 0.00388 0.25 0.054 1.29E-4 0.01 0.1827 0.7322 1087106 IFLab1_001751 CC(=O)Nc1ccc2C(=O)CCc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P14 compound treatment 0.055 0.00488 0.31 0.059 0.00513 0.36 0.4752 0.9978 1195268 IFLab1_001752 Cc1ccccc1C(=O)Nc2nnc(SCC(=O)Nc3ccc(F)cc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P15 compound treatment 0.051 8.75E-4 0.06 0.047 -0.00687 -0.48 -0.2996 -0.6199 2066491 IFLab1_001753 O=C/1/C(=C/c2ccco2)/CC\C1=C/c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P16 compound treatment 0.049 -0.00112 -0.07 0.052 -0.00187 -0.13 -0.1436 -0.9612 1573578 IFLab1_001754 CC(=O)Nc1nnc(SCC(=O)N2CCc3ccccc23)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P17 compound treatment 0.052 0.00187 0.12 0.057 0.00313 0.22 0.2399 0.9608 1437274 IFLab1_001755 CC(=O)NC1(CC2CC3CC(CC(=O)O)(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P18 compound treatment 0.054 0.00388 0.25 0.058 0.00413 0.29 0.3803 0.9974 1361597 IFLab1_001756 CC(=O)Nc1nnc(SCc2cccc(F)c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P19 compound treatment 0.05 -1.25E-4 -0.01 0.053 -8.71E-4 -0.06 -0.0487 -0.7937 1473279 IFLab1_001757 CN(C)c1ccc(cc1)C(=O)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P20 compound treatment 0.051 8.75E-4 0.06 0.056 0.00213 0.15 0.145 0.9117 1116608 IFLab1_001758 CCOC(=O)CSc1nnc(NC(=O)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P21 compound treatment 0.052 0.00187 0.12 0.053 -8.71E-4 -0.06 0.0423 0.3131 1558744 IFLab1_001759 O=C(Nc1nc2ccccc2s1)c3cc(=O)c4ccccc4o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P22 compound treatment 0.051 8.75E-4 0.06 0.051 -0.00287 -0.2 -0.102 -0.4896 2066492 IFLab1_001760 CCc1ccc(cc1)C2CC(=O)NC(=C2C#N)SCC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P23 mock treatment 0.053 0.00288 0.19 0.051 -0.00287 -0.2 -0.011 -0.0402 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1416 P24 mock treatment 0.049 -0.00112 -0.07 0.049 -0.00487 -0.34 -0.2918 -0.8388 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A01 compound treatment 0.064 0.0139 0.89 0.068 0.0169 1.18 1.4682 0.9904 1706923 IFLab1_001761 COc1ccccc1NC(=O)C2=C(C)NC(=C(C#N)C2c3cccs3)SCC(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A02 compound treatment 0.078 0.0279 1.79 0.089 0.0379 2.65 3.1427 0.9819 2066493 IFLab1_001762 Fc1ccc(cc1Cl)N2C(SCC2=O)c3cccc(c3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A03 compound treatment 0.062 0.0119 0.76 0.064 0.0129 0.9 1.1796 0.9965 2066494 IFLab1_001763 COC(=O)[C@H]1C(C(=C(NC1=O)SC)C#N)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A04 compound treatment 0.067 0.0169 1.09 0.061 0.00994 0.69 1.2589 0.9766 2066495 IFLab1_001764 Cc1nnc(NC(=O)c2ccccc2C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A05 compound treatment 0.067 0.0169 1.09 0.072 0.0209 1.46 1.8023 0.9893 1619755 IFLab1_001765 NC(=O)CSC1=C(C#N)C(C(C#N)C(=O)N1)c2ccccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A06 compound treatment 0.063 0.0129 0.83 0.065 0.0139 0.97 1.2745 0.9968 2066496 IFLab1_001766 CC(C)c1nnc(NC(=O)c2ccccc2C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A07 compound treatment 0.057 0.00688 0.44 0.064 0.0129 0.9 0.952 0.946 2066497 IFLab1_001767 *c1ccccc1C2C(=O)N(C)c3ccccc3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A08 compound treatment 0.058 0.00788 0.51 0.058 0.00694 0.48 0.7011 0.9997 1500808 IFLab1_001768 CCOC(=O)c1c(C)c(C)sc1NC(=O)c2ccc(Cl)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A09 compound treatment 0.067 0.0169 1.09 0.07 0.0189 1.32 1.7035 0.9952 1510133 IFLab1_001769 COc1ccccc1N2CCN(CC2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A10 compound treatment 0.062 0.0119 0.76 0.068 0.0169 1.18 1.3772 0.9776 1622222 IFLab1_001770 Cc1ccc2n(C)c(=NC(=O)c3cccc(c3)N4C(=O)CCC4=O)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A11 compound treatment 0.057 0.00688 0.44 0.067 0.0159 1.11 1.1002 0.9183 1038790 IFLab1_001771 COc1ccc(C#CC(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A12 compound treatment 0.061 0.0109 0.7 0.054 0.00294 0.21 0.6401 0.8775 2066498 IFLab1_001772 BrC(=C)CSCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A13 compound treatment 0.059 0.00887 0.57 0.064 0.0129 0.9 1.043 0.9755 2066499 IFLab1_001773 COc1ccc2nc(NC(=O)/C=C/c3cccs3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A14 compound treatment 0.095 0.0449 2.89 0.101 0.0499 3.49 4.5092 0.9956 1322719 IFLab1_001774 CCC(C)Sc1nnc(NC(=O)c2cc(Cl)ccc2OC)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A15 compound treatment 0.066 0.0159 1.02 0.072 0.0209 1.46 1.7568 0.9846 1710534 IFLab1_001775 CC1CC(C)CN(C1)C(=O)c2ccc(cc2)S(=O)(=O)N3CC(C)CC(C)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A16 compound treatment 0.065 0.0149 0.96 0.065 0.0139 0.97 1.3655 1.0 1918857 IFLab1_001776 S=c1sc2ccccc2n1Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A17 compound treatment 0.055 0.00488 0.31 0.063 0.0119 0.83 0.8116 0.9108 1197782 IFLab1_001777 O=C(CN1C(=O)CCC1=O)Nc2ccc3CCc4cccc2c43 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A18 compound treatment 0.051 8.75E-4 0.06 0.057 0.00594 0.41 0.3331 0.7958 1250804 IFLab1_001778 OC(c1ccccc1)c2nccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A19 compound treatment 0.061 0.0109 0.7 0.065 0.0139 0.97 1.1834 0.9869 1304828 IFLab1_001779 COc1cccc(c1)C(=O)N=c2sc3cc(Cl)ccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A20 compound treatment 0.056 0.00588 0.38 0.057 0.00594 0.41 0.5607 0.9989 2066500 IFLab1_001780 CN1/C(=C\C=N\c2ccc(cc2)C(=O)O)/C(C)(C)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A21 compound treatment 0.138 0.0879 5.66 0.139 0.0879 6.14 8.3434 0.9991 1002763 IFLab1_001781 OC(=O)c1cccc(n1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A22 compound treatment 0.057 0.00688 0.44 0.061 0.00994 0.69 0.8038 0.9763 1380195 IFLab1_001782 O=C(N1CCOCC1)c2ccc(cc2)S(=O)(=O)N3CCc4ccccc4C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A23 mock treatment 0.055 0.00488 0.31 0.055 0.00394 0.28 0.4164 0.9978 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 A24 mock treatment 0.053 0.00288 0.19 0.059 0.00794 0.55 0.5229 0.8946 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B01 compound treatment 0.06 0.00987 0.64 0.068 0.0169 1.18 1.2861 0.9575 2066501 IFLab1_001783 Fc1ccc(cc1)C(=O)COC(=O)CSc2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B02 compound treatment 0.071 0.0209 1.34 0.068 0.0169 1.18 1.7868 0.998 1519483 IFLab1_001784 CCOc1ccccc1Nc2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B03 compound treatment 0.054 0.00388 0.25 0.06 0.00894 0.62 0.6179 0.919 2066502 IFLab1_001785 CCn1c(C)cc(C)[n+]1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B04 compound treatment 0.067 0.0169 1.09 0.073 0.0219 1.53 1.8517 0.9858 1430925 IFLab1_001786 CN(Cc1ccccc1)c2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B05 compound treatment 0.058 0.00788 0.51 0.054 0.00294 0.21 0.5035 0.9208 2066503 IFLab1_001787 Cc1ccc(Nc2ccc(C)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B06 compound treatment 0.073 0.0229 1.47 0.078 0.0269 1.88 2.3718 0.9926 1234994 IFLab1_001788 C(CC1=CCCCC1)Nc2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B07 compound treatment 0.078 0.0279 1.79 0.082 0.0309 2.16 2.7969 0.9957 2066504 IFLab1_001789 O/C(=N\c1ccccc1)/NC2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B08 compound treatment 0.055 0.00488 0.31 0.055 0.00394 0.28 0.4164 0.9978 1158576 IFLab1_001790 Cc1ccc(c(C)c1)n2ncc3c(NCCO)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B09 compound treatment 0.053 0.00288 0.19 0.063 0.0119 0.83 0.7205 0.8435 2066505 IFLab1_001791 Cc1sc[n+](CC(=O)c2ccc(Br)cc2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B10 compound treatment 0.054 0.00388 0.25 0.054 0.00294 0.21 0.3215 0.9953 1237630 IFLab1_001792 CN1CCc2c(C(=O)N)c(NC(=O)c3ccco3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B11 compound treatment 0.049 -0.00112 -0.07 0.053 0.00194 0.14 0.0445 0.2899 1587647 IFLab1_001793 OCc1cc(=O)c(O)c(CN2CCCCC2)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B12 compound treatment 0.058 0.00788 0.51 0.062 0.0109 0.76 0.8987 0.9801 1312557 IFLab1_001794 COc1ccc(cc1)C(=O)NCc2nnc(SC)n2C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B13 compound treatment 0.054 0.00388 0.25 0.057 0.00594 0.41 0.4697 0.9704 1319457 IFLab1_001795 CSc1nnc(CNC(=O)COc2ccccc2)n1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B14 compound treatment 0.055 0.00488 0.31 0.059 0.00794 0.55 0.614 0.9636 2066506 IFLab1_001796 O=C(Nc1nnc(s1)c2ccccc2)/C=C\c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B15 compound treatment 0.064 0.0139 0.89 0.067 0.0159 1.11 1.4188 0.994 1661799 IFLab1_001797 CSc1nnc(NC(=O)C2CCCCC2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B16 compound treatment 0.057 0.00688 0.44 0.062 0.0109 0.76 0.8532 0.9663 1717952 IFLab1_001798 CCOC(=O)C(CC)Sc1nnc(NC(=O)Cc2cccs2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B17 compound treatment 0.058 0.00788 0.51 0.057 0.00594 0.41 0.6517 0.995 1118747 IFLab1_001799 COc1cccc(c1)C(=O)Nc2nnc(SCc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B18 compound treatment 0.083 0.0329 2.12 0.081 0.0299 2.09 2.9751 1.0 1238367 IFLab1_001800 COC(CNc1ncnc2n(cc(c3ccccc3)c12)c4ccccc4)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B19 compound treatment 0.068 0.0179 1.15 0.075 0.0239 1.67 1.996 0.9833 1444994 IFLab1_001801 CSc1nnc(NC(=O)C2(CC3CC4CC(C3)C2)C4)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B20 compound treatment 0.092 0.0419 2.7 0.09 0.0389 2.72 3.8293 1.0 1173596 IFLab1_001802 CCC(=O)N1CCc2cc(OC)c(OC)cc2C1COc3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B21 compound treatment 0.098 0.0479 3.08 0.073 0.0219 1.53 3.2626 0.948 1713021 IFLab1_001803 Cc1ccc(c(C)c1)n2ncc3c(NCc4ccco4)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B22 compound treatment 0.063 0.0129 0.83 0.063 0.0119 0.83 1.1757 1.0 1385028 IFLab1_001804 O=C(CCc1ccccc1)N2CCN(CC2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B23 mock treatment 0.048 -0.00213 -0.14 0.049 -0.00206 -0.14 -0.1986 -0.9997 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 B24 mock treatment 0.055 0.00488 0.31 0.054 0.00294 0.21 0.367 0.9788 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C01 compound treatment 0.07 0.0199 1.28 0.07 0.0189 1.32 1.8401 0.9999 1252379 IFLab1_001805 C=CCSC1=C(C#N)C(CC(=O)N1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C02 compound treatment 0.058 0.00788 0.51 0.065 0.0139 0.97 1.0469 0.9537 1695744 IFLab1_001806 O=C(Nc1nnc(s1)c2ccccc2)c3ccc4ccccc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C03 compound treatment 0.053 0.00288 0.19 0.063 0.0119 0.83 0.7205 0.8435 2066507 IFLab1_001807 CCOc1ccccc1C2[C@H](C(=O)OC)C(=O)NC(=C2C#N)SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C04 compound treatment 0.065 0.0149 0.96 0.075 0.0239 1.67 1.8595 0.965 1211582 IFLab1_001808 Cc1nnc(NC(=O)CC2(CC3CC4CC(C3)C2)C4)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C05 compound treatment 0.072 0.0219 1.41 0.081 0.0299 2.09 2.4745 0.9815 1437597 IFLab1_001809 Clc1ccccc1C2C(C#N)C(=O)NC(=C2C#N)SCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C06 compound treatment 0.116 0.0659 4.24 0.112 0.0609 4.26 6.0084 1.0 1546770 IFLab1_001810 CC(C)c1nnc(NC(=O)c2cc(Br)ccc2Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C07 compound treatment 0.071 0.0209 1.34 0.075 0.0239 1.67 2.1326 0.9941 1714685 IFLab1_001811 Brc1ccc2[nH]c(=O)c(NC(=O)c3ccccc3)c(c4ccccc4)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C08 compound treatment 0.06 0.00987 0.64 0.055 0.00394 0.28 0.6439 0.9298 1362589 IFLab1_001812 CCOC(=O)c1c(C)c(C)sc1NC(=O)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C09 compound treatment 0.052 0.00187 0.12 0.058 0.00694 0.48 0.428 0.857 1217478 IFLab1_001813 Cc1cc(C)c(c(C)c1)S(=O)(=O)NC(CC(=O)O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C10 compound treatment 0.054 0.00388 0.25 0.056 0.00494 0.34 0.4203 0.9873 2066508 IFLab1_001814 CCCc1nc2ccccc2n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C11 compound treatment 0.062 0.0119 0.76 0.071 0.0199 1.39 1.5253 0.9601 1347042 IFLab1_001815 O=C(CCSc1ccccc1)Nc2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C12 compound treatment 0.081 0.0309 1.99 0.074 0.0229 1.6 2.5383 0.9943 1364584 IFLab1_001816 CCOC(=O)C(C)Sc1nnc(NC(=O)c2c(F)cccc2Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C13 compound treatment 0.051 8.75E-4 0.06 0.051 -6.25E-5 0.0 0.0367 0.6503 2066509 IFLab1_001817 Brc1ccc2nc(NC(=O)/C=C/c3cccs3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C14 compound treatment 0.054 0.00388 0.25 0.062 0.0109 0.76 0.7167 0.8916 2066510 IFLab1_001818 CCC(C)Sc1nnc(NC(=O)c2ccccc2C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C15 compound treatment 0.052 0.00187 0.12 0.059 0.00794 0.55 0.4774 0.8413 1565540 IFLab1_001819 Brc1ccc2nc(NC(=O)CN3C(=O)CCC3=O)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C16 compound treatment 0.066 0.0159 1.02 0.077 0.0259 1.81 2.0038 0.9633 1343195 IFLab1_001820 CCN1C(=O)c2cccc3c(N)ccc1c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C17 compound treatment 0.052 0.00187 0.12 0.052 9.38E-4 0.07 0.1316 0.9588 1235040 IFLab1_001821 O=C(CN1C(=O)CCC1=O)Nc2ccccc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C18 compound treatment 0.066 0.0159 1.02 0.066 0.0149 1.04 1.4604 0.9999 1307874 IFLab1_001822 O=C(OC(c1ccccc1)c2nccc3ccccc23)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C19 compound treatment 0.062 0.0119 0.76 0.071 0.0199 1.39 1.5253 0.9601 1734067 IFLab1_001823 COc1ccccc1C(=O)N=c2sc3cc(Cl)ccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C20 compound treatment 0.056 0.00588 0.38 0.058 0.00694 0.48 0.6101 0.9925 2066511 IFLab1_001824 C(OCc1nc2ccccc2s1)c3cn4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C21 compound treatment 0.825 0.775 49.87 0.711 0.66 46.1 67.8666 0.9992 1026938 IFLab1_001825 CC(=O)n1c2ccccc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C22 compound treatment 0.053 0.00288 0.19 0.056 0.00494 0.34 0.3748 0.9574 1138266 IFLab1_001826 COc1ccc(C(=O)Nc2ccc(O)c(c2)c3nc4ccccc4s3)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C23 mock treatment 0.047 -0.00313 -0.2 0.052 9.38E-4 0.07 -0.0959 -0.4534 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 C24 mock treatment 0.055 0.00488 0.31 0.052 9.38E-4 0.07 0.2682 0.8367 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D01 compound treatment 0.075 0.0249 1.6 0.072 0.0209 1.46 2.1664 0.999 1265183 IFLab1_001827 COC(=O)C1=C(C)NC(=C(C1c2cccs2)C(=O)OC)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D02 compound treatment 0.136 0.0859 5.53 0.146 0.0949 6.63 8.5982 0.9959 1726080 IFLab1_001828 CSc1ccccc1Nc2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D03 compound treatment 0.054 0.00388 0.25 0.07 0.0189 1.32 1.1118 0.8259 1495117 IFLab1_001829 COC(=O)c1ccc(NC2SC(=O)NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D04 compound treatment 0.061 0.0109 0.7 0.079 0.0279 1.95 1.875 0.9043 1308000 IFLab1_001830 CC1CCN(CC1)c2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D05 compound treatment 0.059 0.00887 0.57 0.061 0.00994 0.69 0.8948 0.9953 1239434 IFLab1_001831 Clc1ccc(cc1)C2=CSc3nnc(Cc4ccccc4)n3N2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D06 compound treatment 0.055 0.00488 0.31 0.093 0.0419 2.93 2.2935 0.7784 1206698 IFLab1_001832 OCCNc1ncnc2n(ncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D07 compound treatment 0.052 0.00187 0.12 0.053 0.00194 0.14 0.181 0.9984 2066512 IFLab1_001833 CCCc1n(C)c2ccccc2[n+]1CC(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D08 compound treatment 0.056 0.00588 0.38 0.06 0.00894 0.62 0.7089 0.9711 1173648 IFLab1_001834 CCOC(=O)c1c(NC(=O)C)sc2CN(CCc12)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D09 compound treatment 0.086 0.0359 2.31 0.098 0.0469 3.28 3.9514 0.9853 2066513 IFLab1_001835 O/N=C/c1ccc(o1)c2cc(Cl)ccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D10 compound treatment 0.063 0.0129 0.83 0.078 0.0269 1.88 1.9166 0.9321 1536384 IFLab1_001836 NC(=O)c1c(NC(=O)COc2ccc(Cl)cc2)sc3CN(Cc4ccccc4)CCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D11 compound treatment 0.051 8.75E-4 0.06 0.055 0.00394 0.28 0.2343 0.8346 1369784 IFLab1_001837 OCc1cc(=O)c(O)c(CN2CCc3ccccc3C2)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D12 compound treatment 0.053 0.00288 0.19 0.057 0.00594 0.41 0.4242 0.9338 2066514 IFLab1_001838 CCn1c(CNC(=O)c2ccc(OC)cc2)nnc1SC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D13 compound treatment 0.052 0.00187 0.12 0.058 0.00694 0.48 0.428 0.857 2066515 IFLab1_001839 CSc1nnc(CNC(=O)c2cccs2)n1c3cccc(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D14 compound treatment 0.055 0.00488 0.31 0.056 0.00494 0.34 0.4658 0.9989 2066516 IFLab1_001840 COc1ccc(/C=C/C(=O)Nc2nnc(s2)c3ccccc3)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D15 compound treatment 0.063 0.0129 0.83 0.063 0.0119 0.83 1.1757 1.0 1474513 IFLab1_001841 O=C(Nc1nnc(SCc2ccccc2)s1)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D16 compound treatment 0.058 0.00788 0.51 0.058 0.00694 0.48 0.7011 0.9997 1123435 IFLab1_001842 O=C(Cc1cccs1)Nc2nnc(SCC(=O)N3CCCCCC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D17 compound treatment 0.059 0.00887 0.57 0.057 0.00594 0.41 0.6972 0.9876 2066517 IFLab1_001843 CSc1nnc(NC(=O)c2ccc(C)c(C)c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D18 compound treatment 0.057 0.00688 0.44 0.065 0.0139 0.97 1.0014 0.9363 1262419 IFLab1_001844 OCCNc1ncnc2n(cc(c3ccccc3)c12)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D19 compound treatment 0.054 0.00388 0.25 0.054 0.00294 0.21 0.3215 0.9953 1599675 IFLab1_001845 CCCSc1nnc(NC(=O)C2(CC3CC4CC(C3)C2)C4)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D20 compound treatment 0.052 0.00187 0.12 0.058 0.00694 0.48 0.428 0.857 1466906 IFLab1_001846 COc1ccccc1OCC2N(CCc3cc(OC)c(OC)cc23)C(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D21 compound treatment 0.061 0.0109 0.7 0.066 0.0149 1.04 1.2328 0.9811 1290646 IFLab1_001847 C(Nc1ncnc2n(ncc12)c3ccccc3)C4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D22 compound treatment 0.041 -0.00912 -0.59 0.042 -0.00906 -0.63 -0.863 -0.9993 1241725 IFLab1_001848 COc1cccc2sc(NC(=O)C3COc4ccccc4O3)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D23 mock treatment 0.05 -1.25E-4 -0.01 0.05 -0.00106 -0.07 -0.0582 -0.7792 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 D24 mock treatment 0.05 -1.25E-4 -0.01 0.053 0.00194 0.14 0.09 0.6639 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E01 compound treatment 0.063 0.0129 0.83 0.064 0.0129 0.9 1.2251 0.9991 2066518 IFLab1_001849 Cc1[nH]nc2OC(=C(C#N)C(CCc3ccccc3)c12)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E02 compound treatment 0.067 0.0169 1.09 0.075 0.0239 1.67 1.9505 0.9782 2066519 IFLab1_001850 FC(F)(F)c1ccccc1C(=O)Nc2nnc(s2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E03 compound treatment 0.058 0.00788 0.51 0.064 0.0129 0.9 0.9975 0.9626 1227743 IFLab1_001851 CCCSC1=C(C#N)C(CC(=O)N1)c2cc(Br)c(O)c(OC)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E04 compound treatment 0.054 0.00388 0.25 0.057 0.00594 0.41 0.4697 0.9704 1170244 IFLab1_001852 CCc1nnc(NC(=O)c2c(OC)cccc2OC)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E05 compound treatment 0.052 0.00187 0.12 0.065 0.0139 0.97 0.7738 0.7887 1694562 IFLab1_001853 COC(=O)CSC1=C(C#N)C(C(C#N)C(=O)N1)c2ccccc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E06 compound treatment 0.087 0.0369 2.37 0.088 0.0369 2.58 3.5029 0.9991 1430816 IFLab1_001854 CC(C)c1nnc(NC(=O)CC2(CC3CC4CC(C3)C2)C4)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E07 compound treatment 0.054 0.00388 0.25 0.06 0.00894 0.62 0.6179 0.919 1694711 IFLab1_001855 CC(=O)Nc1c(c2ccccc2)c3cc(Br)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E08 compound treatment 0.054 0.00388 0.25 0.062 0.0109 0.76 0.7167 0.8916 1456677 IFLab1_001856 O=C(NC1SC2=C(CCCC2)C1C#N)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E09 compound treatment 0.079 0.0289 1.86 0.07 0.0189 1.32 2.2497 0.9861 1211135 IFLab1_001857 Oc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1C3CCCC3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E10 compound treatment 0.051 8.75E-4 0.06 0.052 9.38E-4 0.07 0.0861 0.9972 2066520 IFLab1_001858 CCCc1nc2ccccc2n1CCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E11 compound treatment 0.262 0.212 13.64 0.261 0.21 14.67 20.0136 0.9993 2066521 IFLab1_001859 O=C(CCSc1ccccc1)Nc2nc(cs2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E12 compound treatment 0.058 0.00788 0.51 0.054 0.00294 0.21 0.5035 0.9208 1249277 IFLab1_001860 CCOC(=O)C(C)Sc1nnc(NC(=O)c2ccc3ccccc3c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E13 compound treatment 0.071 0.0209 1.34 0.078 0.0269 1.88 2.2808 0.9864 2066522 IFLab1_001861 O=C(Nc1nc2CCCCc2s1)/C=C/c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E14 compound treatment 0.055 0.00488 0.31 0.061 0.00994 0.69 0.7128 0.9356 1556070 IFLab1_001862 CC(C)Sc1nnc(NC(=O)c2ccc3ccccc3c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E15 compound treatment 0.051 8.75E-4 0.06 0.054 0.00294 0.21 0.1849 0.869 1131316 IFLab1_001863 CC1CCc2nc(NC(=O)CN3C(=O)CCC3=O)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E16 compound treatment 0.25 0.2 12.86 0.235 0.184 12.85 18.1831 1.0 1161051 IFLab1_001864 Cc1ccc(cc1)C(CC(=O)c2ccco2)Sc3ccccc3N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E17 compound treatment 0.054 0.00388 0.25 0.054 0.00294 0.21 0.3215 0.9953 1197512 IFLab1_001865 O=C(CN1C(=O)CCC1=O)Nc2sc3CCCCc3c2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E18 compound treatment 0.064 0.0139 0.89 0.064 0.0129 0.9 1.2706 1.0 1253412 IFLab1_001866 Oc1c(CN2CCCCC2)cc(Cl)c3cccnc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E19 compound treatment 0.053 0.00288 0.19 0.052 9.38E-4 0.07 0.1772 0.9025 1212707 IFLab1_001867 CCOc1ccc(cc1)C(=O)N=c2sc3cc(Cl)ccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E20 compound treatment 0.052 0.00187 0.12 0.054 0.00294 0.21 0.2304 0.968 1670069 IFLab1_001868 CC1COc2c(F)c(F)cc3c(=O)c(cn1c23)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E21 compound treatment 0.058 0.00788 0.51 0.058 0.00694 0.48 0.7011 0.9997 1157091 IFLab1_001869 CC(=O)N(C1SC(=O)N(C1=O)c2ccc(C)cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E22 compound treatment 0.056 0.00588 0.38 0.058 0.00694 0.48 0.6101 0.9925 1241476 IFLab1_001870 COC(=O)c1ccc(cc1)C(=O)Nc2nc3ccc(C)cc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E23 mock treatment 0.047 -0.00313 -0.2 0.048 -0.00306 -0.21 -0.2935 -0.9995 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 E24 mock treatment 0.05 -1.25E-4 -0.01 0.052 9.38E-4 0.07 0.0406 0.6156 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F01 compound treatment 0.071 0.0209 1.34 0.067 0.0159 1.11 1.7374 0.9956 1544313 IFLab1_001871 CC(C)COP(=O)(C(O)c1ccc(cc1)N(C)C)c2ccc(cc2)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F02 compound treatment 0.182 0.132 8.49 0.17 0.119 8.31 11.8773 0.9999 2066523 IFLab1_001872 FC(F)(F)c1cccc(Nc2ncnc3n(ncc23)c4ccccc4)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F03 compound treatment 0.053 0.00288 0.19 0.073 0.0219 1.53 1.2145 0.7868 1307066 IFLab1_001873 Cc1ccccc1NC2(CCCCC2)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F04 compound treatment 0.054 0.00388 0.25 0.057 0.00594 0.41 0.4697 0.9704 1307373 IFLab1_001874 CCN1CCN(CC1)c2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F05 compound treatment 0.07 0.0199 1.28 0.076 0.0249 1.74 2.1364 0.9885 2066524 IFLab1_001875 Brc1cccc(c1)c2nnc(SCC(=O)c3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F06 compound treatment 0.053 0.00288 0.19 0.057 0.00594 0.41 0.4242 0.9338 2066525 IFLab1_001876 CN(C)CCCNc1ncnc2n(ncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F07 compound treatment 0.055 0.00488 0.31 0.056 0.00494 0.34 0.4658 0.9989 2066526 IFLab1_001877 CC(C)(C)C(=O)CSc1nnc(o1)c2ccncc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F08 compound treatment 0.052 0.00187 0.12 0.055 0.00394 0.28 0.2798 0.9316 1703237 IFLab1_001878 COC(=O)c1c(NC(=O)c2ccc(OC)cc2)sc3CN(C)CCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F09 compound treatment 0.173 0.123 7.91 0.214 0.163 11.38 13.6412 0.9842 1740986 IFLab1_001879 Clc1ccccc1c2ccc(o2)C(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F10 compound treatment 0.048 -0.00213 -0.14 0.048 -0.00306 -0.21 -0.248 -0.9766 1122518 IFLab1_001880 CC(C)N1CCc2c(C(=O)N)c(NC(=O)CCOc3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F11 compound treatment 0.054 0.00388 0.25 0.055 0.00394 0.28 0.3709 0.9988 2066527 IFLab1_001881 CSc1nnc(CNC(=O)c2ccccc2)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F12 compound treatment 0.055 0.00488 0.31 0.056 0.00494 0.34 0.4658 0.9989 1555617 IFLab1_001882 CCCCn1c(CNC(=O)c2ccc(OC)cc2)nnc1SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F13 compound treatment 0.062 0.0119 0.76 0.063 0.0119 0.83 1.1302 0.9991 2066528 IFLab1_001883 CCC(=O)Nc1nnc(SC)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F14 compound treatment 0.054 0.00388 0.25 0.057 0.00594 0.41 0.4697 0.9704 1545087 IFLab1_001884 Clc1ccc(cc1)c2nnc(NC(=O)Cc3cccs3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F15 compound treatment 0.054 0.00388 0.25 0.05 -0.00106 -0.07 0.1239 0.476 1476953 IFLab1_001885 CSc1nnc(NC(=O)COc2ccc(Cl)cc2Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F16 compound treatment 0.063 0.0129 0.83 0.063 0.0119 0.83 1.1757 1.0 1255190 IFLab1_001886 O=C(CCc1ccccc1)Nc2nnc(SCC(=O)N3CCCCCC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F17 compound treatment 0.052 0.00187 0.12 0.052 9.38E-4 0.07 0.1316 0.9588 2066529 IFLab1_001887 CSc1nnc(NC(=O)c2ccc(Cl)cc2Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F18 compound treatment 0.773 0.723 46.53 0.691 0.64 44.71 64.512 0.9998 1145823 IFLab1_001888 COCC(C)Nc1ncnc2n(cc(c3ccccc3)c12)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F19 compound treatment 0.234 0.184 11.84 0.226 0.175 12.22 17.0103 0.9999 1571608 IFLab1_001889 CC(C)Nc1ncnc2n(ncc12)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F20 compound treatment 0.143 0.0929 5.98 0.126 0.0749 5.24 7.9288 0.9978 2066530 IFLab1_001890 CCOC(=O)c1sc2nc(NC(=O)C)sc2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F21 compound treatment 0.051 8.75E-4 0.06 0.06 0.00894 0.62 0.4813 0.7678 1229721 IFLab1_001891 Cc1ccc(c(C)c1)n2ncc3c(NCC4CCCO4)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F22 compound treatment 0.04 -0.0101 -0.65 0.04 -0.0111 -0.77 -1.0073 -0.9964 1390189 IFLab1_001892 Clc1ccc2nc(NC(=O)C3COc4ccccc4O3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F23 mock treatment 0.053 0.00288 0.19 0.048 -0.00306 -0.21 -0.0204 -0.0722 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 F24 mock treatment 0.05 -1.25E-4 -0.01 0.049 -0.00206 -0.14 -0.1076 -0.7454 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G01 compound treatment 0.072 0.0219 1.41 0.073 0.0219 1.53 2.0793 0.9991 2066531 IFLab1_001893 Cc1ccc(o1)C2CC(=O)NC(=C2C#N)SCC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G02 compound treatment 0.054 0.00388 0.25 0.062 0.0109 0.76 0.7167 0.8916 1540328 IFLab1_001894 Cc1ccc(cc1)c2nnc(NC(=O)C3CC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G03 compound treatment 0.053 0.00288 0.19 0.058 0.00694 0.48 0.4736 0.9128 1229379 IFLab1_001895 CCSC1=C(C#N)C(CC(=O)N1)c2cccc(Cl)c2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G04 compound treatment 0.079 0.0289 1.86 0.085 0.0339 2.37 2.9906 0.9927 1704234 IFLab1_001896 CCc1nnc(NC(=O)CC2(CC3CC4CC(C3)C2)C4)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G05 compound treatment 0.061 0.0109 0.7 0.068 0.0169 1.18 1.3316 0.9686 1412010 IFLab1_001897 Cc1ccccc1C2C(C#N)C(=O)NC(=C2C#N)SCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G06 compound treatment 0.056 0.00588 0.38 0.069 0.0179 1.25 1.1535 0.8812 2066532 IFLab1_001898 NC(=O)CSc1nc(N)c(C#N)c(c1C#N)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G07 compound treatment 0.052 0.00187 0.12 0.055 0.00394 0.28 0.2798 0.9316 1738994 IFLab1_001899 CCC(=O)Nc1c(c2ccccc2)c3cc(Br)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G08 compound treatment 0.071 0.0209 1.34 0.074 0.0229 1.6 2.0832 0.9962 1544297 IFLab1_001900 CC(C)(C)C(=O)Nc1ccc(c2nc3ccccc3s2)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G09 compound treatment 0.055 0.00488 0.31 0.054 0.00294 0.21 0.367 0.9788 1192710 IFLab1_001901 CCOc1ccc(cc1)S(=O)(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G10 compound treatment 0.054 0.00388 0.25 0.051 -6.25E-5 0.0 0.1733 0.6946 2066533 IFLab1_001902 CCCc1nc2ccccc2n1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G11 compound treatment 0.054 0.00388 0.25 0.055 0.00394 0.28 0.3709 0.9988 1393173 IFLab1_001903 CS(=O)(=O)c1ccc2nc(NC(=O)CCSc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G12 compound treatment 0.051 8.75E-4 0.06 0.054 0.00294 0.21 0.1849 0.869 2066534 IFLab1_001904 CCOC(=O)C(C)Sc1nnc(NC(=O)c2cc(Br)ccc2Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G13 compound treatment 0.073 0.0229 1.47 0.086 0.0349 2.44 2.767 0.9707 2066535 IFLab1_001905 O=C(Nc1nc(cs1)c2ccc(C#N)cc2)/C=C/c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G14 compound treatment 0.052 0.00187 0.12 0.059 0.00794 0.55 0.4774 0.8413 2066536 IFLab1_001906 CC(C)Sc1nnc(NC(=O)c2ccccc2C(F)(F)F)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G15 compound treatment 0.054 0.00388 0.25 0.058 0.00694 0.48 0.5191 0.9523 1134081 IFLab1_001907 Cc1cc(C)c2nc(NC(=O)CN3C(=O)CCC3=O)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G16 compound treatment 0.051 8.75E-4 0.06 0.054 0.00294 0.21 0.1849 0.869 2066537 IFLab1_001908 Oc1c(/C=N/c2ncccn2)c(=O)oc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G17 compound treatment 0.049 -0.00112 -0.07 0.052 9.38E-4 0.07 -0.0049 -0.0501 1344110 IFLab1_001909 O=C(CN1C(=O)CCC1=O)Nc2sc3CCCc3c2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G18 compound treatment 0.065 0.0149 0.96 0.066 0.0149 1.04 1.4149 0.9991 1590099 IFLab1_001910 Clc1ccc(OC(=O)c2cccs2)c3ncccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G19 compound treatment 0.05 -1.25E-4 -0.01 0.05 -0.00106 -0.07 -0.0582 -0.7792 1236688 IFLab1_001911 CN(C)c1ccc(cc1)C(=O)N=c2sc3cc(Cl)ccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G20 compound treatment 0.05 -1.25E-4 -0.01 0.054 0.00294 0.21 0.1394 0.6789 1116313 IFLab1_001912 OC(=O)Cn1c(=S)sc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G21 compound treatment 0.049 -0.00112 -0.07 0.052 9.38E-4 0.07 -0.0049 -0.0501 2066538 IFLab1_001913 Cn1ncc(I)c1C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G22 compound treatment 0.052 0.00187 0.12 0.06 0.00894 0.62 0.5268 0.8284 1593262 IFLab1_001914 COC(=O)c1ccc(cc1)C(=O)Nc2cccc3c(OC)cccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G23 mock treatment 0.047 -0.00313 -0.2 0.049 -0.00206 -0.14 -0.2441 -0.9866 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 G24 mock treatment 0.05 -1.25E-4 -0.01 0.051 -6.25E-5 0.0 -0.0088 -0.9588 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H01 compound treatment 0.081 0.0309 1.99 0.097 0.0459 3.21 3.6744 0.9734 1539174 IFLab1_001915 CC(C)OP(=O)(C(Nc1ccccc1)c2ccccc2)c3ccc(cc3)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H02 compound treatment 0.089 0.0389 2.5 0.096 0.0449 3.14 3.9892 0.9937 1420157 IFLab1_001916 CCN(CC)c1ncnc2n(ncc12)c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H03 compound treatment 0.05 -1.25E-4 -0.01 0.058 0.00694 0.48 0.337 0.6953 1689697 IFLab1_001917 COc1ccccc1NC2(CCCCC2)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H04 compound treatment 0.057 0.00688 0.44 0.058 0.00694 0.48 0.6556 0.999 1124205 IFLab1_001918 CCC(CO)Nc1ncnc2n(ncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H05 compound treatment 0.052 0.00187 0.12 0.06 0.00894 0.62 0.5268 0.8284 2066539 IFLab1_001919 CCOc1ccc(Cc2nnc(SCC(=O)c3ccc(Cl)cc3)o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H06 compound treatment 0.049 -0.00112 -0.07 0.058 0.00694 0.48 0.2915 0.5949 1562161 IFLab1_001920 CCN(CC)CCNc1ncnc2n(ncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H07 compound treatment 0.056 0.00588 0.38 0.053 0.00194 0.14 0.3631 0.904 2066540 IFLab1_001921 CCCn1c[n+](CC(=O)C(C)(C)C)c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H08 compound treatment 0.053 0.00288 0.19 0.054 0.00294 0.21 0.276 0.9987 1470976 IFLab1_001922 COC(=O)c1c(NC(=O)c2ccc(OC)cc2)sc3CN(CCc13)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H09 compound treatment 0.056 0.00588 0.38 0.06 0.00894 0.62 0.7089 0.9711 1452917 IFLab1_001923 COC(=O)C1=C(C)Nc2ncnn2C1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H10 compound treatment 0.085 0.0349 2.24 0.089 0.0379 2.65 3.4613 0.9966 1684580 IFLab1_001924 CC(=O)Nc1sc(Cc2ccc3OCOc3c2)c(C)c1C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H11 compound treatment 0.053 0.00288 0.19 0.057 0.00594 0.41 0.4242 0.9338 1611826 IFLab1_001925 CCSc1nnc(CNC(=O)c2ccccc2)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H12 compound treatment 0.056 0.00588 0.38 0.063 0.0119 0.83 0.8571 0.936 1342725 IFLab1_001926 CCCCn1c(CNC(=O)c2ccc(OC)cc2)nnc1SC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H13 compound treatment 0.073 0.0229 1.47 0.066 0.0149 1.04 1.779 0.9858 2066541 IFLab1_001927 CSc1nnc(NC(=O)C(C)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H14 compound treatment 0.058 0.00788 0.51 0.068 0.0169 1.18 1.1951 0.9284 1318892 IFLab1_001928 COC(=O)C1=C(CCS1)NC(=O)c2ccc3OCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H15 compound treatment 0.121 0.0709 4.56 0.142 0.0909 6.35 7.7179 0.9868 1714879 IFLab1_001929 Clc1ccccc1C(=O)Nc2nnc(SCc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H16 compound treatment 0.068 0.0179 1.15 0.063 0.0119 0.83 1.4032 0.9875 2066542 IFLab1_001930 O=C(CSCc1ccccc1)Nc2nnc(SCC(=O)N3CCCCCC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H17 compound treatment 0.056 0.00588 0.38 0.06 0.00894 0.62 0.7089 0.9711 1321105 IFLab1_001931 Fc1cccc(Cl)c1C(=O)Nc2nnc(SCC(=O)N3CCCc4ccccc34)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H18 compound treatment 0.063 0.0129 0.83 0.064 0.0129 0.9 1.2251 0.9991 1246268 IFLab1_001932 CC(O)CNc1ncnc2n(cc(c3ccccc3)c12)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H19 compound treatment 0.231 0.181 11.64 0.241 0.19 13.27 17.6147 0.9979 1334198 IFLab1_001933 Cc1cccc(c1)n2ncc3c(NC(C)(C)C)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H20 compound treatment 0.054 0.00388 0.25 0.053 0.00194 0.14 0.2721 0.9588 2066543 IFLab1_001934 CCOC(=O)c1sc(NC(=O)c2ccccc2)c(SC#N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H21 compound treatment 0.089 0.0389 2.5 0.081 0.0299 2.09 3.2482 0.996 1526571 IFLab1_001935 Clc1ccc(cc1)n2ncc3c(Nc4ccccc4)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H22 compound treatment 0.576 0.526 33.85 0.479 0.428 29.9 45.0735 0.9981 1622380 IFLab1_001936 CSc1nc2ccc(NC(=O)C3COc4ccccc4O3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H23 mock treatment 0.05 -1.25E-4 -0.01 0.051 -6.25E-5 0.0 -0.0088 -0.9588 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 H24 mock treatment 0.048 -0.00213 -0.14 0.052 9.38E-4 0.07 -0.0504 -0.3324 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I01 compound treatment 0.063 0.0129 0.83 0.068 0.0169 1.18 1.4227 0.9848 1433444 IFLab1_001937 COC(=O)C1C(C(=C(NC1=O)SC)C#N)c2ccccc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I02 compound treatment 0.058 0.00788 0.51 0.064 0.0129 0.9 0.9975 0.9626 1268390 IFLab1_001938 Brc1ccc(cc1)c2nnc(NC(=O)C3CC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I03 compound treatment 0.059 0.00887 0.57 0.096 0.0449 3.14 2.6238 0.8223 2066544 IFLab1_001939 CCOc1ccc(cc1)C2[C@H](C(=O)OC)C(=O)NC(=C2C#N)SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I04 compound treatment 0.065 0.0149 0.96 0.069 0.0179 1.25 1.5631 0.9912 2066545 IFLab1_001940 CCSc1nnc(NC(=O)c2c(C)onc2c3ccccc3Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I05 compound treatment 0.056 0.00588 0.38 0.058 0.00694 0.48 0.6101 0.9925 1351574 IFLab1_001941 CCSC1=C(C#N)C(C(C#N)C(=O)N1)c2ccccc2OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I06 compound treatment 0.131 0.0809 5.21 0.147 0.0959 6.7 8.42 0.9922 1251069 IFLab1_001942 CCOC(=O)c1sc2nc(N)c(C#N)c(c3ccc(Cl)cc3)c2c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I07 compound treatment 0.061 0.0109 0.7 0.057 0.00594 0.41 0.7883 0.9688 1655783 IFLab1_001943 OCC(=O)Nc1c(c2ccccc2)c3cc(Br)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I08 compound treatment 0.058 0.00788 0.51 0.06 0.00894 0.62 0.7999 0.9946 1662562 IFLab1_001944 CSc1nc2ccc(NC(=O)c3cc(=O)c4ccccc4o3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I09 compound treatment 0.467 0.417 26.83 0.517 0.466 32.55 41.9897 0.9954 2066546 IFLab1_001945 COC(=O)c1cccc2c(Br)ccc(C(=O)OC)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I10 compound treatment 0.055 0.00488 0.31 0.052 9.38E-4 0.07 0.2682 0.8367 2066547 IFLab1_001946 CCCc1nc2ccccc2n1C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I11 compound treatment 0.073 0.0229 1.47 0.1 0.0489 3.42 3.4585 0.9291 1244189 IFLab1_001947 O=C(CCc1ccccc1)Nc2nc(cs2)c3ccc(C#N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I12 compound treatment 0.056 0.00588 0.38 0.06 0.00894 0.62 0.7089 0.9711 1421279 IFLab1_001948 CCOC(=O)C(C)Sc1nnc(NC(=O)C2CC2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I13 compound treatment 0.051 8.75E-4 0.06 0.051 -6.25E-5 0.0 0.0367 0.6503 2066548 IFLab1_001949 O=C(Nc1ccc2OCOc2c1)/C=C/c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I14 compound treatment 0.049 -0.00112 -0.07 0.051 -6.25E-5 0.0 -0.0543 -0.7484 1169448 IFLab1_001950 CC(C)Sc1nnc(NC(=O)c2cc(Br)ccc2Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I15 compound treatment 0.055 0.00488 0.31 0.062 0.0109 0.76 0.7622 0.9227 1321566 IFLab1_001951 O=C(CN1C(=O)CCC1=O)Nc2nc(cs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I16 compound treatment 0.054 0.00388 0.25 0.053 0.00194 0.14 0.2721 0.9588 2066549 IFLab1_001952 Cc1cc(C)nc(N/C=C/2\C(=O)Oc3ccccc3C2=O)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I17 compound treatment 0.052 0.00187 0.12 0.05 -0.00106 -0.07 0.0329 0.2319 1599758 IFLab1_001953 Brc1ccc(NC(=O)CN2C(=O)CCC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I18 compound treatment 0.064 0.0139 0.89 0.063 0.0119 0.83 1.2212 0.9994 1699779 IFLab1_001954 c1coc(c1)c2ncc3ccccn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I19 compound treatment 0.059 0.00887 0.57 0.059 0.00794 0.55 0.796 0.9999 2066550 IFLab1_001955 Cn1c(=NC(=O)/C=C/c2cccs2)sc3cc(Cl)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I20 compound treatment 0.058 0.00788 0.51 0.065 0.0139 0.97 1.0469 0.9537 2066551 IFLab1_001956 CN1/C(=C\C=C2C(=O)CC(C)(C)CC2=O)/C(C)(C)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I21 compound treatment 0.056 0.00588 0.38 0.059 0.00794 0.55 0.6595 0.9826 1385511 IFLab1_001957 CCOc1ccc(NC(=O)c2ccccc2NC(=O)c3cccnc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I22 compound treatment 0.056 0.00588 0.38 0.058 0.00694 0.48 0.6101 0.9925 1606202 IFLab1_001958 COC(=O)c1ccc(cc1)C(=O)Nc2cc(C)on2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I23 mock treatment 0.05 -1.25E-4 -0.01 0.05 -0.00106 -0.07 -0.0582 -0.7792 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 I24 mock treatment 0.05 -1.25E-4 -0.01 0.05 -0.00106 -0.07 -0.0582 -0.7792 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J01 compound treatment 0.058 0.00788 0.51 0.061 0.00994 0.69 0.8493 0.9881 2066552 IFLab1_001959 Fc1ccc(/C=N/n2cnnc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J02 compound treatment 0.102 0.0519 3.34 0.1 0.0489 3.42 4.7784 0.9999 1435936 IFLab1_001960 CCN(CC)c1ncnc2n(ncc12)c3cccc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J03 compound treatment 0.051 8.75E-4 0.06 0.056 0.00494 0.34 0.2837 0.8118 1540841 IFLab1_001961 COc1ccc(NC2(CCCCC2)C#N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J04 compound treatment 0.081 0.0309 1.99 0.089 0.0379 2.65 3.2793 0.9899 1429199 IFLab1_001962 COc1cccc(Nc2ncnc3n(ncc23)c4ccccc4)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J05 compound treatment 0.051 8.75E-4 0.06 0.058 0.00694 0.48 0.3825 0.784 2066553 IFLab1_001963 C/N=C(/O)\n1c(nc2ccccc12)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J06 compound treatment 0.602 0.552 35.52 0.48 0.429 29.97 46.3062 0.9964 1688897 IFLab1_001964 CCN(c1ccccc1)c2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J07 compound treatment 0.061 0.0109 0.7 0.062 0.0109 0.76 1.0352 0.999 2066554 IFLab1_001965 CSc1ccc(cc1)c2cn3ccsc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J08 compound treatment 0.048 -0.00213 -0.14 0.046 -0.00506 -0.35 -0.3468 -0.9146 2066555 IFLab1_001966 CC(C)N1CCc2c(C#N)c(NC(=O)CCc3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J09 compound treatment 0.054 0.00388 0.25 0.054 0.00294 0.21 0.3215 0.9953 1694650 IFLab1_001967 CC1=C(C(c2ccccc2Cl)n3ncnc3N1)C(=O)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J10 compound treatment 0.061 0.0109 0.7 0.059 0.00794 0.55 0.8871 0.9933 2066556 IFLab1_001968 COc1ccc(cc1)C(=O)NCc2nnc(SC(C)C)n2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J11 compound treatment 0.056 0.00588 0.38 0.059 0.00794 0.55 0.6595 0.9826 2066557 IFLab1_001969 O=C(CSc1nnc(CNC(=O)c2ccccc2)n1c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J12 compound treatment 0.054 0.00388 0.25 0.058 0.00694 0.48 0.5191 0.9523 2066558 IFLab1_001970 CCCSc1nnc(CNC(=O)C2(CC3CC4CC(C3)C2)C4)n1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J13 compound treatment 0.089 0.0389 2.5 0.086 0.0349 2.44 3.4952 0.9999 2066559 IFLab1_001971 CC(C)Sc1nnc(NC(=O)C(C)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J14 compound treatment 0.081 0.0309 1.99 0.087 0.0359 2.51 3.1805 0.9933 1599393 IFLab1_001972 COC(=O)C1=C(CCS1)NC(=O)CSCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J15 compound treatment 0.051 8.75E-4 0.06 0.053 0.00194 0.14 0.1355 0.9245 1542441 IFLab1_001973 CCCSc1nnc(NC(=O)c2ccccc2Br)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J16 compound treatment 0.054 0.00388 0.25 0.058 0.00694 0.48 0.5191 0.9523 1319496 IFLab1_001974 COc1ccc(CC(=O)Nc2nnc(SCc3ccccc3)s2)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J17 compound treatment 0.055 0.00488 0.31 0.058 0.00694 0.48 0.5646 0.9779 2066560 IFLab1_001975 CSc1nnc(NC(=O)c2ccco2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J18 compound treatment 0.052 0.00187 0.12 0.051 -6.25E-5 0.0 0.0822 0.6811 2066561 IFLab1_001976 CN(C)CCCNc1ncnc2n(cc(c3ccccc3)c12)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J19 compound treatment 0.07 0.0199 1.28 0.074 0.0229 1.6 2.0376 0.9938 1338944 IFLab1_001977 C=CCNc1ncnc2n(ncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J20 compound treatment 0.053 0.00288 0.19 0.051 -6.25E-5 0.0 0.1278 0.6902 2066562 IFLab1_001978 COc1cc(OC)cc(c1)C(=O)N=c2sc3cc(C)cc(C)c3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J21 compound treatment 1.002 0.952 61.27 0.973 0.922 64.41 88.8648 0.9997 1289588 IFLab1_001979 Cc1ccccc1Nc2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J22 compound treatment 0.512 0.462 29.73 0.521 0.47 32.83 44.2354 0.9988 1443554 IFLab1_001980 Cc1nc2cc(NC(=O)C3COc4ccccc4O3)ccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J23 mock treatment 0.053 0.00288 0.19 0.051 -6.25E-5 0.0 0.1278 0.6902 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 J24 mock treatment 0.05 -1.25E-4 -0.01 0.051 -6.25E-5 0.0 -0.0088 -0.9588 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K01 compound treatment 0.064 0.0139 0.89 0.066 0.0149 1.04 1.3694 0.997 2066563 IFLab1_001981 CC(=C)CSC1=C(C#N)C(CC(=O)N1)c2sccc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K02 compound treatment 0.059 0.00887 0.57 0.057 0.00594 0.41 0.6972 0.9876 1162356 IFLab1_001982 COc1ccc(Cl)cc1C(=O)Nc2nnc(s2)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K03 compound treatment 0.058 0.00788 0.51 0.057 0.00594 0.41 0.6517 0.995 2066564 IFLab1_001983 NC(=O)CSC1=C(C#N)C(C(C(=O)c2cccs2)C(O)(N1)C(F)(F)F)c3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K04 compound treatment 0.05 -1.25E-4 -0.01 0.053 0.00194 0.14 0.09 0.6639 1620885 IFLab1_001984 CCSc1nnc(NC(=O)c2ccc3ccccc3c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K05 compound treatment 0.057 0.00688 0.44 0.062 0.0109 0.76 0.8532 0.9663 1713691 IFLab1_001985 CCOc1ccccc1C2C(C#N)C(=O)NC(=C2C#N)SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K06 compound treatment 0.382 0.332 21.36 0.4 0.349 24.38 32.3415 0.9978 2066565 IFLab1_001986 COC(=O)c1sc2nc(N)c(C#N)c(c3ccc(Cl)cc3)c2c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K07 compound treatment 0.059 0.00887 0.57 0.058 0.00694 0.48 0.7466 0.9967 1417357 IFLab1_001987 Brc1ccc2[nH]c(=O)c(N3CCCCC3)c(c4ccccc4)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K08 compound treatment 0.05 -1.25E-4 -0.01 0.048 -0.00306 -0.21 -0.157 -0.7332 1512636 IFLab1_001988 Cn1c(=NC(=O)c2cc(=O)c3ccccc3o2)sc4cc(Br)ccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K09 compound treatment 0.058 0.00788 0.51 0.054 0.00294 0.21 0.5035 0.9208 1160121 IFLab1_001989 CCOc1nc(c(Cl)s1)S(=O)(=O)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K10 compound treatment 0.053 0.00288 0.19 0.05 -0.00106 -0.07 0.0784 0.393 1145304 IFLab1_001990 CCCc1nc2ccccc2n1CC(=O)N(C(C)C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K11 compound treatment 0.059 0.00887 0.57 0.061 0.00994 0.69 0.8948 0.9953 1666697 IFLab1_001991 CC(=O)Nc1ccc2nc(NC(=O)CCc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K12 compound treatment 0.195 0.145 9.32 0.199 0.148 10.33 13.9016 0.9987 1298019 IFLab1_001992 COc1ccc(Cl)cc1C(=O)Nc2nnc(SCC(=O)c3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K13 compound treatment 0.058 0.00788 0.51 0.058 0.00694 0.48 0.7011 0.9997 2066566 IFLab1_001993 O=C(Nc1sc2CCCCc2c1C#N)/C=C/c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K14 compound treatment 0.049 -0.00112 -0.07 0.051 -6.25E-5 0.0 -0.0543 -0.7484 1171242 IFLab1_001994 COc1cccc(OC)c1C(=O)Nc2nnc(SC)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K15 compound treatment 0.048 -0.00213 -0.14 0.051 -6.25E-5 0.0 -0.0998 -0.7293 1413908 IFLab1_001995 Cc1ccc2n(C)c(=NC(=O)CN3C(=O)CCC3=O)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K16 compound treatment 0.05 -1.25E-4 -0.01 0.05 -0.00106 -0.07 -0.0582 -0.7792 2066567 IFLab1_001996 FC(F)(F)c1cccc(N/C=C/2\C(=O)Oc3ccccc3C2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K17 compound treatment 0.052 0.00187 0.12 0.052 9.38E-4 0.07 0.1316 0.9588 1284270 IFLab1_001997 O=S(=O)(N1CCN(Cc2ccccc2)CC1)c3cccc4cccnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K18 compound treatment 0.039 -0.0111 -0.72 0.039 -0.0121 -0.84 -1.1022 -0.9967 1654918 IFLab1_001998 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(N2CCN(CCO)CC2)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K19 compound treatment 0.062 0.0119 0.76 0.058 0.00694 0.48 0.8832 0.9758 1139214 IFLab1_001999 Cc1cccc(NC(=O)CCSc2ccccc2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K20 compound treatment 0.046 -0.00413 -0.27 0.048 -0.00306 -0.21 -0.339 -0.9943 1057475 IFLab1_002000 OCc1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K21 compound treatment 0.047 -0.00313 -0.2 0.048 -0.00306 -0.21 -0.2935 -0.9995 2066568 IFLab1_002001 Clc1cccc(/C=C/C(=O)Nc2cc3ccccc3oc2=O)c1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K22 compound treatment 0.046 -0.00413 -0.27 0.048 -0.00306 -0.21 -0.339 -0.9943 2066569 IFLab1_002002 COC(=O)c1ccc(cc1)C(=O)/C(=C\2/Nc3ccccc3S2)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K23 mock treatment 0.048 -0.00213 -0.14 0.049 -0.00206 -0.14 -0.1986 -0.9997 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 K24 mock treatment 0.055 0.00488 0.31 0.048 -0.00306 -0.21 0.0706 0.1859 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L01 compound treatment 0.062 0.0119 0.76 0.062 0.0109 0.76 1.0808 1.0 2066570 IFLab1_002003 CS(=O)(=O)c1ccc(/C=C/c2ccc(Cl)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L02 compound treatment 0.054 0.00388 0.25 0.057 0.00594 0.41 0.4697 0.9704 1639021 IFLab1_002004 CCN(CC)c1ncnc2n(ncc12)c3ccc(C)cc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L03 compound treatment 0.044 -0.00613 -0.39 0.045 -0.00606 -0.42 -0.5782 -0.9994 1273051 IFLab1_002005 O=C(N1CCN(CC1)C(C#N)c2ccco2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L04 compound treatment 0.059 0.00887 0.57 0.061 0.00994 0.69 0.8948 0.9953 1323830 IFLab1_002006 COc1ccc(CNc2ncnc3n(ncc23)c4ccccc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L05 compound treatment 0.087 0.0369 2.37 0.094 0.0429 3.0 3.7993 0.9933 2066571 IFLab1_002007 COc1ccccc1/C=C/2\C(=Nc3ccccc23)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L06 compound treatment 0.083 0.0329 2.12 0.094 0.0429 3.0 3.6173 0.9854 1719787 IFLab1_002008 CC1CC(C)CN(C1)c2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L07 compound treatment 0.078 0.0279 1.79 0.091 0.0399 2.79 3.2415 0.9772 1432193 IFLab1_002009 COC(=O)Nc1ccc(SCC(=O)N(C(C)C)c2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L08 compound treatment 0.048 -0.00213 -0.14 0.052 9.38E-4 0.07 -0.0504 -0.3324 2066572 IFLab1_002010 CC(C)(C)C(=O)Nc1sc2CN(Cc3ccccc3)CCc2c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L09 compound treatment 0.048 -0.00213 -0.14 0.051 -6.25E-5 0.0 -0.0998 -0.7293 1183269 IFLab1_002011 Fc1ccc(cc1)C(CC(=O)c2ccncc2)SCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L10 compound treatment 0.053 0.00288 0.19 0.055 0.00394 0.28 0.3254 0.9814 1561883 IFLab1_002012 COc1ccc(cc1)C(=O)NCc2nnc(SC)n2Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L11 compound treatment 0.054 0.00388 0.25 0.058 0.00694 0.48 0.5191 0.9523 1657887 IFLab1_002013 CCCSc1nnc(CNC(=O)c2cccc(F)c2)n1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L12 compound treatment 0.053 0.00288 0.19 0.058 0.00694 0.48 0.4736 0.9128 1537959 IFLab1_002014 COc1ccc(cc1)n2nc3CSCc3c2NC(=O)CCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L13 compound treatment 0.062 0.0119 0.76 0.055 0.00394 0.28 0.735 0.9048 1615904 IFLab1_002015 CCC(CC)C(=O)Nc1nnc(SCC(=O)Nc2ccc(F)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L14 compound treatment 0.055 0.00488 0.31 0.055 0.00394 0.28 0.4164 0.9978 1717888 IFLab1_002016 COC(=O)C1=C(CCS1)NC(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L15 compound treatment 0.048 -0.00213 -0.14 0.051 -6.25E-5 0.0 -0.0998 -0.7293 1193481 IFLab1_002017 Cc1ccc(cc1)C(=O)Nc2nnc(SCc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L16 compound treatment 0.052 0.00187 0.12 0.054 0.00294 0.21 0.2304 0.968 2066573 IFLab1_002018 O=C(CSCc1ccccc1)Nc2nnc(SCc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L17 compound treatment 0.051 8.75E-4 0.06 0.05 -0.00106 -0.07 -0.0127 -0.1359 2066574 IFLab1_002019 O=C(Nc1nnc(SCc2ccccc2)s1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L18 compound treatment 0.045 -0.00513 -0.33 0.047 -0.00406 -0.28 -0.4339 -0.9972 1714750 IFLab1_002020 CC(C)C(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCC2c3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L19 compound treatment 0.06 0.00987 0.64 0.067 0.0159 1.11 1.2367 0.9647 1345426 IFLab1_002021 C(Nc1ncnc2n(ncc12)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L20 compound treatment 0.045 -0.00513 -0.33 0.048 -0.00306 -0.21 -0.3845 -0.978 1270721 IFLab1_002022 O=C(N1CCN(CC1)c2nc3ccccc3s2)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L21 compound treatment 0.07 0.0199 1.28 0.077 0.0259 1.81 2.1858 0.9855 1319044 IFLab1_002023 Cc1cccc(Nc2ncnc3n(ncc23)c4ccccc4)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L22 compound treatment 0.059 0.00887 0.57 0.058 0.00694 0.48 0.7466 0.9967 1250717 IFLab1_002024 COc1ccc(cc1)c2csc(NC(=O)C3COc4ccccc4O3)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L23 mock treatment 0.051 8.75E-4 0.06 0.053 0.00194 0.14 0.1355 0.9245 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 L24 mock treatment 0.048 -0.00213 -0.14 0.051 -6.25E-5 0.0 -0.0998 -0.7293 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M01 compound treatment 0.072 0.0219 1.41 0.073 0.0219 1.53 2.0793 0.9991 2066575 IFLab1_002025 Cc1ccsc1C2CC(=O)NC(=C2C#N)SCC(=O)OCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M02 compound treatment 0.055 0.00488 0.31 0.054 0.00294 0.21 0.367 0.9788 1521578 IFLab1_002026 Clc1ccccc1c2nnc(NC(=O)C3CC3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M03 compound treatment 0.055 0.00488 0.31 0.074 0.0229 1.6 1.355 0.8298 2066576 IFLab1_002027 CSC1=C(C#N)C(C(C(=O)c2cccs2)C(O)(N1)C(F)(F)F)c3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M04 compound treatment 0.054 0.00388 0.25 0.057 0.00594 0.41 0.4697 0.9704 1717378 IFLab1_002028 CCSc1nnc(NC(=O)CC2(CC3CC4CC(C3)C2)C4)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M05 compound treatment 0.062 0.0119 0.76 0.061 0.00994 0.69 1.0314 0.9988 1367096 IFLab1_002029 CCOc1ccccc1C2C(C#N)C(=O)NC(=C2C#N)SCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M06 compound treatment 0.087 0.0369 2.37 0.091 0.0399 2.79 3.6511 0.9968 2066577 IFLab1_002030 Cc1ccc(cc1)c2c(C#N)c(N)nc(SCC=C)c2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M07 compound treatment 0.052 0.00187 0.12 0.054 0.00294 0.21 0.2304 0.968 1203190 IFLab1_002031 Cc1ccc2[nH]c(=O)c(N3CCCCC3)c(c4ccccc4)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M08 compound treatment 0.065 0.0149 0.96 0.071 0.0199 1.39 1.6619 0.9833 1351022 IFLab1_002032 CCOc1ccc2nc(NC(=O)CCc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M09 compound treatment 0.057 0.00688 0.44 0.053 0.00194 0.14 0.4086 0.883 1401467 IFLab1_002033 CC(=O)Nc1nc2sc(C)c(C)c2c(=O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M10 compound treatment 0.051 8.75E-4 0.06 0.051 -6.25E-5 0.0 0.0367 0.6503 1648432 IFLab1_002034 CCc1nc2ccccc2n1CC(=O)N(C(C)C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M11 compound treatment 0.05 -1.25E-4 -0.01 0.055 0.00394 0.28 0.1888 0.6861 1605456 IFLab1_002035 CCc1ccccc1NC(=O)c2ccc(cc2)S(=O)(=O)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M12 compound treatment 0.058 0.00788 0.51 0.057 0.00594 0.41 0.6517 0.995 1283829 IFLab1_002036 COc1ccc(CC(=O)Nc2nnc(SCC(=O)c3ccccc3)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M13 compound treatment 0.056 0.00588 0.38 0.054 0.00294 0.21 0.4125 0.9588 2066578 IFLab1_002037 O=C(Nc1sc2CCCc2c1C#N)/C=C/c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M14 compound treatment 0.053 0.00288 0.19 0.051 -6.25E-5 0.0 0.1278 0.6902 1024180 IFLab1_002038 OC(c1ccccc1)c2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M15 compound treatment 0.052 0.00187 0.12 0.057 0.00594 0.41 0.3786 0.8765 1472063 IFLab1_002039 Clc1ccc(NC(=O)CN2C(=O)CCC2=O)c(c1)C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M16 compound treatment 0.054 0.00388 0.25 0.057 0.00594 0.41 0.4697 0.9704 1534214 IFLab1_002040 Fc1ccc(cc1)C(=O)Oc2ccc(Cl)c3cccnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M17 compound treatment 0.042 -0.00813 -0.52 0.044 -0.00706 -0.49 -0.7187 -0.9996 2066579 IFLab1_002041 Brc1ccc(s1)C(=O)Nc2nc(cs2)c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M18 compound treatment 0.047 -0.00313 -0.2 0.051 -6.25E-5 0.0 -0.1453 -0.7223 1235906 IFLab1_002042 OCc1cc(=O)c(O)c(o1)C(Nc2ccccn2)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M19 compound treatment 0.048 -0.00213 -0.14 0.049 -0.00206 -0.14 -0.1986 -0.9997 2066580 IFLab1_002043 O=C(COC(=O)/C=C/c1cccs1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M20 compound treatment 0.048 -0.00213 -0.14 0.052 9.38E-4 0.07 -0.0504 -0.3324 1141707 IFLab1_002044 CC(C)Oc1ccc(cc1)C(=O)N=c2sc3cc(Cl)ccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M21 compound treatment 0.049 -0.00112 -0.07 0.049 -0.00206 -0.14 -0.1531 -0.9493 2066581 IFLab1_002045 Cc1cc(nn1CC(=O)N)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M22 compound treatment 0.051 8.75E-4 0.06 0.054 0.00294 0.21 0.1849 0.869 1118672 IFLab1_002046 COC(=O)c1ccc(cc1)C(=O)Nc2ccc3n(c(C)nc3c2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M23 mock treatment 0.048 -0.00213 -0.14 0.049 -0.00206 -0.14 -0.1986 -0.9997 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 M24 mock treatment 0.048 -0.00213 -0.14 0.049 -0.00206 -0.14 -0.1986 -0.9997 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N01 compound treatment 0.062 0.0119 0.76 0.061 0.00994 0.69 1.0314 0.9988 1367393 IFLab1_002047 CC(=C1C(=O)c2ccccc2C1=O)NCc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N02 compound treatment 0.104 0.0539 3.47 0.135 0.0839 5.86 6.5984 0.9686 1346381 IFLab1_002048 CCCN(CCC)c1ncnc2n(ncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N03 compound treatment 0.048 -0.00213 -0.14 0.055 0.00394 0.28 0.0978 0.3183 1741714 IFLab1_002049 N#CC1(CCCCC1)NCCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N04 compound treatment 0.474 0.424 27.28 0.515 0.464 32.41 42.2095 0.9963 1291416 IFLab1_002050 COc1ccccc1CNc2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N05 compound treatment 0.054 0.00388 0.25 0.062 0.0109 0.76 0.7167 0.8916 2066582 IFLab1_002051 O/C(=C/Sc1nnc(Cc2ccccc2)o1)/c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N06 compound treatment 0.168 0.118 7.59 0.151 0.0999 6.98 10.3016 0.9991 1426062 IFLab1_002052 CC1CN(CC(C)O1)c2ncnc3n(ncc23)c4cccc(C)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N07 compound treatment 0.056 0.00588 0.38 0.062 0.0109 0.76 0.8077 0.9474 2066583 IFLab1_002053 COC(=O)Nc1ccc(SCC(=O)Nc2ccc(C)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N08 compound treatment 0.049 -0.00112 -0.07 0.055 0.00394 0.28 0.1433 0.5038 2066584 IFLab1_002054 CC(C)N1CCc2c(C#N)c(NC(=O)C(C)(C)C)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N09 compound treatment 0.055 0.00488 0.31 0.06 0.00894 0.62 0.6634 0.9493 1195559 IFLab1_002055 Fc1ccc(cc1)C(Nc2ccccn2)c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N10 compound treatment 0.057 0.00688 0.44 0.063 0.0119 0.83 0.9026 0.9561 1426396 IFLab1_002056 COc1ccc(cc1)C(=O)NCc2nnc(SC(C)C)n2Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N11 compound treatment 0.057 0.00688 0.44 0.058 0.00694 0.48 0.6556 0.999 1589739 IFLab1_002057 CCSc1nnc(CNC(=O)c2cccc(OC)c2)n1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N12 compound treatment 0.053 0.00288 0.19 0.054 0.00294 0.21 0.276 0.9987 1323956 IFLab1_002058 COc1ccccc1c2nnc(NC(=O)CSCc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N13 compound treatment 0.135 0.0849 5.46 0.136 0.0849 5.93 8.0587 0.9991 1545951 IFLab1_002059 CC(C)CC(=O)Nc1nnc(SCc2ccccc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N14 compound treatment 0.05 -1.25E-4 -0.01 0.052 9.38E-4 0.07 0.0406 0.6156 2066585 IFLab1_002060 CSc1nnc(NC(=O)/C=C\c2ccc3OCOc3c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N15 compound treatment 0.066 0.0159 1.02 0.067 0.0159 1.11 1.5098 0.9991 2066586 IFLab1_002061 CSc1nnc(NC(=O)c2ccc(F)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N16 compound treatment 0.055 0.00488 0.31 0.055 0.00394 0.28 0.4164 0.9978 2066587 IFLab1_002062 COc1ccc(/C=C/C(=O)Nc2nnc(SCc3ccccc3)s2)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N17 compound treatment 0.071 0.0209 1.34 0.067 0.0159 1.11 1.7374 0.9956 2066588 IFLab1_002063 CSc1nnc(NC(=O)c2cccs2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N18 compound treatment 0.051 8.75E-4 0.06 0.055 0.00394 0.28 0.2343 0.8346 1380308 IFLab1_002064 Cc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N19 compound treatment 0.085 0.0349 2.24 0.086 0.0349 2.44 3.3131 0.9991 1724334 IFLab1_002065 Cc1ccc(c(C)c1)n2ncc3c(NC4CCCCC4)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N20 compound treatment 0.051 8.75E-4 0.06 0.053 0.00194 0.14 0.1355 0.9245 1122906 IFLab1_002066 CCOC(=O)c1sc(NC(=O)COc2ccccc2)c(SC#N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N21 compound treatment 0.059 0.00887 0.57 0.06 0.00894 0.62 0.8454 0.999 1438816 IFLab1_002067 Cc1ccc(Nc2ncnc3n(ncc23)c4ccccc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N22 compound treatment 0.061 0.0109 0.7 0.059 0.00794 0.55 0.8871 0.9933 2066589 IFLab1_002068 O=C(Nc1nc(cs1)c2cccs2)c3ccc4ncsc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N23 mock treatment 0.049 -0.00112 -0.07 0.05 -0.00106 -0.07 -0.1037 -0.9999 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 N24 mock treatment 0.049 -0.00112 -0.07 0.053 0.00194 0.14 0.0445 0.2899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O01 compound treatment 0.06 0.00987 0.64 0.065 0.0139 0.97 1.1379 0.9786 2066590 IFLab1_002069 COC(=O)[C@H]1C(C(=C(NC1=O)SCC=C)C#N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O02 compound treatment 0.063 0.0129 0.83 0.063 0.0119 0.83 1.1757 1.0 1131201 IFLab1_002070 Cc1nnc(NC(=O)c2ccc3ccccc3c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O03 compound treatment 0.056 0.00588 0.38 0.062 0.0109 0.76 0.8077 0.9474 1560450 IFLab1_002071 COC(=O)CSC1=C(C#N)C(C(C#N)C(=O)N1)c2ccccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O04 compound treatment 0.057 0.00688 0.44 0.062 0.0109 0.76 0.8532 0.9663 1630046 IFLab1_002072 CC(C)c1nnc(NC(=O)c2ccc3ccccc3c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O05 compound treatment 0.06 0.00987 0.64 0.063 0.0119 0.83 1.0391 0.991 1660891 IFLab1_002073 COc1ccc(cc1)c2nnc(SCC(=O)O)n2CC(=C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O06 compound treatment 0.061 0.0109 0.7 0.061 0.00994 0.69 0.9858 1.0 2066591 IFLab1_002074 O=C(Nc1nc(cs1)c2ccc3OCOc3c2)/C=C/c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O07 compound treatment 0.053 0.00288 0.19 0.054 0.00294 0.21 0.276 0.9987 1699053 IFLab1_002075 CCN(CC)c1c(c2ccccc2)c3cc(Br)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O08 compound treatment 0.056 0.00588 0.38 0.059 0.00794 0.55 0.6595 0.9826 1606282 IFLab1_002076 Cc1sc2nc(SCC(=O)N3CCCC3)[nH]c(=O)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O09 compound treatment 0.059 0.00887 0.57 0.061 0.00994 0.69 0.8948 0.9953 2066592 IFLab1_002077 C=CCSc1nc2sc3CCCCc3c2c(=O)[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O10 compound treatment 0.05 -1.25E-4 -0.01 0.05 -0.00106 -0.07 -0.0582 -0.7792 2066593 IFLab1_002078 CCc1nc2ccccc2n1CC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O11 compound treatment 0.139 0.0889 5.72 0.173 0.122 8.52 10.0685 0.9812 1127904 IFLab1_002079 CCc1ccccc1NC(=O)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O12 compound treatment 0.064 0.0139 0.89 0.063 0.0119 0.83 1.2212 0.9994 1493243 IFLab1_002080 CCCSc1nnc(NC(=O)Cc2ccc(OC)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O13 compound treatment 0.054 0.00388 0.25 0.056 0.00494 0.34 0.4203 0.9873 1203259 IFLab1_002081 CC1CC(C)CN(C1)S(=O)(=O)c2ccc(cc2)C(=O)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O14 compound treatment 0.051 8.75E-4 0.06 0.057 0.00594 0.41 0.3331 0.7958 1402101 IFLab1_002082 CC(NC(=O)c1ccccc1)C(O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O15 compound treatment 0.052 0.00187 0.12 0.055 0.00394 0.28 0.2798 0.9316 1628010 IFLab1_002083 Cc1ccc(NC(=O)CN2C(=O)CCC2=O)c(c1)C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O16 compound treatment 0.053 0.00288 0.19 0.061 0.00994 0.69 0.6217 0.8654 1495979 IFLab1_002084 COc1ccc(cc1OC)C(=O)Oc2ccc(Cl)c3cccnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O17 compound treatment 0.047 -0.00313 -0.2 0.049 -0.00206 -0.14 -0.2441 -0.9866 1266836 IFLab1_002085 O=C(CCOc1ccccc1)Nc2nc(cs2)c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O18 compound treatment 0.05 -1.25E-4 -0.01 0.053 0.00194 0.14 0.09 0.6639 1915215 IFLab1_002086 CN1/C(=C\C=N\c2cccc(c2)C(=O)O)/C(C)(C)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O19 compound treatment 0.212 0.162 10.42 0.251 0.2 13.97 17.244 0.9896 2066594 IFLab1_002087 O=C(OCc1ccc2OCOc2c1)/C=C/c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O20 compound treatment 0.053 0.00288 0.19 0.053 0.00194 0.14 0.2266 0.9882 1297842 IFLab1_002088 COc1cccc(OC)c1C(=O)N=c2sc3ccccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O21 compound treatment 0.047 -0.00313 -0.2 0.056 0.00494 0.34 0.1017 0.2546 2066595 IFLab1_002089 FC(F)(F)c1cc(nc2cc(nn12)C(=O)NCC#N)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O22 compound treatment 0.062 0.0119 0.76 0.057 0.00594 0.41 0.8338 0.9588 1453344 IFLab1_002090 O=C(CSc1nc2ccccc2s1)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O23 mock treatment 0.048 -0.00213 -0.14 0.051 -6.25E-5 0.0 -0.0998 -0.7293 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 O24 mock treatment 0.051 8.75E-4 0.06 0.053 0.00194 0.14 0.1355 0.9245 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P01 compound treatment 0.059 0.00887 0.57 0.059 0.00794 0.55 0.796 0.9999 2066596 IFLab1_002091 COc1ccc(/C=C/C(=C2C(=O)c3ccccc3C2=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P02 compound treatment 0.061 0.0109 0.7 0.067 0.0159 1.11 1.2822 0.975 1287937 IFLab1_002092 CN(C1CCCCC1)c2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P03 compound treatment 0.056 0.00588 0.38 0.061 0.00994 0.69 0.7583 0.9592 1374478 IFLab1_002093 COc1ccc(cc1)C(C#N)N2CCN(CC2)C(C#N)c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P04 compound treatment 0.059 0.00887 0.57 0.067 0.0159 1.11 1.1912 0.9519 1474382 IFLab1_002094 C(Nc1ncnc2n(ncc12)c3ccccc3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P05 compound treatment 0.073 0.0229 1.47 0.08 0.0289 2.02 2.4706 0.9879 2066597 IFLab1_002095 CCOc1ccc(/C=C\2/C(=Nc3ccccc23)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P06 compound treatment 0.177 0.127 8.17 0.201 0.15 10.47 13.1811 0.9924 1265467 IFLab1_002096 Cc1ccc(c(C)c1)n2ncc3c(NCc4cccs4)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P07 compound treatment 0.062 0.0119 0.76 0.06 0.00894 0.62 0.982 0.995 1649963 IFLab1_002097 COc1ccnc(Nc2ccc(C)cc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P08 compound treatment 0.057 0.00688 0.44 0.06 0.00894 0.62 0.7544 0.9858 1151052 IFLab1_002098 CN1CCc2c(C(=O)N)c(NC(=O)c3cc(Cl)sc3Cl)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P09 compound treatment 0.055 0.00488 0.31 0.058 0.00694 0.48 0.5646 0.9779 1597260 IFLab1_002099 Cc1occc(=O)c1OC(=O)c2ccc(cc2)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P10 compound treatment 0.059 0.00887 0.57 0.058 0.00694 0.48 0.7466 0.9967 1130732 IFLab1_002100 COc1ccc(cc1)C(=O)NCc2nnc(SC)n2CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P11 compound treatment 0.057 0.00688 0.44 0.061 0.00994 0.69 0.8038 0.9763 1217156 IFLab1_002101 CSc1nnc(CNC(=O)Cc2ccccc2)n1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P12 compound treatment 0.051 8.75E-4 0.06 0.057 0.00594 0.41 0.3331 0.7958 1737840 IFLab1_002102 COc1ccc(OC)c(c1)c2nnc(NC(=O)Cc3cccs3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P13 compound treatment 0.1 0.0499 3.21 0.093 0.0419 2.93 4.3416 0.999 1627526 IFLab1_002103 CC(C)(C)C(=O)Nc1nnc(SCc2ccccc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P14 compound treatment 0.057 0.00688 0.44 0.06 0.00894 0.62 0.7544 0.9858 1467867 IFLab1_002104 CSc1nnc(NC(=O)c2cc3ccccc3oc2=O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P15 compound treatment 0.054 0.00388 0.25 0.06 0.00894 0.62 0.6179 0.919 1131969 IFLab1_002105 CC(C)Sc1nnc(NC(=O)c2ccc(F)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P16 compound treatment 0.051 8.75E-4 0.06 0.057 0.00594 0.41 0.3331 0.7958 1642669 IFLab1_002106 Fc1ccc(CSc2nnc(NC(=O)CCc3ccccc3)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P17 compound treatment 0.043 -0.00713 -0.46 0.044 -0.00706 -0.49 -0.6732 -0.9993 2066598 IFLab1_002107 CC(C)Sc1nnc(NC(=O)c2cccs2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P18 compound treatment 0.056 0.00588 0.38 0.057 0.00594 0.41 0.5607 0.9989 1153759 IFLab1_002108 Clc1ccc(cc1)C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P19 compound treatment 0.061 0.0109 0.7 0.059 0.00794 0.55 0.8871 0.9933 1297256 IFLab1_002109 Clc1ccc(cc1)n2ncc3c(NCc4ccco4)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P20 compound treatment 0.164 0.114 7.33 0.056 0.00494 0.34 5.4267 0.7396 1399814 IFLab1_002110 O=C(CCOc1ccccc1)N2CCN(CC2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P21 compound treatment 0.072 0.0219 1.41 0.072 0.0209 1.46 2.0299 0.9998 1486928 IFLab1_002111 CCc1ccccc1Nc2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P22 compound treatment 0.053 0.00288 0.19 0.059 0.00794 0.55 0.5229 0.8946 2066599 IFLab1_002112 Cc1sc(NC(=O)c2ccc3ncsc3c2)nc1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P23 mock treatment 0.05 -1.25E-4 -0.01 0.053 0.00194 0.14 0.09 0.6639 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1417 P24 mock treatment 0.048 -0.00213 -0.14 0.049 -0.00206 -0.14 -0.1986 -0.9997 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A01 compound treatment 0.127 0.0325 2.09 0.106 0.0308 2.15 3.0035 0.9999 1635158 IFLab1_002113 CCOC(=O)Cc1csc(NC(=O)c2ccc3ncsc3c2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A02 compound treatment 0.094 -4.84E-4 -0.03 0.081 0.00584 0.41 0.2666 0.6513 1610130 IFLab1_002114 Cc1nnc(NC(=O)CSc2c[nH]c3ccccc23)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A03 compound treatment 0.069 -0.0255 -1.64 0.068 -0.00716 -0.5 -1.5134 -0.8825 1165598 IFLab1_002115 Cc1cccc(NC(=O)c2ccc3CCCCc3c2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A04 compound treatment 0.132 0.0375 2.41 0.111 0.0358 2.5 3.4781 0.9998 2066600 IFLab1_002116 CC(Oc1ccccc1)C(=O)Nc2ccc(cc2)n3nncc3c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A05 compound treatment 0.433 0.339 21.79 0.27 0.195 13.61 25.0318 0.9743 1573765 IFLab1_002117 O=C(Nc1ccc2sccc2c1)C3COc4ccccc4O3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A06 compound treatment 0.093 -0.00148 -0.1 0.09 0.0148 1.04 0.6657 0.6393 1249570 IFLab1_002118 Cc1cc(C)n2cc(CN3CCOCC3)nc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A07 compound treatment 0.069 -0.0255 -1.64 0.086 0.0108 0.76 -0.6242 -0.3455 1492235 IFLab1_002119 CCCC(=O)Nc1c2CS(=O)(=O)Cc2nn1c3cccc(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A08 compound treatment 0.585 0.491 31.57 0.56 0.485 33.87 46.2753 0.9994 1570935 IFLab1_002120 COCC(C)n1c(=O)c2ccccc2c3ccccc3c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A09 compound treatment 0.13 0.0355 2.29 0.109 0.0338 2.36 3.2883 0.9999 1733826 IFLab1_002121 CCC(C(=O)Nc1c2CSCc2nn1c3ccc(F)cc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A10 compound treatment 0.079 -0.0155 -1.0 0.068 -0.00716 -0.5 -1.0582 -0.9491 2066601 IFLab1_002122 CN1CCc2c(OCC(=O)N3CCC(Cc4ccccc4)CC3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A11 compound treatment 0.078 -0.0165 -1.06 0.077 0.00184 0.13 -0.6592 -0.6167 2066602 IFLab1_002123 O=C(CSC1=NN2CCCC(=O)N=C2S1)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A12 compound treatment 0.473 0.379 24.36 0.414 0.339 23.67 33.9657 0.9999 2066603 IFLab1_002124 CCN1CCc2c(OCc3ccc(Cl)cc3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A13 compound treatment 0.084 -0.0105 -0.67 0.073 -0.00216 -0.15 -0.5837 -0.8442 1161551 IFLab1_002125 Cc1nnc(NC(=O)CSc2cn(Cc3ccccc3)c4ccccc24)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A14 compound treatment 0.366 0.272 17.48 0.432 0.357 24.93 29.985 0.9849 2066604 IFLab1_002126 CC(C)Oc1cccc2C(=O)N(Cc3ccccc3)CCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A15 compound treatment 0.219 0.125 8.01 0.216 0.141 9.84 12.6245 0.9948 1341623 IFLab1_002127 COc1ccc(CCNC(=O)CSc2cn(C)c3ccccc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A16 compound treatment 0.092 -0.00248 -0.16 0.085 0.00984 0.69 0.3732 0.5286 2066605 IFLab1_002128 O=C(COc1cccc2C(=O)N(Cc3cccnc3)CCc12)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A17 compound treatment 0.078 -0.0165 -1.06 0.064 -0.0112 -0.78 -1.3013 -0.9885 1575537 IFLab1_002129 CCn1cc(SCC(=O)NCc2ccco2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A18 compound treatment 0.104 0.00952 0.61 0.085 0.00984 0.69 0.9194 0.9983 1429546 IFLab1_002130 Cc1ccc2NC(=O)CN(C(c3ccccc3)c2c1)C(=O)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A19 compound treatment 0.04 -0.0545 -3.51 0.04 -0.0352 -2.46 -4.2164 -0.9848 2066606 IFLab1_002131 Fc1ccc(CSc2c[nH]c3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A20 compound treatment 0.113 0.0185 1.19 0.112 0.0368 2.57 2.6627 0.9388 1168181 IFLab1_002132 Fc1ccc(cc1)C2N(CC(=O)Nc3ccc(F)cc23)C(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A21 compound treatment 0.099 0.00452 0.29 0.084 0.00884 0.62 0.6424 0.9409 1383288 IFLab1_002133 O=C(CSc1c[nH]c2ccccc12)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A22 compound treatment 0.12 0.0255 1.64 0.09 0.0148 1.04 1.8946 0.9754 1698240 IFLab1_002134 CCCCC1CCC(CC1)C(=O)Nc2c3CS(=O)Cc3nn2c4ccccc4C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A23 mock treatment 0.095 5.16E-4 0.03 0.068 -0.00716 -0.5 -0.33 -0.6587 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 A24 mock treatment 0.087 -0.00748 -0.48 0.074 -0.00116 -0.08 -0.3977 -0.8143 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B01 compound treatment 0.121 0.0265 1.71 0.096 0.0208 1.46 2.2365 0.9969 1132477 IFLab1_002135 Cc1cccc(c1C)n2nc3CS(=O)Cc3c2NC(=O)COc4ccc(Cl)cc4Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B02 compound treatment 0.326 0.232 14.9 0.254 0.179 12.49 19.3716 0.9962 2066607 IFLab1_002136 CCCSc1nc2CCSc2c(=O)n1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B03 compound treatment 0.218 0.124 7.95 0.168 0.0928 6.49 10.2079 0.9949 2066608 IFLab1_002137 CC(C)Sc1nc2n(ncc2c(=O)[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B04 compound treatment 0.359 0.265 17.03 0.321 0.246 17.17 24.1832 1.0 1599701 IFLab1_002138 CC(C)Sc1nc2c3ccccc3[nH]c2c(=O)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B05 compound treatment 0.039 -0.0555 -3.57 0.058 -0.0172 -1.2 -3.3727 -0.8953 2066609 IFLab1_002139 CC(=O)Oc1c(Sc2ccccc2)c(C)nn1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B06 compound treatment 0.801 0.707 45.47 0.814 0.739 51.62 68.6533 0.998 2066610 IFLab1_002140 CCOc1ccccc1C(=O)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B07 compound treatment 0.112 0.0175 1.13 0.096 0.0208 1.46 1.8269 0.992 1337346 IFLab1_002141 NC(=O)CSc1c([nH]c2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B08 compound treatment 0.114 0.0195 1.26 0.089 0.0138 0.97 1.5721 0.9917 2066611 IFLab1_002142 O=C(NCCSc1c[nH]c2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B09 compound treatment 0.119 0.0245 1.58 0.094 0.0188 1.32 2.0467 0.9959 1501564 IFLab1_002143 CC1CC(CC(C)(C)C1)Nc2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B10 compound treatment 0.106 0.0115 0.74 0.081 0.00584 0.41 0.8128 0.9605 2066612 IFLab1_002144 Cc1[nH]c2ccccc2c1SCCNC(=O)Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B11 compound treatment 0.073 -0.0215 -1.38 0.064 -0.0112 -0.78 -1.5289 -0.9632 1666807 IFLab1_002145 CC(C)CNc1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B12 compound treatment 0.163 0.0685 4.41 0.13 0.0548 3.83 5.8276 0.9975 2066613 IFLab1_002146 CCC(=O)NCCSc1c([nH]c2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B13 compound treatment 0.108 0.0135 0.87 0.075 -1.56E-4 -0.01 0.6074 0.6982 1204379 IFLab1_002147 CCN(C1CCCCC1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B14 compound treatment 0.085 -0.00948 -0.61 0.07 -0.00516 -0.36 -0.6863 -0.9683 2066614 IFLab1_002148 Cn1c(CNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B15 compound treatment 0.104 0.00952 0.61 0.076 8.44E-4 0.06 0.4748 0.7716 1740866 IFLab1_002149 CCOC(=O)C(CC)Sc1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B16 compound treatment 0.096 0.00152 0.1 0.088 0.0128 0.9 0.7035 0.7794 2066615 IFLab1_002150 CCCn1c(CNC(=O)c2cccc(C)c2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B17 compound treatment 0.079 -0.0155 -1.0 0.063 -0.0122 -0.85 -1.3052 -0.9968 2066616 IFLab1_002151 CN(CCNc1ncnc2[nH]cnc12)Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B18 compound treatment 0.086 -0.00848 -0.55 0.079 0.00384 0.27 -0.1963 -0.3225 2066617 IFLab1_002152 CCCCn1c(CNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B19 compound treatment 0.091 -0.00348 -0.22 0.081 0.00584 0.41 0.1301 0.2793 2066618 IFLab1_002153 O=C(CSc1nc2CCSc2c(=O)n1c3ccccc3)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B20 compound treatment 0.109 0.0145 0.93 0.079 0.00384 0.27 0.8505 0.8749 2066619 IFLab1_002154 CC(C)(C)C(=O)NCc1nc2ccccc2n1Cc3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B21 compound treatment 0.09 -0.00448 -0.29 0.081 0.00584 0.41 0.0846 0.1692 2066620 IFLab1_002155 COC(=O)C(C)Sc1nc2CCSc2c(=O)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B22 compound treatment 0.088 -0.00648 -0.42 0.077 0.00184 0.13 -0.204 -0.4671 2066621 IFLab1_002156 Cc1cccc(c1)C(=O)NCc2nc3ccccc3n2CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B23 mock treatment 0.114 0.0195 1.26 0.076 8.44E-4 0.06 0.9299 0.7395 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 B24 mock treatment 0.079 -0.0155 -1.0 0.07 -0.00516 -0.36 -0.9594 -0.9054 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C01 compound treatment 0.324 0.23 14.77 0.264 0.189 13.19 19.7745 0.9984 1633953 IFLab1_002157 Fc1cccc(NC(=O)C2COc3ccccc3O2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C02 compound treatment 0.112 0.0175 1.13 0.096 0.0208 1.46 1.8269 0.992 1252358 IFLab1_002158 Cc1cc(NC(=O)CSc2c[nH]c3ccccc23)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C03 compound treatment 0.328 0.234 15.03 0.207 0.132 9.21 17.1409 0.9724 1433727 IFLab1_002159 Cc1cccc(NC(=O)C2COc3ccccc3O2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C04 compound treatment 0.134 0.0395 2.54 0.094 0.0188 1.32 2.7293 0.953 1504829 IFLab1_002160 Fc1ccc(cc1)C(=O)Nc2ccc(cc2)n3nncc3c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C05 compound treatment 0.105 0.0105 0.68 0.109 0.0338 2.36 2.1504 0.8744 1633628 IFLab1_002161 COc1ccc2n(C)c(=NC(=O)C3COc4ccccc4O3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C06 compound treatment 0.094 -4.84E-4 -0.03 0.073 -0.00216 -0.15 -0.1285 -0.8356 1737527 IFLab1_002162 Cc1cc(C)n2c(Br)c(CN3CCC4(CC3)OCCO4)nc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C07 compound treatment 0.11 0.0155 1.0 0.073 -0.00216 -0.15 0.5997 0.5937 2066622 IFLab1_002163 CC(=O)Nc1c2CS(=O)(=O)Cc2nn1c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C08 compound treatment 0.068 -0.0265 -1.7 0.059 -0.0162 -1.13 -2.0034 -0.98 1629891 IFLab1_002164 O=c1n(Cc2ccco2)c(=O)c3ccccc3c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C09 compound treatment 0.139 0.0445 2.87 0.123 0.0478 3.34 4.3895 0.9971 1614228 IFLab1_002165 Fc1ccc(cc1)n2nc3CSCc3c2NC(=O)COc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C10 compound treatment 0.122 0.0275 1.77 0.096 0.0208 1.46 2.282 0.9953 2066623 IFLab1_002166 CN1CCc2c(OCC(=O)NC3CCCCC3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C11 compound treatment 0.1 0.00552 0.36 0.086 0.0108 0.76 0.7867 0.9404 2066624 IFLab1_002167 O=C(CSC1=NN2CCCC(=O)N=C2S1)N3CCCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C12 compound treatment 0.096 0.00152 0.1 0.075 -1.56E-4 -0.01 0.0613 0.6241 2066625 IFLab1_002168 CCN1CCc2c(OCC(=O)N3CCC(Cc4ccccc4)CC3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C13 compound treatment 0.086 -0.00848 -0.55 0.071 -0.00416 -0.29 -0.5914 -0.9563 1512964 IFLab1_002169 Cn1cc(SCC(=O)N2CCCC2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C14 compound treatment 0.074 -0.0205 -1.32 0.06 -0.0152 -1.06 -1.681 -0.9941 2066626 IFLab1_002170 CCOC(=O)COc1cccc2C(=O)N(Cc3ccccc3)CCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C15 compound treatment 0.078 -0.0165 -1.06 0.064 -0.0112 -0.78 -1.3013 -0.9885 1604129 IFLab1_002171 Cn1cc(SCC(=O)NCc2ccco2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C16 compound treatment 0.134 0.0395 2.54 0.096 0.0208 1.46 2.8281 0.965 1668735 IFLab1_002172 O=C(CSCC(=O)N1CCCC1)Nc2nc(cs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C17 compound treatment 0.111 0.0165 1.06 0.108 0.0328 2.29 2.3741 0.9388 1597456 IFLab1_002173 CCn1cc(SCC(=O)Nc2nccs2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C18 compound treatment 0.237 0.143 9.17 0.228 0.153 10.68 14.0366 0.9971 1399135 IFLab1_002174 CCCC(=O)N1CC(=O)Nc2ccc(Br)cc2C1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C19 compound treatment 0.04 -0.0545 -3.51 0.039 -0.0362 -2.53 -4.2658 -0.987 2066627 IFLab1_002175 Fc1cccc(CSc2c[nH]c3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C20 compound treatment 0.084 -0.0105 -0.67 0.08 0.00484 0.34 -0.2379 -0.3151 1343528 IFLab1_002176 CC(C)(C)n1nc2CS(=O)Cc2c1NC(=O)CC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C21 compound treatment 0.078 -0.0165 -1.06 0.07 -0.00516 -0.36 -1.0049 -0.8969 1368429 IFLab1_002177 Cc1cccc(NC(=O)CSc2c[nH]c3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C22 compound treatment 0.087 -0.00748 -0.48 0.082 0.00684 0.48 -0.0025 -0.0037 1125236 IFLab1_002178 O=C(Cc1ccccc1)Nc2c3CS(=O)Cc3nn2c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C23 mock treatment 0.089 -0.00548 -0.35 0.073 -0.00216 -0.15 -0.3561 -0.9279 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 C24 mock treatment 0.093 -0.00148 -0.1 0.083 0.00784 0.55 0.3199 0.5752 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D01 compound treatment 0.131 0.0365 2.35 0.088 0.0128 0.9 2.2964 0.9128 2066628 IFLab1_002179 CCn1c(=NC(=O)c2ccc(cc2)S(=O)(=O)N(C)C)sc3cc(Cl)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D02 compound treatment 0.142 0.0475 3.06 0.123 0.0478 3.34 4.526 0.999 2066629 IFLab1_002180 CC(C)Sc1nc2CCSc2c(=O)n1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D03 compound treatment 0.456 0.362 23.27 0.269 0.194 13.54 26.0292 0.9668 2066630 IFLab1_002181 CCC(C)Sc1nc2n(ncc2c(=O)[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D04 compound treatment 0.144 0.0495 3.19 0.089 0.0138 0.97 2.9375 0.882 1160659 IFLab1_002182 CCOC(=O)CSc1nc2c3ccccc3[nH]c2c(=O)n1c4ccc(C)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D05 compound treatment 0.059 -0.0355 -2.28 0.051 -0.0242 -1.69 -2.8083 -0.9889 1575575 IFLab1_002183 COCC(=O)Oc1c(Sc2ccc(C)cc2)c(C)nn1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D06 compound treatment 0.296 0.202 12.97 0.195 0.12 8.37 15.0917 0.9776 2066631 IFLab1_002184 O=C(NCCSc1c[nH]c2ccccc12)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D07 compound treatment 0.119 0.0245 1.58 0.087 0.0118 0.83 1.7009 0.9546 1439475 IFLab1_002185 CC1=C(C(c2ccccc2)n3nc(SCc4ccccc4)nc3N1)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D08 compound treatment 0.11 0.0155 1.0 0.084 0.00884 0.62 1.1431 0.9733 1986922 IFLab1_002186 CC(C)C(=O)NCCSc1c[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D09 compound treatment 0.065 -0.0295 -1.9 0.058 -0.0172 -1.2 -2.1894 -0.9754 1088782 IFLab1_002187 C(Cc1ccccc1)Nc2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D10 compound treatment 0.281 0.187 12.01 0.236 0.161 11.24 16.4343 0.9995 2066632 IFLab1_002188 Cc1[nH]c2ccccc2c1SCCNC(=O)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D11 compound treatment 0.092 -0.00248 -0.16 0.061 -0.0142 -0.99 -0.8123 -0.8109 1222884 IFLab1_002189 CC(O)CNc1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D12 compound treatment 0.181 0.0865 5.57 0.105 0.0298 2.08 5.4118 0.9101 2066633 IFLab1_002190 COc1ccc(cc1)c2[nH]c3ccccc3c2SCCNC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D13 compound treatment 0.085 -0.00948 -0.61 0.077 0.00184 0.13 -0.3406 -0.5459 1329314 IFLab1_002191 C1CCCN(CC1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D14 compound treatment 0.08 -0.0145 -0.93 0.069 -0.00616 -0.43 -0.9633 -0.9383 2066634 IFLab1_002192 Cn1c(CNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D15 compound treatment 0.102 0.00752 0.48 0.079 0.00384 0.27 0.532 0.9614 2066635 IFLab1_002193 CCOC(=O)C(C)(C)Sc1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D16 compound treatment 0.118 0.0235 1.51 0.071 -0.00416 -0.29 0.865 0.5612 2066636 IFLab1_002194 CC(C)n1c(CNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D17 compound treatment 0.06 -0.0345 -2.22 0.054 -0.0212 -1.48 -2.6145 -0.9805 2066637 IFLab1_002195 CCN(c1cccc(C)c1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D18 compound treatment 0.103 0.00852 0.55 0.073 -0.00216 -0.15 0.2811 0.4945 2066638 IFLab1_002196 CCCCn1c(CNC(=O)c2cccs2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D19 compound treatment 0.09 -0.00448 -0.29 0.107 0.0318 2.22 1.369 0.6103 2066639 IFLab1_002197 NC(=O)CSc1nc2CCSc2c(=O)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D20 compound treatment 0.116 0.0215 1.38 0.086 0.0108 0.76 1.5149 0.9597 2066640 IFLab1_002198 Fc1ccccc1Cn2c(CNC(=O)Cc3ccccc3)nc4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D21 compound treatment 0.09 -0.00448 -0.29 0.083 0.00784 0.55 0.1834 0.2961 2066641 IFLab1_002199 O=C(CSc1nc2CCSc2c(=O)n1c3ccccc3)OCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D22 compound treatment 0.079 -0.0155 -1.0 0.067 -0.00816 -0.57 -1.1076 -0.9648 2066642 IFLab1_002200 C=CCn1c(CNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D23 mock treatment 0.092 -0.00248 -0.16 0.082 0.00684 0.48 0.225 0.4464 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 D24 mock treatment 0.075 -0.0195 -1.25 0.068 -0.00716 -0.5 -1.2403 -0.9187 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E01 compound treatment 0.051 -0.0435 -2.8 0.052 -0.0232 -1.62 -3.123 -0.966 1527773 IFLab1_002201 O=C(Nc1nccs1)c2ccc3CCCCc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E02 compound treatment 0.088 -0.00648 -0.42 0.072 -0.00316 -0.22 -0.451 -0.9555 2066643 IFLab1_002202 CC(C)(C)c1cnnn1c2ccc(NC(=O)COc3ccccc3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E03 compound treatment 0.091 -0.00348 -0.22 0.097 0.0218 1.53 0.9205 0.5968 1374536 IFLab1_002203 O=C(N1CCN(CC1)c2ccccc2)c3ccc4CCCCc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E04 compound treatment 0.139 0.0445 2.87 0.114 0.0388 2.71 3.9449 0.9996 1643731 IFLab1_002204 COc1ccc(cc1)C(=O)Nc2ccc(cc2)n3nncc3c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E05 compound treatment 0.072 -0.0225 -1.45 0.068 -0.00716 -0.5 -1.3768 -0.8992 1359418 IFLab1_002205 CCN1CCc2c(C(=O)N)c(NC(=O)c3ccc4CCCCc4c3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E06 compound treatment 0.141 0.0465 2.99 0.104 0.0288 2.02 3.5419 0.9814 1228490 IFLab1_002206 COc1ccc(cc1)N2CCN(Cc3nc4nc(C)cc(C)n4c3Br)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E07 compound treatment 0.098 0.00352 0.23 0.074 -0.00116 -0.08 0.1029 0.4283 2066644 IFLab1_002207 Clc1ccc(cc1)n2nc3CS(=O)(=O)Cc3c2NC(=O)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E08 compound treatment 0.162 0.0675 4.35 0.111 0.0358 2.5 4.8435 0.9657 2066645 IFLab1_002208 Brc1ccc(CN2CCc3c(OCC(=O)N4CCOCC4)cccc3C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E09 compound treatment 0.2 0.106 6.79 0.124 0.0488 3.41 7.2151 0.9493 2066646 IFLab1_002209 Cc1cccc(c1C)n2nc3CSCc3c2NC(=O)/C=C\c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E10 compound treatment 0.069 -0.0255 -1.64 0.062 -0.0132 -0.92 -1.8097 -0.9625 2066647 IFLab1_002210 CN1CCc2c(OCC(=O)N3CCc4ccccc34)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E11 compound treatment 0.108 0.0135 0.87 0.077 0.00184 0.13 0.7062 0.803 2066648 IFLab1_002211 O=C(CSC1=NN2CCCC(=O)N=C2S1)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E12 compound treatment 0.328 0.234 15.03 0.234 0.159 11.1 18.4746 0.9889 2066649 IFLab1_002212 CCN1CCc2c(OCC(=O)N3CCCc4ccccc34)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E13 compound treatment 0.073 -0.0215 -1.38 0.064 -0.0112 -0.78 -1.5289 -0.9632 1274679 IFLab1_002213 Cn1cc(SCC(=O)NC2CCCCC2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E14 compound treatment 0.175 0.0805 5.18 0.089 0.0138 0.97 4.3484 0.8248 2066650 IFLab1_002214 CC1CCN(CC1)C(=O)COc2cccc3C(=O)N(Cc4ccccc4)CCc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E15 compound treatment 0.108 0.0135 0.87 0.072 -0.00316 -0.22 0.4592 0.5117 1546893 IFLab1_002215 Cn1cc(SCC(=O)Nc2nccs2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E16 compound treatment 0.143 0.0485 3.12 0.111 0.0358 2.5 3.9787 0.994 1267123 IFLab1_002216 O=C(CSCC(=O)N1CCOCC1)Nc2nc(cs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E17 compound treatment 0.117 0.0225 1.45 0.086 0.0108 0.76 1.5604 0.9542 1512881 IFLab1_002217 CCSc1nnc(NC(=O)CSc2cn(CC)c3ccccc23)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E18 compound treatment 0.295 0.201 12.91 0.244 0.169 11.8 17.4667 0.999 1192525 IFLab1_002218 CC(C)CC(=O)N1CC(=O)Nc2ccc(Cl)cc2C1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E19 compound treatment 0.094 -4.84E-4 -0.03 0.074 -0.00116 -0.08 -0.0791 -0.9141 1431821 IFLab1_002219 O=C(CSc1c[nH]c2ccccc12)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E20 compound treatment 0.103 0.00852 0.55 0.083 0.00784 0.55 0.7751 1.0 1522936 IFLab1_002220 Cc1ccc(cc1)n2nc3CS(=O)Cc3c2NC(=O)C4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E21 compound treatment 0.084 -0.0105 -0.67 0.073 -0.00216 -0.15 -0.5837 -0.8442 1248786 IFLab1_002221 COc1ccc(NC(=O)CSc2c[nH]c3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E22 compound treatment 0.12 0.0255 1.64 0.082 0.00684 0.48 1.4994 0.8766 1196087 IFLab1_002222 COc1ccc(cc1)n2nc3CS(=O)Cc3c2NC(=O)c4cccc(F)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E23 mock treatment 0.088 -0.00648 -0.42 0.076 8.44E-4 0.06 -0.2534 -0.6013 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 E24 mock treatment 0.098 0.00352 0.23 0.085 0.00984 0.69 0.6463 0.8927 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F01 compound treatment 0.123 0.0285 1.84 0.119 0.0438 3.06 3.4637 0.97 2066651 IFLab1_002223 CCn1c(=NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCC3)sc4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F02 compound treatment 0.162 0.0675 4.35 0.101 0.0258 1.81 4.3495 0.9243 2066652 IFLab1_002224 Clc1ccc(cc1)n2c(SCC(=O)NCCc3ccccc3)nc4CCSc4c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F03 compound treatment 0.296 0.202 12.97 0.18 0.105 7.32 14.3507 0.9634 2066653 IFLab1_002225 CC(C)CSc1nc2n(ncc2c(=O)[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F04 compound treatment 0.419 0.325 20.89 0.305 0.23 16.06 26.1236 0.9916 1401085 IFLab1_002226 COC(=O)C(C)Sc1nc2c3ccccc3[nH]c2c(=O)n1c4cc(C)cc(C)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F05 compound treatment 0.041 -0.0535 -3.44 0.041 -0.0342 -2.39 -4.1215 -0.984 2066654 IFLab1_002227 CC(=O)Oc1c(Sc2ccccc2)c(C)nn1C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F06 compound treatment 0.289 0.195 12.52 0.204 0.129 9.0 15.2177 0.9869 2066655 IFLab1_002228 COc1ccc(/C=C/C(=O)NCCSc2c[nH]c3ccccc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F07 compound treatment 0.09 -0.00448 -0.29 0.072 -0.00316 -0.22 -0.36 -0.9912 1116063 IFLab1_002229 N(c1ccccc1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F08 compound treatment 0.099 0.00452 0.29 0.076 8.44E-4 0.06 0.2472 0.8335 2066656 IFLab1_002230 O=C(NCCSc1c[nH]c2ccccc12)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F09 compound treatment 0.082 -0.0125 -0.8 0.074 -0.00116 -0.08 -0.6253 -0.7743 1433115 IFLab1_002231 Cc1ccc(CNc2ncnc3[nH]cnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F10 compound treatment 0.099 0.00452 0.29 0.07 -0.00516 -0.36 -0.0492 -0.1062 2066657 IFLab1_002232 Cc1[nH]c2ccccc2c1SCCNC(=O)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F11 compound treatment 0.085 -0.00948 -0.61 0.058 -0.0172 -1.2 -1.2791 -0.951 1515739 IFLab1_002233 C1CCC(C1)Nc2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F12 compound treatment 0.224 0.13 8.34 0.285 0.21 14.66 16.2606 0.9642 2066658 IFLab1_002234 CCC(=O)NCCSc1c([nH]c2ccccc12)c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F13 compound treatment 0.094 -4.84E-4 -0.03 0.077 0.00184 0.13 0.0691 0.5211 1116026 IFLab1_002235 C1CCN(C1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F14 compound treatment 0.093 -0.00148 -0.1 0.07 -0.00516 -0.36 -0.3222 -0.8647 1986747 IFLab1_002236 CCn1c(CNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F15 compound treatment 0.151 0.0565 3.64 0.135 0.0598 4.18 5.5284 0.9976 1025691 IFLab1_002237 CC(Sc1ncnc2[nH]cnc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F16 compound treatment 0.122 0.0275 1.77 0.075 -1.56E-4 -0.01 1.2446 0.7027 2066659 IFLab1_002238 CCC(=O)NCc1nc2ccccc2n1C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F17 compound treatment 0.078 -0.0165 -1.06 0.064 -0.0112 -0.78 -1.3013 -0.9885 2066660 IFLab1_002239 CCN(c1ccc(CC)cc1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F18 compound treatment 0.088 -0.00648 -0.42 0.076 8.44E-4 0.06 -0.2534 -0.6013 2066661 IFLab1_002240 CC(=O)NCc1nc2ccccc2n1Cc3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F19 compound treatment 0.11 0.0155 1.0 0.083 0.00784 0.55 1.0937 0.9601 2066662 IFLab1_002241 O=C(CSc1nc2CCSc2c(=O)n1c3ccccc3)NCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F20 compound treatment 0.093 -0.00148 -0.1 0.075 -1.56E-4 -0.01 -0.0753 -0.7828 2066663 IFLab1_002242 CC(C)Cn1c(CNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F21 compound treatment 0.083 -0.0115 -0.74 0.07 -0.00516 -0.36 -0.7774 -0.9454 2066664 IFLab1_002243 O=C(CSc1nc2CCSc2c(=O)n1c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F22 compound treatment 0.077 -0.0175 -1.13 0.067 -0.00816 -0.57 -1.1986 -0.9503 2066665 IFLab1_002244 CCCC(=O)NCc1nc2ccccc2n1CC(=C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F23 mock treatment 0.1 0.00552 0.36 0.077 0.00184 0.13 0.3421 0.9059 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 F24 mock treatment 0.093 -0.00148 -0.1 0.073 -0.00216 -0.15 -0.1741 -0.9758 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G01 compound treatment 0.48 0.386 24.81 0.369 0.294 20.53 32.0614 0.9956 1529122 IFLab1_002245 COc1cccc(NC(=O)c2ccc3CCCCc3c2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G02 compound treatment 0.113 0.0185 1.19 0.087 0.0118 0.83 1.4278 0.9841 1264034 IFLab1_002246 COc1ccc(cc1)C(=O)Nc2ccc(cc2)n3nncc3C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G03 compound treatment 0.079 -0.0155 -1.0 0.077 0.00184 0.13 -0.6136 -0.6106 1737761 IFLab1_002247 NC(=O)c1c(NC(=O)C2COc3ccccc3O2)sc4CCCCc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G04 compound treatment 0.602 0.508 32.67 0.256 0.181 12.63 32.0319 0.9146 1611845 IFLab1_002248 O=C(Nc1ccc(cc1)n2nncc2c3ccccc3)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G05 compound treatment 0.082 -0.0125 -0.8 0.074 -0.00116 -0.08 -0.6253 -0.7743 1578795 IFLab1_002249 CN1CCc2c(C(=O)N)c(NC(=O)c3ccc4ncsc4c3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G06 compound treatment 0.108 0.0135 0.87 0.101 0.0258 1.81 1.8918 0.944 1503991 IFLab1_002250 O=C(CSc1cn(CCNC(=O)c2ccccc2)c3ccccc13)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G07 compound treatment 0.088 -0.00648 -0.42 0.074 -0.00116 -0.08 -0.3522 -0.8286 2066666 IFLab1_002251 CC(C)(C)C(=O)Nc1c2CS(=O)(=O)Cc2nn1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G08 compound treatment 0.199 0.105 6.73 0.135 0.0598 4.18 7.713 0.9738 2066667 IFLab1_002252 COc1cccc2C(=O)N(C)CCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G09 compound treatment 0.073 -0.0215 -1.38 0.062 -0.0132 -0.92 -1.6277 -0.9803 2066668 IFLab1_002253 O=C1CCCN2N=C(SCc3ccccc3)SC2=N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G10 compound treatment 0.139 0.0445 2.87 0.097 0.0218 1.53 3.1051 0.9565 2066669 IFLab1_002254 CN1CCc2c(OCC(=O)Nc3ccccc3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G11 compound treatment 0.101 0.00652 0.42 0.082 0.00684 0.48 0.6346 0.9979 1988980 IFLab1_002255 CC(C)SC1=NN2CCCC(=O)N=C2S1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G12 compound treatment 0.137 0.0425 2.74 0.109 0.0338 2.36 3.6069 0.9973 2066670 IFLab1_002256 CCN1CCc2c(OCC(=O)Nc3ccccc3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G13 compound treatment 0.682 0.588 37.82 0.344 0.269 18.78 40.02 0.9478 1711507 IFLab1_002257 Cn1cc(SCC(=O)N2CCc3ccccc23)c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G14 compound treatment 0.107 0.0125 0.81 0.093 0.0178 1.25 1.4511 0.9777 2066671 IFLab1_002258 O=C(COc1cccc2C(=O)N(Cc3ccccc3)CCc12)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G15 compound treatment 0.096 0.00152 0.1 0.076 8.44E-4 0.06 0.1107 0.9709 1700924 IFLab1_002259 Cc1cc(NC(=O)CSc2cn(C)c3ccccc23)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G16 compound treatment 0.339 0.245 15.74 0.278 0.203 14.17 21.1488 0.9986 1624721 IFLab1_002260 CC1CCCCN1C(=O)CSCC(=O)Nc2nc(cs2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G17 compound treatment 0.084 -0.0105 -0.67 0.071 -0.00416 -0.29 -0.6825 -0.929 1575716 IFLab1_002261 CCCn1cc(SCC(=O)NC2CCCCC2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G18 compound treatment 0.183 0.0885 5.7 0.148 0.0728 5.09 7.627 0.9984 1550535 IFLab1_002262 Clc1ccc2NC(=O)CN(C(c3ccccc3)c2c1)C(=O)c4ccc(Br)o4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G19 compound treatment 0.098 0.00352 0.23 0.069 -0.00616 -0.43 -0.1441 -0.2965 1246056 IFLab1_002263 O=C(CSc1c[nH]c2ccccc12)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G20 compound treatment 0.091 -0.00348 -0.22 0.072 -0.00316 -0.22 -0.3145 -1.0 1243084 IFLab1_002264 Clc1cccc(c1)n2nc3CS(=O)Cc3c2NC(=O)C4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G21 compound treatment 0.13 0.0355 2.29 0.101 0.0258 1.81 2.8931 0.9932 1195249 IFLab1_002265 CCOc1ccc(NC(=O)CSc2c[nH]c3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G22 compound treatment 0.108 0.0135 0.87 0.084 0.00884 0.62 1.052 0.9859 1386808 IFLab1_002266 COc1cccc(c1)C(=O)Nc2c3CS(=O)Cc3nn2c4ccc(C)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G23 mock treatment 0.072 -0.0225 -1.45 0.069 -0.00616 -0.43 -1.3274 -0.8792 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 G24 mock treatment 0.081 -0.0135 -0.87 0.072 -0.00316 -0.22 -0.7696 -0.8595 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H01 compound treatment 0.138 0.0435 2.8 0.115 0.0398 2.78 3.9488 1.0 2066672 IFLab1_002267 CCn1c(=NC(=O)c2ccc(cc2)S(=O)(=O)N(CC=C)CC=C)sc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H02 compound treatment 0.159 0.0645 4.15 0.13 0.0548 3.83 5.6455 0.9992 2066673 IFLab1_002268 CCC(C)Sc1nc2CCSc2c(=O)n1c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H03 compound treatment 0.143 0.0485 3.12 0.098 0.0228 1.6 3.3366 0.9514 2066674 IFLab1_002269 O=c1[nH]c(SCc2ccccc2)nc3n(ncc13)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H04 compound treatment 0.126 0.0315 2.03 0.083 0.00784 0.55 1.8219 0.867 1232933 IFLab1_002270 CCOC(=O)CSc1nc2c3ccccc3[nH]c2c(=O)n1c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H05 compound treatment 0.087 -0.00748 -0.48 0.068 -0.00716 -0.5 -0.6941 -0.9998 1719331 IFLab1_002271 Cc1[nH]c2ccccc2c1SCC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H06 compound treatment 0.16 0.0655 4.22 0.121 0.0458 3.2 5.2464 0.9908 2066675 IFLab1_002272 O=C(NCCSc1c[nH]c2ccccc12)C3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H07 compound treatment 0.107 0.0125 0.81 0.076 8.44E-4 0.06 0.6113 0.7568 1716215 IFLab1_002273 Cc1ccccc1Nc2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H08 compound treatment 0.225 0.131 8.4 0.158 0.0828 5.79 10.0325 0.9835 2066676 IFLab1_002274 O=C(NCCSc1c[nH]c2ccccc12)c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H09 compound treatment 0.095 5.16E-4 0.03 0.076 8.44E-4 0.06 0.0652 0.9632 1011397 IFLab1_002275 OCCNc1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H10 compound treatment 0.544 0.45 28.93 0.539 0.464 32.4 43.3719 0.9984 2066677 IFLab1_002276 Cc1[nH]c2ccccc2c1SCCNC(=O)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H11 compound treatment 0.069 -0.0255 -1.64 0.064 -0.0112 -0.78 -1.7109 -0.9421 1504774 IFLab1_002277 C(Nc1ncnc2[nH]cnc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H12 compound treatment 0.17 0.0755 4.86 0.134 0.0588 4.11 6.3437 0.9965 2066678 IFLab1_002278 CC(=O)NCCSc1c([nH]c2ccccc12)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H13 compound treatment 0.068 -0.0265 -1.7 0.061 -0.0142 -0.99 -1.9047 -0.9665 1215993 IFLab1_002279 CC1CC(C)CN(C1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H14 compound treatment 0.08 -0.0145 -0.93 0.071 -0.00416 -0.29 -0.8645 -0.8854 2066679 IFLab1_002280 CCC(=O)NCc1nc2ccccc2n1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H15 compound treatment 0.381 0.287 18.44 0.283 0.208 14.52 23.3073 0.993 1660279 IFLab1_002281 Cc1cccc(CSc2ncnc3[nH]cnc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H16 compound treatment 0.082 -0.0125 -0.8 0.072 -0.00316 -0.22 -0.7241 -0.869 2066680 IFLab1_002282 CCCCn1c(CNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H17 compound treatment 0.086 -0.00848 -0.55 0.072 -0.00316 -0.22 -0.542 -0.9204 2066681 IFLab1_002283 CCCN(c1ccc(OCC)cc1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H18 compound treatment 0.106 0.0115 0.74 0.079 0.00384 0.27 0.714 0.9057 2066682 IFLab1_002284 Cc1ccccc1Cn2c(CNC(=O)C(C)(C)C)nc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H19 compound treatment 0.454 0.36 23.14 0.329 0.254 17.73 28.9021 0.9914 2066683 IFLab1_002285 CSc1nc2CCSc2c(=O)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H20 compound treatment 0.088 -0.00648 -0.42 0.073 -0.00216 -0.15 -0.4016 -0.9052 2066684 IFLab1_002286 CCC(=O)NCc1nc2ccccc2n1CC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H21 compound treatment 0.094 -4.84E-4 -0.03 0.074 -0.00116 -0.08 -0.0791 -0.9141 2066685 IFLab1_002287 CCSc1nc2CCSc2c(=O)n1c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H22 compound treatment 0.078 -0.0165 -1.06 0.057 -0.0182 -1.27 -1.6471 -0.9961 2066686 IFLab1_002288 CC(=C)Cn1c(CNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H23 mock treatment 0.09 -0.00448 -0.29 0.084 0.00884 0.62 0.2328 0.3414 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 H24 mock treatment 0.083 -0.0115 -0.74 0.063 -0.0122 -0.85 -1.1232 -0.9976 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I01 compound treatment 0.125 0.0305 1.96 0.109 0.0338 2.36 3.0607 0.9958 1273039 IFLab1_002289 CCOC(=O)c1ccc(NC(=O)c2ccc3ncsc3c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I02 compound treatment 0.135 0.0405 2.61 0.11 0.0348 2.43 3.5652 0.9994 2066687 IFLab1_002290 CCOc1ccccc1C(=O)Nc2ccc(cc2)n3nncc3C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I03 compound treatment 0.106 0.0115 0.74 0.082 0.00684 0.48 0.8622 0.9775 1441041 IFLab1_002291 CC1CN(CC(C)O1)C(=O)c2ccc3ncsc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I04 compound treatment 0.499 0.405 26.04 0.65 0.575 40.16 46.807 0.978 1452546 IFLab1_002292 O=C(Nc1ccc(cc1)n2nncc2c3ccccc3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I05 compound treatment 0.119 0.0245 1.58 0.092 0.0168 1.18 1.9479 0.9896 1459497 IFLab1_002293 CCCCC1CCC(CC1)C(=O)Nc2c3CS(=O)(=O)Cc3nn2C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I06 compound treatment 0.185 0.0905 5.83 0.144 0.0688 4.81 7.5204 0.9955 1453256 IFLab1_002294 O=C(CSc1cn(CCNC(=O)c2ccccc2)c3ccccc13)NCc4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I07 compound treatment 0.147 0.0525 3.38 0.129 0.0538 3.76 5.05 0.9986 1388827 IFLab1_002295 Fc1ccc(cc1)n2nc3CS(=O)(=O)Cc3c2NC(=O)CCC4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I08 compound treatment 0.337 0.243 15.61 0.318 0.243 16.97 23.0337 0.9991 2066688 IFLab1_002296 CCCOc1cccc2C(=O)N(C)CCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I09 compound treatment 0.068 -0.0265 -1.7 0.052 -0.0232 -1.62 -2.3492 -0.9997 2066689 IFLab1_002297 CCOC(=O)CSC1=NN2CCCC(=O)N=C2S1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I10 compound treatment 0.138 0.0435 2.8 0.127 0.0518 3.62 4.5415 0.9919 2066690 IFLab1_002298 CN1CCc2c(OCC(=O)NCc3ccco3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I11 compound treatment 0.113 0.0185 1.19 0.095 0.0198 1.39 1.823 0.9972 2066691 IFLab1_002299 O=C(CSC1=NN2CCCC(=O)N=C2S1)OCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I12 compound treatment 0.142 0.0475 3.06 0.098 0.0228 1.6 3.291 0.954 2066692 IFLab1_002300 CCN1CCc2c(OCC(=O)NCc3ccco3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I13 compound treatment 0.833 0.739 47.53 0.724 0.649 45.33 65.6638 0.9997 1570021 IFLab1_002301 Cn1cc(SCC(=O)N2CCCc3ccccc23)c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I14 compound treatment 0.218 0.124 7.95 0.282 0.207 14.45 15.8393 0.9604 2066693 IFLab1_002302 O=C(COc1cccc2C(=O)N(Cc3ccccc3)CCc12)NC4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I15 compound treatment 0.104 0.00952 0.61 0.084 0.00884 0.62 0.87 1.0 1196611 IFLab1_002303 CCn1cc(SCC(=O)N2CCOCC2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I16 compound treatment 0.307 0.213 13.68 0.219 0.144 10.05 16.7779 0.9885 1651192 IFLab1_002304 CC1CCCN(C1)C(=O)CSCC(=O)Nc2nc(cs2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I17 compound treatment 0.101 0.00652 0.42 0.074 -0.00116 -0.08 0.2395 0.5606 1710188 IFLab1_002305 CCCn1cc(SCC(=O)NCc2ccco2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I18 compound treatment 0.172 0.0775 4.99 0.145 0.0698 4.88 6.9782 0.9999 1308271 IFLab1_002306 Clc1ccc2NC(=O)CN(C(c3ccccc3)c2c1)C(=O)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I19 compound treatment 0.159 0.0645 4.15 0.122 0.0468 3.27 5.2503 0.993 1445814 IFLab1_002307 O=C(CSc1c[nH]c2ccccc12)N3CCN(CC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I20 compound treatment 0.119 0.0245 1.58 0.082 0.00684 0.48 1.4539 0.8818 1275791 IFLab1_002308 Cc1ccc(cc1)n2nc3CS(=O)Cc3c2NC(=O)CCC4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I21 compound treatment 0.11 0.0155 1.0 0.083 0.00784 0.55 1.0937 0.9601 1390944 IFLab1_002309 COc1ccc(CCNC(=O)CSc2c[nH]c3ccccc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I22 compound treatment 0.09 -0.00448 -0.29 0.072 -0.00316 -0.22 -0.36 -0.9912 1616799 IFLab1_002310 CCOc1ccc(cc1)C(=O)Nc2c3CS(=O)Cc3nn2c4cccc(Cl)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I23 mock treatment 0.097 0.00252 0.16 0.078 0.00284 0.2 0.255 0.9949 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 I24 mock treatment 0.111 0.0165 1.06 0.074 -0.00116 -0.08 0.6946 0.6515 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J01 compound treatment 0.328 0.234 15.03 0.248 0.173 12.07 19.1662 0.9941 2066694 IFLab1_002311 C=CCSc1nc2n(ncc2c(=O)[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J02 compound treatment 0.146 0.0515 3.32 0.106 0.0308 2.15 3.8683 0.9782 1702777 IFLab1_002312 NC(=O)CSc1nc2c3ccccc3[nH]c2c(=O)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J03 compound treatment 0.142 0.0475 3.06 0.107 0.0318 2.22 3.7356 0.9878 2066695 IFLab1_002313 FC(F)(F)c1cccc(CSc2nc3n(ncc3c(=O)[nH]2)c4ccccc4)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J04 compound treatment 0.189 0.0945 6.08 0.143 0.0678 4.74 7.6531 0.9924 1237051 IFLab1_002314 CCOC(=O)C(C)Sc1nc2c3ccccc3[nH]c2c(=O)n1c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J05 compound treatment 0.134 0.0395 2.54 0.087 0.0118 0.83 2.3836 0.8912 1157350 IFLab1_002315 Cc1[nH]c2ccccc2c1SCC(=O)NCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J06 compound treatment 0.146 0.0515 3.32 0.105 0.0298 2.08 3.8189 0.975 2066696 IFLab1_002316 Fc1cccc(F)c1C(=O)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J07 compound treatment 0.09 -0.00448 -0.29 0.078 0.00284 0.2 -0.0636 -0.1815 1105705 IFLab1_002317 Cc1cccc(Nc2ncnc3[nH]cnc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J08 compound treatment 0.278 0.184 11.81 0.2 0.125 8.72 14.5194 0.9889 2066697 IFLab1_002318 CC(Oc1ccccc1)C(=O)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J09 compound treatment 0.098 0.00352 0.23 0.077 0.00184 0.13 0.2511 0.9643 1554706 IFLab1_002319 C(Nc1ncnc2[nH]cnc12)C3CCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J10 compound treatment 0.082 -0.0125 -0.8 0.08 0.00484 0.34 -0.3289 -0.3772 2066698 IFLab1_002320 CC(=O)NCCSc1c(C)[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J11 compound treatment 0.134 0.0395 2.54 0.093 0.0178 1.25 2.6799 0.9461 1287684 IFLab1_002321 CCC(CO)Nc1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J12 compound treatment 0.092 -0.00248 -0.16 0.084 0.00884 0.62 0.3238 0.5074 2066699 IFLab1_002322 CC(=O)NCc1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J13 compound treatment 0.118 0.0235 1.51 0.091 0.0158 1.11 1.8529 0.9882 1206546 IFLab1_002323 C1Cc2ccccc2N1c3ncnc4[nH]cnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J14 compound treatment 0.081 -0.0135 -0.87 0.073 -0.00216 -0.15 -0.7202 -0.8176 2066700 IFLab1_002324 CCn1c(CNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J15 compound treatment 0.233 0.139 8.92 0.181 0.106 7.39 11.5328 0.9957 1015839 IFLab1_002325 Fc1cccc(CSc2ncnc3[nH]cnc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J16 compound treatment 0.082 -0.0125 -0.8 0.078 0.00284 0.2 -0.4277 -0.5167 2066701 IFLab1_002326 CCCCn1c(CNC(=O)CC)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J17 compound treatment 0.11 0.0155 1.0 0.094 0.0188 1.32 1.637 0.9907 2066702 IFLab1_002327 O=C(CSc1nc2CCSc2c(=O)n1c3ccccc3)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J18 compound treatment 0.104 0.00952 0.61 0.081 0.00584 0.41 0.7218 0.9806 2066703 IFLab1_002328 COCC(=O)NCc1nc2ccccc2n1Cc3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J19 compound treatment 0.1 0.00552 0.36 0.08 0.00484 0.34 0.4903 0.9997 2066704 IFLab1_002329 O=c1c2SCCc2nc(SCc3ccccc3)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J20 compound treatment 0.1 0.00552 0.36 0.08 0.00484 0.34 0.4903 0.9997 2066705 IFLab1_002330 CC(C)Cn1c(CNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J21 compound treatment 0.179 0.0845 5.44 0.126 0.0508 3.55 6.3582 0.9787 2066706 IFLab1_002331 CCSc1nc2CCSc2c(=O)n1c3ccccc3OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J22 compound treatment 0.093 -0.00148 -0.1 0.074 -0.00116 -0.08 -0.1247 -0.9965 2066707 IFLab1_002332 CC(=C)Cn1c(CNC(=O)c2ccc(F)cc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J23 mock treatment 0.113 0.0185 1.19 0.082 0.00684 0.48 1.1808 0.9195 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 J24 mock treatment 0.087 -0.00748 -0.48 0.075 -1.56E-4 -0.01 -0.3483 -0.7229 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K01 compound treatment 0.112 0.0175 1.13 0.103 0.0278 1.95 2.1726 0.9664 1379846 IFLab1_002333 NS(=O)(=O)c1ccc(NC(=O)c2ccc3ncsc3c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K02 compound treatment 0.188 0.0935 6.02 0.112 0.0368 2.57 6.0762 0.9282 2066708 IFLab1_002334 CC(C)(C)c1cnnn1c2ccc(NC(=O)c3ccc(Br)o3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K03 compound treatment 0.169 0.0745 4.8 0.121 0.0458 3.2 5.6561 0.9807 1415594 IFLab1_002335 CS(=O)(=O)c1ccc2nc(NC(=O)c3ccc4CCCCc4c3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K04 compound treatment 0.153 0.0585 3.77 0.095 0.0198 1.39 3.6435 0.9078 2066709 IFLab1_002336 CC(=O)Nc1ccc(cc1)n2nncc2c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K05 compound treatment 0.11 0.0155 1.0 0.076 8.44E-4 0.06 0.7479 0.7475 1736282 IFLab1_002337 CC(C)(C)n1nc2CS(=O)(=O)Cc2c1NC(=O)Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K06 compound treatment 0.221 0.127 8.14 0.164 0.0888 6.21 10.1469 0.991 1606600 IFLab1_002338 O=C(CSc1cn(CCNC(=O)c2ccccc2)c3ccccc13)Nc4nccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K07 compound treatment 0.094 -4.84E-4 -0.03 0.076 8.44E-4 0.06 0.0197 0.2949 1259324 IFLab1_002339 Cc1cccc(c1C)n2nc3CS(=O)(=O)Cc3c2NC(=O)c4c(F)cccc4Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K08 compound treatment 0.106 0.0115 0.74 0.089 0.0138 0.97 1.208 0.9914 2066710 IFLab1_002340 CCC1CCCCN1C(=O)COc2cccc3C(=O)N(C)CCc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K09 compound treatment 0.138 0.0435 2.8 0.094 0.0188 1.32 2.9114 0.9407 2066711 IFLab1_002341 CCC1CCCCN1C(=O)CSC2=NN3CCCC(=O)N=C3S2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K10 compound treatment 0.551 0.457 29.38 0.509 0.434 30.31 42.2085 0.9999 2066712 IFLab1_002342 CCCOc1cccc2C(=O)N(CC)CCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K11 compound treatment 0.17 0.0755 4.86 0.115 0.0398 2.78 5.4052 0.965 2066713 IFLab1_002343 O=C(CSC1=NN2CCCC(=O)N=C2S1)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K12 compound treatment 0.322 0.228 14.64 0.24 0.165 11.52 18.4979 0.9929 2066714 IFLab1_002344 COC(=O)c1ccc(COc2cccc3C(=O)N(Cc4ccccc4)CCc23)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K13 compound treatment 0.129 0.0345 2.22 0.092 0.0168 1.18 2.403 0.9558 1287039 IFLab1_002345 Cc1ccc(NC(=O)CSc2cn(C)c3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K14 compound treatment 0.381 0.287 18.44 0.291 0.216 15.08 23.7025 0.995 2066715 IFLab1_002346 O=C(COc1cccc2C(=O)N(Cc3ccccc3)CCc12)NCc4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K15 compound treatment 0.079 -0.0155 -1.0 0.076 8.44E-4 0.06 -0.663 -0.6641 1337054 IFLab1_002347 CCn1cc(SCC(=O)NC2CCCCC2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K16 compound treatment 0.278 0.184 11.81 0.183 0.108 7.53 13.6797 0.9764 1485238 IFLab1_002348 Cc1sc(NC(=O)CSCC(=O)N2CCCCC2)nc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K17 compound treatment 0.125 0.0305 1.96 0.09 0.0148 1.04 2.1221 0.9554 1720561 IFLab1_002349 CCCn1cc(SCC(=O)Nc2nccs2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K18 compound treatment 0.144 0.0495 3.19 0.105 0.0298 2.08 3.7279 0.9788 1691725 IFLab1_002350 Fc1ccc(cc1)C2N(CC(=O)Nc3ccc(F)cc23)C(=O)C4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K19 compound treatment 0.129 0.0345 2.22 0.081 0.00584 0.41 1.8596 0.8233 1714284 IFLab1_002351 O=C(CSc1c[nH]c2ccccc12)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K20 compound treatment 0.1 0.00552 0.36 0.067 -0.00816 -0.57 -0.1519 -0.2262 2066716 IFLab1_002352 CC(C)CC(=O)Nc1c2CS(=O)Cc2nn1c3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K21 compound treatment 0.124 0.0295 1.9 0.104 0.0288 2.02 2.7682 0.9996 1552804 IFLab1_002353 COc1ccc(NC(=O)CSc2c[nH]c3ccccc23)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K22 compound treatment 0.12 0.0255 1.64 0.11 0.0348 2.43 2.8825 0.9817 1685998 IFLab1_002354 CC(C)(C)c1ccc(cc1)C(=O)Nc2c3CS(=O)Cc3nn2c4cccc(Cl)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K23 mock treatment 0.092 -0.00248 -0.16 0.074 -0.00116 -0.08 -0.1702 -0.95 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 K24 mock treatment 0.085 -0.00948 -0.61 0.077 0.00184 0.13 -0.3406 -0.5459 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L01 compound treatment 0.164 0.0695 4.47 0.123 0.0478 3.34 5.5273 0.9897 2066717 IFLab1_002355 CSc1nc2n(ncc2c(=O)[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L02 compound treatment 0.629 0.535 34.4 0.455 0.38 26.54 43.091 0.9918 1500101 IFLab1_002356 CSc1nc2c3ccccc3[nH]c2c(=O)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L03 compound treatment 0.173 0.0785 5.05 0.108 0.0328 2.29 5.1959 0.9362 2066718 IFLab1_002357 Cc1cccc(CSc2nc3n(ncc3c(=O)[nH]2)c4ccc(Cl)cc4)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L04 compound treatment 0.165 0.0705 4.54 0.126 0.0508 3.55 5.721 0.9926 1324500 IFLab1_002358 COC(=O)C(C)Sc1nc2c3ccccc3[nH]c2c(=O)n1c4cccc(Cl)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L05 compound treatment 0.146 0.0515 3.32 0.093 0.0178 1.25 3.2261 0.9107 1682223 IFLab1_002359 Cc1[nH]c2ccccc2c1SCC(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L06 compound treatment 0.661 0.567 36.46 0.6 0.525 36.67 51.7102 1.0 2066719 IFLab1_002360 COc1ccccc1C(=O)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L07 compound treatment 0.079 -0.0155 -1.0 0.067 -0.00816 -0.57 -1.1076 -0.9648 1015182 IFLab1_002361 COc1ccc(Nc2ncnc3[nH]cnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L08 compound treatment 0.209 0.115 7.37 0.167 0.0918 6.42 9.7489 0.9976 2066720 IFLab1_002362 Cc1cccc(c1)C(=O)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L09 compound treatment 0.06 -0.0345 -2.22 0.054 -0.0212 -1.48 -2.6145 -0.9805 1540141 IFLab1_002363 CC(Nc1ncnc2[nH]cnc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L10 compound treatment 0.169 0.0745 4.8 0.106 0.0308 2.15 4.9151 0.9348 2066721 IFLab1_002364 Cc1[nH]c2ccccc2c1SCCNC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L11 compound treatment 0.059 -0.0355 -2.28 0.056 -0.0192 -1.34 -2.5613 -0.9676 1666417 IFLab1_002365 CCCN(CCC)c1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L12 compound treatment 0.118 0.0235 1.51 0.085 0.00984 0.69 1.5566 0.9363 2066722 IFLab1_002366 CCC(=O)NCc1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L13 compound treatment 0.093 -0.00148 -0.1 0.073 -0.00216 -0.15 -0.1741 -0.9758 1569766 IFLab1_002367 OC1CCN(CC1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L14 compound treatment 0.094 -4.84E-4 -0.03 0.074 -0.00116 -0.08 -0.0791 -0.9141 2066723 IFLab1_002368 CCn1c(CNC(=O)COC)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L15 compound treatment 0.099 0.00452 0.29 0.079 0.00384 0.27 0.3954 0.9992 1070173 IFLab1_002369 COc1ccccc1CNc2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L16 compound treatment 0.109 0.0145 0.93 0.093 0.0178 1.25 1.5421 0.9899 2066724 IFLab1_002370 CCCCn1c(CNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L17 compound treatment 0.166 0.0715 4.6 0.122 0.0468 3.27 5.5689 0.986 2066725 IFLab1_002371 CCC1CCCCN1C(=O)CSc2nc3CCSc3c(=O)n2c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L18 compound treatment 0.113 0.0185 1.19 0.102 0.0268 1.88 2.1688 0.9761 2066726 IFLab1_002372 CCCC(=O)NCc1nc2ccccc2n1Cc3cc(C)ccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L19 compound treatment 0.286 0.192 12.33 0.169 0.0938 6.56 13.3522 0.9563 2066727 IFLab1_002373 COC(=O)c1ccc(CSc2nc3CCSc3c(=O)n2c4ccccc4)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L20 compound treatment 0.133 0.0385 2.48 0.086 0.0108 0.76 2.2886 0.8829 2066728 IFLab1_002374 CC(C)Cn1c(CNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L21 compound treatment 0.656 0.562 36.14 0.54 0.465 32.47 48.5187 0.9986 2066729 IFLab1_002375 COc1ccccc1n2c(SCc3ccc(F)cc3)nc4CCSc4c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L22 compound treatment 0.082 -0.0125 -0.8 0.07 -0.00516 -0.36 -0.8229 -0.9345 2066730 IFLab1_002376 CC(=C)Cn1c(CNC(=O)c2cccs2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L23 mock treatment 0.094 -4.84E-4 -0.03 0.073 -0.00216 -0.15 -0.1285 -0.8356 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 L24 mock treatment 0.093 -0.00148 -0.1 0.072 -0.00316 -0.22 -0.2234 -0.9299 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M01 compound treatment 0.257 0.163 10.46 0.227 0.152 10.61 14.8974 1.0 1137296 IFLab1_002377 O=C(NCc1ccccc1)c2ccc3ncsc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M02 compound treatment 0.153 0.0585 3.77 0.114 0.0388 2.71 4.5821 0.9871 2066731 IFLab1_002378 CC(=O)Nc1ccc(cc1)n2nncc2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M03 compound treatment 0.067 -0.0275 -1.77 0.054 -0.0212 -1.48 -2.296 -0.996 1609713 IFLab1_002379 O=C(Nc1nc(cs1)c2ccncc2)C3COc4ccccc4O3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M04 compound treatment 0.932 0.838 53.91 0.948 0.873 60.98 81.2348 0.9981 2066732 IFLab1_002380 CSc1ncnc2n(cc(c3ccccc3)c12)c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M05 compound treatment 0.099 0.00452 0.29 0.076 8.44E-4 0.06 0.2472 0.8335 1373988 IFLab1_002381 CC(=O)Nc1c2CS(=O)(=O)Cc2nn1c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M06 compound treatment 1.231 1.14 73.15 1.159 1.08 75.72 105.2662 0.9999 1591870 IFLab1_002382 C=CCn1c(=O)c2ccccc2c3ccccc3c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M07 compound treatment 0.209 0.115 7.37 0.225 0.15 10.47 12.614 0.9853 1542921 IFLab1_002383 Cc1ccc(cc1)n2nc3CSCc3c2NC(=O)CCC4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M08 compound treatment 1.164 1.07 68.84 1.047 0.972 67.89 96.6843 1.0 2066733 IFLab1_002384 CN1CCc2c(OCc3ccccc3Cl)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M09 compound treatment 0.1 0.00552 0.36 0.09 0.0148 1.04 0.9843 0.898 2066734 IFLab1_002385 O=C(CSC1=NN2CCCC(=O)N=C2S1)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M10 compound treatment 0.83 0.736 47.34 0.701 0.626 43.72 64.3911 0.9992 2066735 IFLab1_002386 CCN1CCc2c(OC(C)C)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M11 compound treatment 0.041 -0.0535 -3.44 0.04 -0.0352 -2.46 -4.1709 -0.9863 1736080 IFLab1_002387 O=C(CSc1cn(Cc2ccccc2)c3ccccc13)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M12 compound treatment 0.496 0.402 25.84 0.429 0.354 24.72 35.7535 0.9998 2066736 IFLab1_002388 COc1cccc2C(=O)N(Cc3ccccc3)CCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M13 compound treatment 0.485 0.391 25.14 0.341 0.266 18.57 30.9058 0.9889 1211414 IFLab1_002389 CCOC(=O)c1ccc(NC(=O)CSc2cn(C)c3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M14 compound treatment 0.141 0.0465 2.99 0.1 0.0248 1.74 3.3443 0.9664 2066737 IFLab1_002390 Cc1ccccc1CN2CCc3c(OCC(=O)N4CCOCC4)cccc3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M15 compound treatment 0.617 0.523 33.63 0.562 0.487 34.01 47.8305 1.0 1364028 IFLab1_002391 CCn1cc(SCC(=O)N2CCc3ccccc23)c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M16 compound treatment 0.194 0.0995 6.41 0.145 0.0698 4.88 7.9794 0.991 1545038 IFLab1_002392 CC(C)CC(=O)N1CC(=O)Nc2ccc(C)cc2C1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M17 compound treatment 0.146 0.0515 3.32 0.132 0.0568 3.97 5.1526 0.996 1675792 IFLab1_002393 CCCn1cc(SCC(=O)Nc2nnc(SCC)s2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M18 compound treatment 0.134 0.0395 2.54 0.091 0.0158 1.11 2.5811 0.9305 1149106 IFLab1_002394 CC(Oc1ccccc1)C(=O)N2CC(=O)Nc3ccc(F)cc3C2c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M19 compound treatment 0.2 0.106 6.79 0.135 0.0598 4.18 7.7585 0.9728 1575533 IFLab1_002395 O=C(CSc1c[nH]c2ccccc12)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M20 compound treatment 0.106 0.0115 0.74 0.074 -0.00116 -0.08 0.467 0.6263 1739369 IFLab1_002396 Cc1cccc(c1C)n2nc3CS(=O)Cc3c2NC(=O)c4ccc(Br)o4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M21 compound treatment 0.112 0.0175 1.13 0.086 0.0108 0.76 1.3329 0.9813 1124986 IFLab1_002397 O=C(CSc1c[nH]c2ccccc12)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M22 compound treatment 0.111 0.0165 1.06 0.094 0.0188 1.32 1.6825 0.9944 2066738 IFLab1_002398 FC(F)(F)c1cccc(c1)C(=O)Nc2c3CS(=O)Cc3nn2c4cccc(Cl)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M23 mock treatment 0.132 0.0375 2.41 0.081 0.00584 0.41 1.9961 0.8151 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 M24 mock treatment 0.089 -0.00548 -0.35 0.084 0.00884 0.62 0.1873 0.2632 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N01 compound treatment 0.145 0.0505 3.25 0.125 0.0498 3.48 4.7613 0.9994 2066739 IFLab1_002399 CCSc1nc2n(ncc2c(=O)[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N02 compound treatment 0.19 0.0955 6.15 0.131 0.0558 3.9 7.1058 0.9759 1246183 IFLab1_002400 CCSc1nc2c3ccccc3[nH]c2c(=O)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N03 compound treatment 0.128 0.0335 2.16 0.087 0.0118 0.83 2.1105 0.9134 2066740 IFLab1_002401 Cc1ccc(cc1)n2ncc3c(=O)[nH]c(SCc4ccccc4F)nc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N04 compound treatment 0.224 0.13 8.34 0.163 0.0878 6.14 10.234 0.9886 2066741 IFLab1_002402 O=C(Cc1ccccc1)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N05 compound treatment 0.159 0.0645 4.15 0.12 0.0448 3.13 5.1515 0.9903 1703926 IFLab1_002403 O=C(CSc1c([nH]c2ccccc12)c3ccccc3)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N06 compound treatment 0.214 0.12 7.69 0.191 0.116 8.09 11.162 0.9997 2066742 IFLab1_002404 COc1cccc(c1)C(=O)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N07 compound treatment 0.063 -0.0315 -2.03 0.057 -0.0182 -1.27 -2.3298 -0.9745 1680511 IFLab1_002405 CCOc1ccc(Nc2ncnc3[nH]cnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N08 compound treatment 0.131 0.0365 2.35 0.097 0.0218 1.53 2.741 0.9781 2066743 IFLab1_002406 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N09 compound treatment 0.104 0.00952 0.61 0.075 -1.56E-4 -0.01 0.4254 0.6944 1606233 IFLab1_002407 COc1ccc(CNc2ncnc3[nH]cnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N10 compound treatment 0.127 0.0325 2.09 0.077 0.00184 0.13 1.571 0.7492 2066744 IFLab1_002408 CC(C)C(=O)NCCSc1c(C)[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N11 compound treatment 0.325 0.231 14.84 0.203 0.128 8.93 16.8067 0.9705 1628336 IFLab1_002409 C(N(Cc1ccccc1)c2ncnc3[nH]cnc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N12 compound treatment 0.136 0.0415 2.67 0.096 0.0208 1.46 2.9192 0.9593 2066745 IFLab1_002410 CCCC(=O)NCc1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N13 compound treatment 0.096 0.00152 0.1 0.072 -0.00316 -0.22 -0.0869 -0.3604 1343384 IFLab1_002411 Cc1ccc(C)c(c1)N2CCN(CC2)c3ncnc4[nH]cnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N14 compound treatment 0.147 0.0525 3.38 0.082 0.00684 0.48 2.7282 0.7992 2066746 IFLab1_002412 CCn1c(CNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N15 compound treatment 0.099 0.00452 0.29 0.073 -0.00216 -0.15 0.099 0.3025 2066747 IFLab1_002413 C(CNc1ncnc2[nH]cnc12)CN3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N16 compound treatment 0.099 0.00452 0.29 0.072 -0.00316 -0.22 0.0496 0.136 2066748 IFLab1_002414 CCCCn1c(CNC(=O)COC)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N17 compound treatment 0.131 0.0365 2.35 0.106 0.0308 2.15 3.1856 0.9991 2066749 IFLab1_002415 O=C(CSc1nc2CCSc2c(=O)n1c3ccccc3)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N18 compound treatment 0.098 0.00352 0.23 0.086 0.0108 0.76 0.6957 0.8799 2066750 IFLab1_002416 CC(=O)NCc1nc2ccccc2n1Cc3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N19 compound treatment 0.141 0.0465 2.99 0.092 0.0168 1.18 2.9491 0.9168 2066751 IFLab1_002417 CCOC(=O)CSc1nc2CCSc2c(=O)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N20 compound treatment 0.102 0.00752 0.48 0.077 0.00184 0.13 0.4332 0.8652 2066752 IFLab1_002418 COc1ccc(cc1OC)C(=O)NCc2nc3ccccc3n2CC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N21 compound treatment 0.102 0.00752 0.48 0.08 0.00484 0.34 0.5814 0.9847 2066753 IFLab1_002419 COc1ccc(cc1)n2c(SCC(=O)NCCc3ccccc3)nc4CCSc4c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N22 compound treatment 0.18 0.0855 5.5 0.11 0.0348 2.43 5.6133 0.9327 2066754 IFLab1_002420 CCCC(=O)NCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N23 mock treatment 0.117 0.0225 1.45 0.079 0.00384 0.27 1.2146 0.8241 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 N24 mock treatment 0.109 0.0145 0.93 0.068 -0.00716 -0.5 0.3072 0.2899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O01 compound treatment 0.203 0.109 6.98 0.112 0.0368 2.57 6.7589 0.908 2066755 IFLab1_002421 O=C(N1CCCCC1)c2ccc3ncsc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O02 compound treatment 0.221 0.127 8.14 0.192 0.117 8.16 11.53 1.0 2066756 IFLab1_002422 O=C(COc1ccccc1)Nc2ccc(cc2)n3nncc3c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O03 compound treatment 0.113 0.0185 1.19 0.091 0.0158 1.11 1.6254 0.9993 1560385 IFLab1_002423 COC(=O)c1sc(cc1NC(=O)C2COc3ccccc3O2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O04 compound treatment 0.123 0.0285 1.84 0.098 0.0228 1.6 2.4263 0.9976 1284076 IFLab1_002424 COc1ccc(cc1)n2cc(c3ccccc3)c4c(SC)ncnc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O05 compound treatment 0.097 0.00252 0.16 0.08 0.00484 0.34 0.3538 0.9431 1188956 IFLab1_002425 CC(C)C(=O)Nc1c2CS(=O)(=O)Cc2nn1c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O06 compound treatment 0.785 0.691 44.45 0.703 0.628 43.86 62.4418 1.0 1159535 IFLab1_002426 COCCn1c(=O)c2ccccc2c3ccccc3c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O07 compound treatment 0.76 0.666 42.84 0.748 0.673 47.0 63.5269 0.9989 1651482 IFLab1_002427 COc1cccc(C(=O)Nc2c3CSCc3nn2c4ccc(F)cc4)c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O08 compound treatment 0.102 0.00752 0.48 0.078 0.00284 0.2 0.4826 0.9227 2066757 IFLab1_002428 CN1CCc2c(OCC(=O)N3CCCCCC3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O09 compound treatment 0.09 -0.00448 -0.29 0.086 0.0108 0.76 0.3316 0.409 2066758 IFLab1_002429 O=C(CSC1=NN2CCCC(=O)N=C2S1)N3CCC(Cc4ccccc4)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O10 compound treatment 0.132 0.0375 2.41 0.125 0.0498 3.48 4.1697 0.984 2066759 IFLab1_002430 CCN1CCc2c(OCc3ccc(C)cc3)cccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O11 compound treatment 0.149 0.0545 3.51 0.096 0.0208 1.46 3.5108 0.9241 1669221 IFLab1_002431 O=C(CSc1cn(Cc2ccccc2)c3ccccc13)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O12 compound treatment 0.577 0.483 31.06 0.043 -0.0322 -2.25 20.3722 0.6543 2066760 IFLab1_002432 CCCOc1cccc2C(=O)N(Cc3ccccc3)CCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O13 compound treatment 0.084 -0.0105 -0.67 0.072 -0.00316 -0.22 -0.6331 -0.8918 1539780 IFLab1_002433 Cn1cc(SCC(=O)Nc2ccc3OCCOc3c2)c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O14 compound treatment 0.092 -0.00248 -0.16 0.089 0.0138 0.97 0.5708 0.5823 2066761 IFLab1_002434 Clc1ccc(COc2cccc3C(=O)N(Cc4cccnc4)CCc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O15 compound treatment 0.192 0.0975 6.28 0.11 0.0348 2.43 6.1595 0.9149 1338499 IFLab1_002435 CCn1cc(SCC(=O)Nc2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O16 compound treatment 0.225 0.131 8.4 0.186 0.111 7.74 11.4157 0.9992 1234655 IFLab1_002436 Cc1ccc2NC(=O)CN(C(c3ccc(F)cc3)c2c1)C(=O)c4ccc(Br)o4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O17 compound treatment 0.289 0.195 12.52 0.232 0.157 10.96 16.6008 0.9978 1606138 IFLab1_002437 CCCn1cc(SCC(=O)Nc2cc(C)on2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O18 compound treatment 0.119 0.0245 1.58 0.1 0.0248 1.74 2.343 0.9989 1356340 IFLab1_002438 CCCCC(=O)N1CC(=O)Nc2ccc(F)cc2C1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O19 compound treatment 0.556 0.462 29.71 0.395 0.32 22.34 36.8047 0.9901 1446040 IFLab1_002439 O=C(CSc1c[nH]c2ccccc12)N3CCCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O20 compound treatment 0.096 0.00152 0.1 0.072 -0.00316 -0.22 -0.0869 -0.3604 1165282 IFLab1_002440 CC(C)C(=O)Nc1c2CS(=O)Cc2nn1C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O21 compound treatment 0.129 0.0345 2.22 0.089 0.0138 0.97 2.2548 0.9306 1658135 IFLab1_002441 CCSc1nnc(NC(=O)CSc2c[nH]c3ccccc23)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O22 compound treatment 0.089 -0.00548 -0.35 0.078 0.00284 0.2 -0.1091 -0.2694 1674962 IFLab1_002442 O=C(Nc1c2CS(=O)Cc2nn1c3ccccc3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O23 mock treatment 0.101 0.00652 0.42 0.078 0.00284 0.2 0.437 0.9417 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 O24 mock treatment 0.104 0.00952 0.61 0.073 -0.00216 -0.15 0.3266 0.5178 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P01 compound treatment 0.411 0.317 20.37 0.277 0.202 14.1 24.3763 0.9839 2066762 IFLab1_002443 CCCSc1nc2n(ncc2c(=O)[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P02 compound treatment 0.235 0.141 9.04 0.138 0.0628 4.39 9.4997 0.9449 1652304 IFLab1_002444 CCCSc1nc2c3ccccc3[nH]c2c(=O)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P03 compound treatment 0.13 0.0355 2.29 0.092 0.0168 1.18 2.4485 0.9523 2066763 IFLab1_002445 Cc1ccc(cc1)n2ncc3c(=O)[nH]c(SCC(=O)c4ccccc4)nc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P04 compound treatment 0.157 0.0625 4.02 0.114 0.0388 2.71 4.7641 0.9816 2066764 IFLab1_002446 COc1ccc(CC(=O)NCCSc2c[nH]c3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P05 compound treatment 0.139 0.0445 2.87 0.114 0.0388 2.71 3.9449 0.9996 1227813 IFLab1_002447 CCOC(=O)N1CCN(CC1)C(=O)CSc2c([nH]c3ccccc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P06 compound treatment 0.753 0.659 42.39 0.723 0.648 45.26 61.9734 0.9995 2066765 IFLab1_002448 CCOc1ccc(cc1)C(=O)NCCSc2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P07 compound treatment 0.085 -0.00948 -0.61 0.072 -0.00316 -0.22 -0.5876 -0.9053 1579426 IFLab1_002449 CCCNc1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P08 compound treatment 0.106 0.0115 0.74 0.087 0.0118 0.83 1.1092 0.9985 2066766 IFLab1_002450 O=C(NCCSc1c[nH]c2ccccc12)c3ccc(cc3)N4C(=O)CCC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P09 compound treatment 0.063 -0.0315 -2.03 0.057 -0.0182 -1.27 -2.3298 -0.9745 1427094 IFLab1_002451 C(CC1=CCCCC1)Nc2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P10 compound treatment 0.083 -0.0115 -0.74 0.068 -0.00716 -0.5 -0.8762 -0.9819 2066767 IFLab1_002452 CCC(=O)NCCSc1c(C)[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P11 compound treatment 0.081 -0.0135 -0.87 0.067 -0.00816 -0.57 -1.0166 -0.9792 1378306 IFLab1_002453 CN(C1CCCCC1)c2ncnc3[nH]cnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P12 compound treatment 0.087 -0.00748 -0.48 0.068 -0.00716 -0.5 -0.6941 -0.9998 2066768 IFLab1_002454 Cn1c(CNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P13 compound treatment 0.104 0.00952 0.61 0.077 0.00184 0.13 0.5242 0.8375 1589607 IFLab1_002455 CC1Cc2ccccc2N1c3ncnc4[nH]cnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P14 compound treatment 0.089 -0.00548 -0.35 0.073 -0.00216 -0.15 -0.3561 -0.9279 2066769 IFLab1_002456 CCn1c(CNC(=O)c2ccc(OC)c(OC)c2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P15 compound treatment 0.106 0.0115 0.74 0.087 0.0118 0.83 1.1092 0.9985 2066770 IFLab1_002457 CCN(CCCNc1ncnc2[nH]cnc12)c3cccc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P16 compound treatment 0.101 0.00652 0.42 0.075 -1.56E-4 -0.01 0.2888 0.6885 2066771 IFLab1_002458 CCCCn1c(CNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P17 compound treatment 0.089 -0.00548 -0.35 0.064 -0.0112 -0.78 -0.8007 -0.9358 2066772 IFLab1_002459 O=C(CSc1nc2CCSc2c(=O)n1c3ccccc3)NC4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P18 compound treatment 0.096 0.00152 0.1 0.074 -0.00116 -0.08 0.0119 0.0938 2066773 IFLab1_002460 CCC(=O)NCc1nc2ccccc2n1Cc3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P19 compound treatment 0.108 0.0135 0.87 0.081 0.00584 0.41 0.9038 0.9405 2066774 IFLab1_002461 CCC(Sc1nc2CCSc2c(=O)n1c3ccccc3)C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P20 compound treatment 0.103 0.00852 0.55 0.066 -0.00916 -0.64 -0.0647 -0.0768 1986829 IFLab1_002462 CC(=O)NCc1nc2ccccc2n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P21 compound treatment 0.076 -0.0185 -1.19 0.066 -0.00916 -0.64 -1.2936 -0.9576 2066775 IFLab1_002463 CCOc1ccc(cc1)n2c(SC(C)CC)nc3CCSc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P22 compound treatment 0.089 -0.00548 -0.35 0.073 -0.00216 -0.15 -0.3561 -0.9279 2066776 IFLab1_002464 CC(C)(C)C(=O)NCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P23 mock treatment 0.113 0.0185 1.19 0.079 0.00384 0.27 1.0326 0.8452 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1418 P24 mock treatment 0.095 5.16E-4 0.03 0.065 -0.0102 -0.71 -0.4782 -0.6733 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A01 compound treatment 0.095 0.0279 1.8 0.105 0.0432 3.02 3.4066 0.9691 2066777 IFLab1_002465 COCC(=O)NCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A02 compound treatment 0.068 9.06E-4 0.06 0.063 0.00125 0.09 0.103 0.9808 2066778 IFLab1_002466 CCCn1c(CCCNC(=O)CC)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A03 compound treatment 0.064 -0.00309 -0.2 0.062 2.5E-4 0.02 -0.1285 -0.6426 2066779 IFLab1_002467 CCn1c(nc2ccccc12)C(C)NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A04 compound treatment 0.078 0.0109 0.7 0.081 0.0193 1.34 1.4473 0.9541 2066780 IFLab1_002468 CCCCn1c(CCCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A05 compound treatment 0.067 -9.37E-5 -0.01 0.06 -0.00175 -0.12 -0.0907 -0.7411 2066781 IFLab1_002469 CCCCn1c(nc2ccccc12)C(C)NC(=O)CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A06 compound treatment 0.055 -0.0121 -0.78 0.062 2.5E-4 0.02 -0.5381 -0.6911 2066782 IFLab1_002470 C=CCn1c(CCCNC(=O)c2cccs2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A07 compound treatment 0.066 -0.00109 -0.07 0.056 -0.00575 -0.4 -0.3338 -0.8186 2066783 IFLab1_002471 CC(NC(=O)C)c1nc2ccccc2n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A08 compound treatment 0.076 0.00891 0.57 0.064 0.00225 0.16 0.5165 0.8689 2066784 IFLab1_002472 CC(=O)NC(c1nc2ccccc2[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A09 compound treatment 0.065 -0.00209 -0.13 0.057 -0.00475 -0.33 -0.3299 -0.9212 2066785 IFLab1_002473 COCC(=O)NC(C)c1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A10 compound treatment 0.066 -0.00109 -0.07 0.063 0.00125 0.09 0.012 0.1067 2066786 IFLab1_002474 O=C(CSc1oc(nc1S(=O)(=O)c2ccccc2)c3cccs3)NC4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A11 compound treatment 0.066 -0.00109 -0.07 0.057 -0.00475 -0.33 -0.2844 -0.8385 2066787 IFLab1_002475 Cn1c(CCNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A12 compound treatment 0.799 0.732 47.11 0.734 0.672 46.96 66.5192 1.0 2066788 IFLab1_002476 CCOC(=O)c1[nH]c2ccccc2c1NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A13 compound treatment 0.082 0.0149 0.96 0.058 -0.00375 -0.26 0.4932 0.4959 2066789 IFLab1_002477 CCC(=O)NCCc1nc2ccccc2n1C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A14 compound treatment 0.063 -0.00409 -0.26 0.057 -0.00475 -0.33 -0.421 -0.9935 2066790 IFLab1_002478 COc1ccc(cc1)c2nc3ccccn3c2NC(=O)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A15 compound treatment 0.063 -0.00409 -0.26 0.062 2.5E-4 0.02 -0.174 -0.6588 2066791 IFLab1_002479 Cc1ccccc1Cn2c(CCNC(=O)C(C)(C)C)nc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A16 compound treatment 0.065 -0.00209 -0.13 0.062 2.5E-4 0.02 -0.0829 -0.6104 2066792 IFLab1_002480 Cc1ccn2c(NC(=O)C3CC3)c(nc2c1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A17 compound treatment 0.061 -0.00609 -0.39 0.06 -0.00175 -0.12 -0.3638 -0.8855 2066793 IFLab1_002481 CC(C)(C)C(=O)NCCc1nc2ccccc2n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A18 compound treatment 0.06 -0.00709 -0.46 0.064 0.00225 0.16 -0.2117 -0.4384 2066794 IFLab1_002482 Clc1ccc(CS(=O)(=O)c2c[nH]c3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A19 compound treatment 0.058 -0.00909 -0.59 0.054 -0.00775 -0.54 -0.7967 -0.9992 2066795 IFLab1_002483 COCC(=O)NCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A20 compound treatment 0.073 0.00591 0.38 0.068 0.00625 0.44 0.5776 0.9976 2066796 IFLab1_002484 CCCn1cc(c2ccccc12)S(=O)(=O)CC(=O)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A21 compound treatment 0.055 -0.0121 -0.78 0.053 -0.00875 -0.61 -0.9827 -0.9928 2066797 IFLab1_002485 CCC(=O)NCCCc1nc2ccccc2n1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A22 compound treatment 0.066 -0.00109 -0.07 0.061 -7.5E-4 -0.05 -0.0868 -0.9894 2066798 IFLab1_002486 Clc1ccc(Cn2cc(c3ccccc23)S(=O)(=O)CC(=O)Nc4nccs4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A23 mock treatment 0.065 -0.00209 -0.13 0.058 -0.00375 -0.26 -0.2805 -0.9522 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 A24 mock treatment 0.062 -0.00509 -0.33 0.063 0.00125 0.09 -0.1701 -0.5013 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B01 compound treatment 0.102 0.0349 2.25 0.102 0.0403 2.81 3.577 0.9938 2066799 IFLab1_002487 Cc1ccc(cc1)c2nnc(SCC(=O)NC3CCCCC3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B02 compound treatment 0.156 0.0889 5.72 0.066 0.00425 0.3 4.2563 0.7428 2066800 IFLab1_002488 COc1ccc(CNCc2cn3c(nnc3s2)c4ccc(Br)cc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B03 compound treatment 0.088 0.0209 1.35 0.072 0.0103 0.72 1.4578 0.9564 2066801 IFLab1_002489 O=C(CSc1nnc(Cc2ccccc2)o1)N3CCN(CC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B04 compound treatment 0.075 0.00791 0.51 0.076 0.0143 1.0 1.0638 0.9515 2066802 IFLab1_002490 CCCC(=O)NCCc1cc2cc(C)c(C)cc2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B05 compound treatment 0.101 0.0339 2.18 0.086 0.0243 1.69 2.7411 0.9922 2066803 IFLab1_002491 O=C(CSc1ncnc2c3ccccc3oc12)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B06 compound treatment 0.072 0.00491 0.32 0.066 0.00425 0.3 0.4332 0.9995 2066804 IFLab1_002492 Cc1ccc2cc(CCNC(=O)C3CC3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B07 compound treatment 0.094 0.0269 1.73 0.07 0.00825 0.58 1.6321 0.8942 1987303 IFLab1_002493 O=C(CSc1ncnc2c3ccccc3oc12)NCCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B08 compound treatment 0.067 -9.37E-5 -0.01 0.06 -0.00175 -0.12 -0.0907 -0.7411 2066805 IFLab1_002494 CC(C)C(=O)NCCc1cc2ccc(C)cc2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B09 compound treatment 1.04 0.973 62.62 0.924 0.862 60.24 86.8735 0.9998 2066806 IFLab1_002495 COC(=O)C(C)Sc1ncnc2c3ccccc3oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B10 compound treatment 0.068 9.06E-4 0.06 0.066 0.00425 0.3 0.2512 0.8302 2066807 IFLab1_002496 COc1ccc2cc(CCNC(=O)/C=C\c3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B11 compound treatment 0.077 0.00991 0.64 0.069 0.00725 0.51 0.809 0.9935 2066808 IFLab1_002497 CCSc1nnc(NC(=O)CSc2nccn2c3ccccc3)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B12 compound treatment 0.063 -0.00409 -0.26 0.063 0.00125 0.09 -0.1246 -0.4488 2066809 IFLab1_002498 COc1ccc2cc(CCNC(=O)c3ccco3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B13 compound treatment 0.06 -0.00709 -0.46 0.057 -0.00475 -0.33 -0.5575 -0.9877 2066810 IFLab1_002499 O=C(CSc1nccn1c2ccccc2)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B14 compound treatment 0.064 -0.00309 -0.2 0.061 -7.5E-4 -0.05 -0.1779 -0.8638 2066811 IFLab1_002500 COc1ccc(cc1OC)C(=O)NCCc2cc3c(C)ccc(C)c3[nH]c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B15 compound treatment 0.061 -0.00609 -0.39 0.063 0.00125 0.09 -0.2156 -0.5365 2066812 IFLab1_002501 Cc1cc(C)cc(c1)n2ccnc2SCC(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B16 compound treatment 0.077 0.00991 0.64 0.067 0.00525 0.37 0.7102 0.9655 2066813 IFLab1_002502 Cc1ccc2cc(CCNC(=O)c3cc4ccccc4oc3=O)c(=O)[nH]c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B17 compound treatment 0.075 0.00791 0.51 0.078 0.0163 1.14 1.1626 0.9345 2066814 IFLab1_002503 CCOc1ccc(cc1)n2ccnc2SCC(=O)Nc3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B18 compound treatment 0.116 0.0489 3.15 0.12 0.0583 4.07 5.1033 0.9919 2066815 IFLab1_002504 O=C(Cc1ccccc1)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B19 compound treatment 0.115 0.0479 3.08 0.097 0.0352 2.46 3.9216 0.9938 2066816 IFLab1_002505 Cc1ccc(NC(=O)CSc2nccn2c3ccc(Cl)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B20 compound treatment 0.21 0.143 9.2 0.228 0.166 11.61 14.7166 0.9933 2066817 IFLab1_002506 O=C(NCCn1ccc2ccccc12)/C=C/c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B21 compound treatment 0.066 -0.00109 -0.07 0.061 -7.5E-4 -0.05 -0.0868 -0.9894 2066818 IFLab1_002507 CC(=O)Nc1ccc2n(C)c(=NC(=O)c3ccc(Br)s3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B22 compound treatment 0.396 0.329 21.17 0.287 0.225 15.74 26.0965 0.9893 2066819 IFLab1_002508 O=C(NCCn1ccc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B23 mock treatment 0.074 0.00691 0.44 0.065 0.00325 0.23 0.4749 0.9514 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 B24 mock treatment 0.062 -0.00509 -0.33 0.055 -0.00675 -0.47 -0.5653 -0.9842 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C01 compound treatment 0.082 0.0149 0.96 0.07 0.00825 0.58 1.086 0.9703 2066820 IFLab1_002509 O=C(Cc1ccccc1)NCc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C02 compound treatment 0.073 0.00591 0.38 0.066 0.00425 0.3 0.4788 0.9925 2066821 IFLab1_002510 CCCn1c(CCCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C03 compound treatment 0.066 -0.00109 -0.07 0.061 -7.5E-4 -0.05 -0.0868 -0.9894 2066822 IFLab1_002511 CCC(=O)NC(C)c1nc2ccccc2n1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C04 compound treatment 0.071 0.00391 0.25 0.065 0.00325 0.23 0.3383 0.9987 2066823 IFLab1_002512 CCCCn1c(CCCNC(=O)c2cccs2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C05 compound treatment 0.072 0.00491 0.32 0.065 0.00325 0.23 0.3838 0.9869 2066824 IFLab1_002513 CCCCn1c(nc2ccccc12)C(C)NC(=O)c3ccc(OC)c(OC)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C06 compound treatment 0.063 -0.00409 -0.26 0.059 -0.00275 -0.19 -0.3222 -0.9879 2066825 IFLab1_002514 CCC(=O)NCCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C07 compound treatment 0.063 -0.00409 -0.26 0.058 -0.00375 -0.26 -0.3716 -1.0 2066826 IFLab1_002515 CC(NC(=O)C(C)(C)C)c1nc2ccccc2n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C08 compound treatment 0.077 0.00991 0.64 0.057 -0.00475 -0.33 0.2162 0.3008 2066827 IFLab1_002516 Cn1c(nc2ccccc12)C(Cc3ccccc3)NC(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C09 compound treatment 0.062 -0.00509 -0.33 0.058 -0.00375 -0.26 -0.4171 -0.9938 1586768 IFLab1_002517 CC(NC(=O)c1ccccc1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C10 compound treatment 0.65 0.583 37.52 0.149 0.0872 6.1 30.8398 0.8113 2066828 IFLab1_002518 CSc1oc(nc1S(=O)(=O)c2ccccc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C11 compound treatment 0.061 -0.00609 -0.39 0.062 2.5E-4 0.02 -0.265 -0.675 2066829 IFLab1_002519 COc1ccc(cc1OC)C(=O)NCCc2nc3ccccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C12 compound treatment 0.08 0.0129 0.83 0.071 0.00925 0.65 1.0443 0.9923 2066830 IFLab1_002520 CCOC(=O)c1[nH]c2ccccc2c1NC(=O)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C13 compound treatment 0.062 -0.00509 -0.33 0.056 -0.00575 -0.4 -0.5159 -0.9949 2066831 IFLab1_002521 CC(C)n1c(CCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C14 compound treatment 0.069 0.00191 0.12 0.059 -0.00275 -0.19 -0.0491 -0.2153 2066832 IFLab1_002522 CCCCC(=O)Nc1c(nc2ccccn12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C15 compound treatment 0.067 -9.37E-5 -0.01 0.058 -0.00375 -0.26 -0.1895 -0.7232 2066833 IFLab1_002523 COCC(=O)NCCc1nc2ccccc2n1Cc3c(F)cccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C16 compound treatment 0.064 -0.00309 -0.2 0.061 -7.5E-4 -0.05 -0.1779 -0.8638 2066834 IFLab1_002524 O=C(CS(=O)(=O)c1c[nH]c2ccccc12)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C17 compound treatment 0.061 -0.00609 -0.39 0.053 -0.00875 -0.61 -0.7096 -0.977 2066835 IFLab1_002525 C=CCn1c(CCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C18 compound treatment 0.073 0.00591 0.38 0.07 0.00825 0.58 0.6763 0.9796 2066836 IFLab1_002526 FC(F)(F)c1ccc(CS(=O)(=O)c2c[nH]c3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C19 compound treatment 0.056 -0.0111 -0.71 0.056 -0.00575 -0.4 -0.7889 -0.963 2066837 IFLab1_002527 CCC(=O)NCCCc1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C20 compound treatment 0.07 0.00291 0.19 0.071 0.00925 0.65 0.5892 0.8758 2066838 IFLab1_002528 CCCn1cc(c2ccccc12)S(=O)(=O)CC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C21 compound treatment 0.055 -0.0121 -0.78 0.055 -0.00675 -0.47 -0.8839 -0.9712 2066839 IFLab1_002529 CCn1c(CCCNC(=O)c2cccc(C)c2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C22 compound treatment 0.063 -0.00409 -0.26 0.073 0.0113 0.79 0.3694 0.4457 2066840 IFLab1_002530 Clc1ccccc1Cn2cc(c3ccccc23)S(=O)(=O)CC(=O)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C23 mock treatment 0.062 -0.00509 -0.33 0.063 0.00125 0.09 -0.1701 -0.5013 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 C24 mock treatment 0.075 0.00791 0.51 0.064 0.00225 0.16 0.471 0.8843 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D01 compound treatment 0.111 0.0439 2.83 0.092 0.0302 2.11 3.4926 0.9897 2066841 IFLab1_002531 COc1ccccc1c2nnc(SCC(=O)NC3CCCCC3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D02 compound treatment 0.065 -0.00209 -0.13 0.071 0.00925 0.65 0.3616 0.5479 2066842 IFLab1_002532 C(NCc1ccccc1)c2cn3c(nnc3s2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D03 compound treatment 0.094 0.0269 1.73 0.082 0.0203 1.41 2.2249 0.995 2066843 IFLab1_002533 O=C(CSc1nnc(Cc2ccccc2)o1)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D04 compound treatment 0.074 0.00691 0.44 0.076 0.0143 1.0 1.0183 0.934 2066844 IFLab1_002534 Cc1cc2cc(CCNC(=O)CC3CCCCC3)c(=O)[nH]c2cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D05 compound treatment 0.095 0.0279 1.8 0.078 0.0163 1.14 2.0728 0.9755 2066845 IFLab1_002535 O=C(CSc1ncnc2c3ccccc3oc12)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D06 compound treatment 0.076 0.00891 0.57 0.078 0.0163 1.14 1.2081 0.9499 2066846 IFLab1_002536 Cc1ccc2cc(CCNC(=O)Cc3cccs3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D07 compound treatment 0.219 0.152 9.78 0.137 0.0752 5.26 10.6309 0.9576 2066847 IFLab1_002537 COc1cccc(NC(=O)CSc2ncnc3c4ccccc4oc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D08 compound treatment 0.075 0.00791 0.51 0.063 0.00125 0.09 0.4216 0.8165 2066848 IFLab1_002538 Cc1ccc2cc(CCNC(=O)c3ccco3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D09 compound treatment 0.094 0.0269 1.73 0.078 0.0163 1.14 2.0273 0.979 2066849 IFLab1_002539 O=C(CSc1ncnc2c3ccccc3oc12)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D10 compound treatment 0.06 -0.00709 -0.46 0.06 -0.00175 -0.12 -0.4093 -0.8659 2066850 IFLab1_002540 COc1ccc2cc(CCNC(=O)C3CC3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D11 compound treatment 0.056 -0.0111 -0.71 0.053 -0.00875 -0.61 -0.9371 -0.997 2066851 IFLab1_002541 O=C(CSc1nccn1c2ccccc2)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D12 compound treatment 0.066 -0.00109 -0.07 0.06 -0.00175 -0.12 -0.1362 -0.9656 2066852 IFLab1_002542 CCC(C(=O)NCCc1cc2ccc(OC)cc2[nH]c1=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D13 compound treatment 0.056 -0.0111 -0.71 0.055 -0.00675 -0.47 -0.8383 -0.9797 2066853 IFLab1_002543 Cc1cc(NC(=O)CSc2nccn2c3ccccc3)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D14 compound treatment 0.061 -0.00609 -0.39 0.061 -7.5E-4 -0.05 -0.3144 -0.7945 2066854 IFLab1_002544 Cc1ccc(C)c2[nH]c(=O)c(CCNC(=O)c3ccc4OCOc4c3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D15 compound treatment 0.071 0.00391 0.25 0.073 0.0113 0.79 0.7335 0.8889 2066855 IFLab1_002545 COc1cccc(c1)n2ccnc2SCC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D16 compound treatment 0.066 -0.00109 -0.07 0.062 2.5E-4 0.02 -0.0374 -0.516 2066856 IFLab1_002546 CCS(=O)(=O)NCCc1cc2ccc(C)cc2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D17 compound treatment 0.074 0.00691 0.44 0.061 -7.5E-4 -0.05 0.2773 0.6195 2066857 IFLab1_002547 CCOc1ccc(cc1)n2ccnc2SCC(=O)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D18 compound treatment 0.076 0.00891 0.57 0.071 0.00925 0.65 0.8623 0.9982 2066858 IFLab1_002548 COc1cc(cc(OC)c1OC)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D19 compound treatment 0.064 -0.00309 -0.2 0.061 -7.5E-4 -0.05 -0.1779 -0.8638 2066859 IFLab1_002549 Clc1ccc(cc1)n2ccnc2SCC(=O)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D20 compound treatment 0.07 0.00291 0.19 0.072 0.0103 0.72 0.6386 0.8629 2066860 IFLab1_002550 O=C(NCCn1ccc2ccccc12)C3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D21 compound treatment 0.059 -0.00809 -0.52 0.062 2.5E-4 0.02 -0.356 -0.683 2066861 IFLab1_002551 CC(=O)Nc1ccc2n(C)c(=NC(=O)c3ccc4ncsc4c3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D22 compound treatment 0.07 0.00291 0.19 0.099 0.0372 2.6 1.9724 0.756 2066862 IFLab1_002552 CC(C)C(=O)NCCn1ccc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D23 mock treatment 0.075 0.00791 0.51 0.061 -7.5E-4 -0.05 0.3228 0.631 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 D24 mock treatment 0.061 -0.00609 -0.39 0.058 -0.00375 -0.26 -0.4626 -0.9808 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E01 compound treatment 0.074 0.00691 0.44 0.08 0.0182 1.27 1.2158 0.9005 2066863 IFLab1_002553 O=C(NCc1nc2ccccc2[nH]1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E02 compound treatment 0.064 -0.00309 -0.2 0.058 -0.00375 -0.26 -0.326 -0.9908 2066864 IFLab1_002554 CCCn1c(CCCNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E03 compound treatment 0.064 -0.00309 -0.2 0.067 0.00525 0.37 0.1185 0.284 2066865 IFLab1_002555 CCn1c(nc2ccccc12)C(C)NC(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E04 compound treatment 0.068 9.06E-4 0.06 0.072 0.0103 0.72 0.5476 0.7622 2066866 IFLab1_002556 CC(=O)NCCCc1nc2ccccc2n1Cc3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E05 compound treatment 0.072 0.00491 0.32 0.064 0.00225 0.16 0.3344 0.9481 2066867 IFLab1_002557 CC(NC(=O)C)c1nc2ccccc2n1Cc3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E06 compound treatment 0.091 0.0239 1.54 0.067 0.00525 0.37 1.3474 0.8518 1986706 IFLab1_002558 CC(C)(C)C(=O)NCCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E07 compound treatment 0.069 0.00191 0.12 0.063 0.00125 0.09 0.1485 0.9861 2066868 IFLab1_002559 CC(NC(=O)c1ccccc1)c2nc3ccccc3n2CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E08 compound treatment 0.072 0.00491 0.32 0.064 0.00225 0.16 0.3344 0.9481 2066869 IFLab1_002560 Cn1c(nc2ccccc12)C(Cc3ccccc3)NC(=O)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E09 compound treatment 0.065 -0.00209 -0.13 0.06 -0.00175 -0.12 -0.1817 -0.9988 2066870 IFLab1_002561 COc1ccc(cc1OC)C(=O)NC(C)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E10 compound treatment 0.873 0.806 51.87 0.791 0.729 50.95 72.7029 1.0 2066871 IFLab1_002562 CCSc1oc(nc1S(=O)(=O)c2ccccc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E11 compound treatment 0.06 -0.00709 -0.46 0.058 -0.00375 -0.26 -0.5081 -0.9652 2066872 IFLab1_002563 CCn1c(CCNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E12 compound treatment 0.082 0.0149 0.96 0.093 0.0313 2.18 2.2221 0.9318 2066873 IFLab1_002564 CCOC(=O)c1[nH]c2ccccc2c1NC(=O)Cc3ccc(OCC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E13 compound treatment 0.064 -0.00309 -0.2 0.055 -0.00675 -0.47 -0.4742 -0.9265 2066874 IFLab1_002565 CC(C)n1c(CCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E14 compound treatment 0.086 0.0189 1.22 0.073 0.0113 0.79 1.4162 0.9776 2066875 IFLab1_002566 O=C(COc1ccccc1)Nc2c(nc3ccccn23)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E15 compound treatment 0.069 0.00191 0.12 0.06 -0.00175 -0.12 3.0E-4 0.0018 2066876 IFLab1_002567 COCC(=O)NCCc1nc2ccccc2n1Cc3cc(C)ccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E16 compound treatment 0.057 -0.0101 -0.65 0.054 -0.00775 -0.54 -0.8422 -0.9959 2066877 IFLab1_002568 O=C(CS(=O)(=O)c1c[nH]c2ccccc12)N3CCN(CC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E17 compound treatment 0.059 -0.00809 -0.52 0.057 -0.00475 -0.33 -0.603 -0.9763 2066878 IFLab1_002569 C=CCn1c(CCNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E18 compound treatment 0.062 -0.00509 -0.33 0.063 0.00125 0.09 -0.1701 -0.5013 2066879 IFLab1_002570 Cn1cc(c2ccccc12)S(=O)(=O)CC(=O)N3CCCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E19 compound treatment 0.052 -0.0151 -0.97 0.054 -0.00775 -0.54 -1.0698 -0.9619 2066880 IFLab1_002571 Cn1c(CCCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E20 compound treatment 0.073 0.00591 0.38 0.068 0.00625 0.44 0.5776 0.9976 2066881 IFLab1_002572 CCCn1cc(c2ccccc12)S(=O)(=O)CC(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E21 compound treatment 0.06 -0.00709 -0.46 0.05 -0.0118 -0.82 -0.9033 -0.9617 2066882 IFLab1_002573 CCn1c(CCCNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E22 compound treatment 0.075 0.00791 0.51 0.063 0.00125 0.09 0.4216 0.8165 2066883 IFLab1_002574 CCC1CCCCN1C(=O)CSc2nnc(o2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E23 mock treatment 0.067 -9.37E-5 -0.01 0.061 -7.5E-4 -0.05 -0.0413 -0.7834 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 E24 mock treatment 0.068 9.06E-4 0.06 0.058 -0.00375 -0.26 -0.144 -0.5365 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F01 compound treatment 0.089 0.0219 1.41 0.107 0.0452 3.16 3.2323 0.9338 2066884 IFLab1_002575 O=C(CSc1nnc(o1)c2cccs2)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F02 compound treatment 0.145 0.0779 5.01 0.129 0.0673 4.7 6.8678 0.9995 2066885 IFLab1_002576 CC(C)C(=O)Oc1c(c(C)nn1C(C)(C)C)S(=O)(=O)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F03 compound treatment 0.174 0.107 6.88 0.129 0.0673 4.7 8.1877 0.9827 2066886 IFLab1_002577 O=C(CSc1nnc(Cc2ccccc2)o1)N3CCCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F04 compound treatment 0.079 0.0119 0.77 0.068 0.00625 0.44 0.8506 0.9644 2066887 IFLab1_002578 COc1ccc(CC(=O)NCCc2cc3cc(C)c(C)cc3[nH]c2=O)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F05 compound treatment 0.385 0.318 20.46 0.389 0.327 22.86 30.6344 0.9985 2066888 IFLab1_002579 COc1ccc(NC(=O)CSc2ncnc3c4ccccc4oc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F06 compound treatment 0.072 0.00491 0.32 0.068 0.00625 0.44 0.532 0.9873 2066889 IFLab1_002580 Cc1ccc2cc(CCNC(=O)/C=C\c3ccc4OCOc4c3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F07 compound treatment 0.701 0.634 40.8 0.745 0.683 47.73 62.6023 0.997 2066890 IFLab1_002581 CSc1ncnc2c3ccccc3oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F08 compound treatment 0.084 0.0169 1.09 0.07 0.00825 0.58 1.177 0.9558 2066891 IFLab1_002582 COc1ccc(C(=O)NCCc2cc3ccc(C)cc3[nH]c2=O)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F09 compound treatment 0.078 0.0109 0.7 0.079 0.0173 1.21 1.3485 0.9669 2066892 IFLab1_002583 NC(=O)CSC1=NN2CCCC(=O)N=C2S1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F10 compound treatment 0.065 -0.00209 -0.13 0.067 0.00525 0.37 0.164 0.4198 2066893 IFLab1_002584 COc1ccc2cc(CCNC(=O)C3CCCC3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F11 compound treatment 0.059 -0.00809 -0.52 0.057 -0.00475 -0.33 -0.603 -0.9763 2066894 IFLab1_002585 CCOC(=O)c1ccc(NC(=O)CSc2nccn2c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F12 compound treatment 0.071 0.00391 0.25 0.063 0.00125 0.09 0.2395 0.9 2066895 IFLab1_002586 COc1ccc2cc(CCNC(=O)C(C)Oc3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F13 compound treatment 0.054 -0.0131 -0.84 0.052 -0.00975 -0.68 -1.0776 -0.9944 2066896 IFLab1_002587 CCc1ccc(NC(=O)CSc2nccn2c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F14 compound treatment 0.072 0.00491 0.32 0.07 0.00825 0.58 0.6308 0.9599 2066897 IFLab1_002588 CC(Oc1ccccc1)C(=O)NCCc2cc3c(C)ccc(C)c3[nH]c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F15 compound treatment 0.068 9.06E-4 0.06 0.064 0.00225 0.16 0.1524 0.9089 2066898 IFLab1_002589 COc1cccc(c1)n2ccnc2SCC(=O)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F16 compound treatment 0.073 0.00591 0.38 0.066 0.00425 0.3 0.4788 0.9925 2066899 IFLab1_002590 Cc1ccc2cc(CCNS(=O)(=O)c3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F17 compound treatment 0.065 -0.00209 -0.13 0.066 0.00425 0.3 0.1147 0.3516 2066900 IFLab1_002591 COc1ccc(NC(=O)CSc2nccn2c3ccc(F)cc3)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F18 compound treatment 0.902 0.835 53.74 0.88 0.818 57.16 78.4192 0.9995 2066901 IFLab1_002592 Clc1ccc(OCC(=O)NCCn2ccc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F19 compound treatment 0.169 0.102 6.56 0.153 0.0912 6.37 9.1456 0.9999 2066902 IFLab1_002593 COc1ccc(OC)c(NC(=O)CSc2nccn2c3ccc(Cl)cc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F20 compound treatment 0.145 0.0779 5.01 0.172 0.11 7.7 8.9919 0.9784 2066903 IFLab1_002594 Fc1cccc(F)c1C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F21 compound treatment 0.087 0.0199 1.28 0.062 2.5E-4 0.02 0.9183 0.7167 2066904 IFLab1_002595 Brc1cccc(c1)c2nnc3sc(CNCc4ccco4)cn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F22 compound treatment 0.509 0.442 28.44 0.537 0.475 33.2 43.589 0.997 2066905 IFLab1_002596 COc1ccc(C(=O)NCCn2ccc3ccccc23)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F23 mock treatment 0.061 -0.00609 -0.39 0.062 2.5E-4 0.02 -0.265 -0.675 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 F24 mock treatment 0.07 0.00291 0.19 0.063 0.00125 0.09 0.194 0.9398 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G01 compound treatment 0.078 0.0109 0.7 0.065 0.00325 0.23 0.6569 0.8904 2066906 IFLab1_002597 CC(NC(=O)C)c1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G02 compound treatment 0.068 9.06E-4 0.06 0.052 -0.00975 -0.68 -0.4404 -0.6442 2066907 IFLab1_002598 CC(C)n1c(CCCNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G03 compound treatment 0.061 -0.00609 -0.39 0.059 -0.00275 -0.19 -0.4132 -0.9461 2066908 IFLab1_002599 CCn1c(nc2ccccc12)C(C)NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G04 compound treatment 0.067 -9.37E-5 -0.01 0.063 0.00125 0.09 0.0575 0.6567 2066909 IFLab1_002600 CCC(=O)NCCCc1nc2ccccc2n1Cc3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G05 compound treatment 0.065 -0.00209 -0.13 0.063 0.00125 0.09 -0.0335 -0.2089 2066910 IFLab1_002601 CCC(=O)NC(C)c1nc2ccccc2n1Cc3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G06 compound treatment 0.06 -0.00709 -0.46 0.064 0.00225 0.16 -0.2117 -0.4384 2066911 IFLab1_002602 O=C(NCCCc1nc2ccccc2[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G07 compound treatment 0.066 -0.00109 -0.07 0.061 -7.5E-4 -0.05 -0.0868 -0.9894 2066912 IFLab1_002603 CC(NC(=O)Cc1ccccc1)c2nc3ccccc3n2CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G08 compound treatment 0.082 0.0149 0.96 0.073 0.0113 0.79 1.2342 0.9951 2066913 IFLab1_002604 CCn1c(nc2ccccc12)C(Cc3ccccc3)NC(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G09 compound treatment 0.056 -0.0111 -0.71 0.057 -0.00475 -0.33 -0.7396 -0.9392 2066914 IFLab1_002605 CCC(=O)NCCc1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G10 compound treatment 0.656 0.589 37.9 0.613 0.551 38.51 54.0337 1.0 2066915 IFLab1_002606 CSc1oc(nc1S(=O)(=O)c2ccc(F)cc2)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G11 compound treatment 0.064 -0.00309 -0.2 0.057 -0.00475 -0.33 -0.3754 -0.9702 2066916 IFLab1_002607 CCC(=O)NCCc1nc2ccccc2n1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G12 compound treatment 0.097 0.0299 1.92 0.075 0.0133 0.93 2.0156 0.9437 2066917 IFLab1_002608 Fc1ccc(cc1)c2nc3ccccn3c2NC(=O)COc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G13 compound treatment 0.067 -9.37E-5 -0.01 0.064 0.00225 0.16 0.1069 0.6795 2066918 IFLab1_002609 CCCCn1c(CCNC(=O)CC)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G14 compound treatment 0.087 0.0199 1.28 0.081 0.0193 1.34 1.8569 0.9997 2066919 IFLab1_002610 O=C(Nc1c(nc2ccccn12)c3cccs3)/C=C\c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G15 compound treatment 0.063 -0.00409 -0.26 0.06 -0.00175 -0.12 -0.2728 -0.939 2066920 IFLab1_002611 CC(C)(C)C(=O)NCCc1nc2ccccc2n1Cc3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G16 compound treatment 0.067 -9.37E-5 -0.01 0.057 -0.00475 -0.33 -0.2389 -0.7198 2066921 IFLab1_002612 O=C(CS(=O)(=O)c1c[nH]c2ccccc12)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G17 compound treatment 0.058 -0.00909 -0.59 0.058 -0.00375 -0.26 -0.5991 -0.9343 2066922 IFLab1_002613 COc1ccc(cc1OC)C(=O)NCCc2nc3ccccc3n2CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G18 compound treatment 0.061 -0.00609 -0.39 0.058 -0.00375 -0.26 -0.4626 -0.9808 2066923 IFLab1_002614 Cn1cc(c2ccccc12)S(=O)(=O)CC(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G19 compound treatment 0.052 -0.0151 -0.97 0.049 -0.0127 -0.89 -1.3168 -0.9991 2066924 IFLab1_002615 Cn1c(CCCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G20 compound treatment 0.062 -0.00509 -0.33 0.067 0.00525 0.37 0.0275 0.0559 2066925 IFLab1_002616 COc1ccc(NC(=O)CS(=O)(=O)c2cn(Cc3cccc(F)c3)c4ccccc24)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G21 compound treatment 0.06 -0.00709 -0.46 0.052 -0.00975 -0.68 -0.8045 -0.9811 2066926 IFLab1_002617 CCn1c(CCCNC(=O)c2ccc(Cl)cc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G22 compound treatment 0.061 -0.00609 -0.39 0.059 -0.00275 -0.19 -0.4132 -0.9461 2066927 IFLab1_002618 O=C(CSc1nnc(o1)c2ccccc2)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G23 mock treatment 0.065 -0.00209 -0.13 0.062 2.5E-4 0.02 -0.0829 -0.6104 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 G24 mock treatment 0.063 -0.00409 -0.26 0.061 -7.5E-4 -0.05 -0.2234 -0.8314 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H01 compound treatment 0.098 0.0309 1.99 0.083 0.0213 1.48 2.4563 0.9896 2066928 IFLab1_002619 O=C(CSc1nnc(o1)c2ccco2)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H02 compound treatment 0.039 -0.0281 -1.81 0.041 -0.0208 -1.45 -2.3036 -0.994 2066929 IFLab1_002620 Cc1nn(c(OC(=O)C2CC2)c1S(=O)(=O)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H03 compound treatment 0.116 0.0489 3.15 0.109 0.0473 3.3 4.5599 0.9997 2066930 IFLab1_002621 CC1CC(C)CN(C1)C(=O)CSc2nnc(Cc3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H04 compound treatment 0.069 0.00191 0.12 0.067 0.00525 0.37 0.3461 0.8949 2066931 IFLab1_002622 CCCC(=O)NCCc1cc2c(OC)ccc(OC)c2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H05 compound treatment 0.219 0.152 9.78 0.175 0.113 7.91 12.5081 0.9945 2066932 IFLab1_002623 Cc1cccc(NC(=O)CSc2ncnc3c4ccccc4oc23)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H06 compound treatment 0.074 0.00691 0.44 0.074 0.0123 0.86 0.9195 0.9534 2066933 IFLab1_002624 Cc1ccc2cc(CCNC(=O)C3CCCC3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H07 compound treatment 0.945 0.878 56.51 1.026 0.964 67.36 87.5884 0.9962 2066934 IFLab1_002625 CCSc1ncnc2c3ccccc3oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H08 compound treatment 0.069 0.00191 0.12 0.061 -7.5E-4 -0.05 0.0497 0.3726 2066935 IFLab1_002626 Cc1ccc2cc(CCNC(=O)CCC3CCCC3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H09 compound treatment 0.084 0.0169 1.09 0.07 0.00825 0.58 1.177 0.9558 2066936 IFLab1_002627 O=C(CSC1=NN2CCCC(=O)N=C2S1)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H10 compound treatment 0.08 0.0129 0.83 0.076 0.0143 1.0 1.2913 0.996 2066937 IFLab1_002628 COc1ccc2cc(CCNC(=O)c3cccc(c3)C(F)(F)F)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H11 compound treatment 0.053 -0.0141 -0.91 0.054 -0.00775 -0.54 -1.0243 -0.9696 2066938 IFLab1_002629 Cc1cccc(NC(=O)CSc2nccn2c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H12 compound treatment 0.071 0.00391 0.25 0.079 0.0173 1.21 1.0299 0.8366 2066939 IFLab1_002630 COc1ccc2cc(CCNC(=O)CCCc3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H13 compound treatment 0.05 -0.0171 -1.1 0.049 -0.0127 -0.89 -1.4078 -0.9945 2066940 IFLab1_002631 O=C(CSc1nccn1c2ccccc2)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H14 compound treatment 0.071 0.00391 0.25 0.071 0.00925 0.65 0.6347 0.9154 2066941 IFLab1_002632 COc1cc(OC)cc(c1)C(=O)NCCc2cc3ccc(C)c(C)c3[nH]c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H15 compound treatment 0.067 -9.37E-5 -0.01 0.06 -0.00175 -0.12 -0.0907 -0.7411 2066942 IFLab1_002633 COc1cccc(c1)n2ccnc2SCC(=O)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H16 compound treatment 0.056 -0.0111 -0.71 0.059 -0.00275 -0.19 -0.6408 -0.8665 2066943 IFLab1_002634 COc1ccc2cc(CCNS(=O)(=O)C)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H17 compound treatment 0.071 0.00391 0.25 0.064 0.00225 0.16 0.2889 0.9744 2066944 IFLab1_002635 Fc1ccc(cc1)n2ccnc2SCC(=O)Nc3ccc4OCCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H18 compound treatment 0.804 0.737 47.43 0.747 0.685 47.87 67.389 1.0 2066945 IFLab1_002636 CCOc1ccccc1C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H19 compound treatment 0.062 -0.00509 -0.33 0.066 0.00425 0.3 -0.0219 -0.0495 2066946 IFLab1_002637 Clc1ccc(cc1)n2ccnc2SCC(=O)NC3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H20 compound treatment 0.067 -9.37E-5 -0.01 0.073 0.0113 0.79 0.5515 0.7017 2066947 IFLab1_002638 Clc1ccc(C(=O)NCCn2ccc3ccccc23)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H21 compound treatment 0.064 -0.00309 -0.2 0.065 0.00325 0.23 0.0197 0.0654 2066948 IFLab1_002639 CC1CCCCN1Cc2cn3c(nnc3s2)c4ccc(Br)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H22 compound treatment 0.205 0.138 8.88 0.213 0.151 10.57 13.748 0.9962 2066949 IFLab1_002640 O=C(NCCn1ccc2ccccc12)c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H23 mock treatment 0.066 -0.00109 -0.07 0.055 -0.00675 -0.47 -0.3832 -0.8038 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 H24 mock treatment 0.063 -0.00409 -0.26 0.059 -0.00275 -0.19 -0.3222 -0.9879 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I01 compound treatment 0.066 -0.00109 -0.07 0.068 0.00625 0.44 0.259 0.5855 2066950 IFLab1_002641 CCC(=O)NC(C)c1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I02 compound treatment 0.071 0.00391 0.25 0.069 0.00725 0.51 0.5359 0.9478 2066951 IFLab1_002642 CCC(=O)NCCCc1nc2ccccc2n1C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I03 compound treatment 0.061 -0.00609 -0.39 0.072 0.0103 0.72 0.229 0.2805 2066952 IFLab1_002643 CCCn1c(nc2ccccc12)C(C)NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I04 compound treatment 0.068 9.06E-4 0.06 0.061 -7.5E-4 -0.05 0.0042 0.0535 2066953 IFLab1_002644 CC(C)Cn1c(CCCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I05 compound treatment 0.075 0.00791 0.51 0.069 0.00725 0.51 0.718 1.0 2066954 IFLab1_002645 CC(NC(=O)C(C)(C)C)c1nc2ccccc2n1Cc3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I06 compound treatment 0.075 0.00791 0.51 0.065 0.00325 0.23 0.5204 0.9339 2066955 IFLab1_002646 Cc1cccc(c1)C(=O)NCCCc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I07 compound treatment 0.07 0.00291 0.19 0.062 2.5E-4 0.02 0.1446 0.7698 2066956 IFLab1_002647 COCC(=O)NC(C)c1nc2ccccc2n1CC(=C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I08 compound treatment 0.068 9.06E-4 0.06 0.094 0.0323 2.25 1.6343 0.7252 2066957 IFLab1_002648 CCn1c(nc2ccccc12)C(Cc3ccccc3)NC(=O)COC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I09 compound treatment 0.075 0.00791 0.51 0.068 0.00625 0.44 0.6686 0.9971 2066958 IFLab1_002649 CCCC(=O)NCCc1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I10 compound treatment 0.115 0.0479 3.08 0.092 0.0302 2.11 3.6747 0.983 2066959 IFLab1_002650 CCCCC(=O)Nc1c([nH]c2ccccc12)C(=O)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I11 compound treatment 0.069 0.00191 0.12 0.068 0.00625 0.44 0.3955 0.872 2066960 IFLab1_002651 CCn1c(CCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I12 compound treatment 0.07 0.00291 0.19 0.067 0.00525 0.37 0.3916 0.9512 2066961 IFLab1_002652 CC(C)CC(=O)Nc1c(nc2ccccn12)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I13 compound treatment 0.069 0.00191 0.12 0.058 -0.00375 -0.26 -0.0985 -0.3404 2066962 IFLab1_002653 CCCCn1c(CCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I14 compound treatment 0.07 0.00291 0.19 0.07 0.00825 0.58 0.5398 0.8909 2066963 IFLab1_002654 Fc1cccc(F)c1C(=O)Nc2c(nc3ccccn23)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I15 compound treatment 0.071 0.00391 0.25 0.065 0.00325 0.23 0.3383 0.9987 2066964 IFLab1_002655 CC(C)Cn1c(CCNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I16 compound treatment 0.072 0.00491 0.32 0.069 0.00725 0.51 0.5814 0.9741 2066965 IFLab1_002656 Cc1cccc(NC(=O)CS(=O)(=O)c2c[nH]c3ccccc23)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I17 compound treatment 0.062 -0.00509 -0.33 0.057 -0.00475 -0.33 -0.4665 -1.0 2066966 IFLab1_002657 CCCC(=O)NCCc1nc2ccccc2n1CC(=C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I18 compound treatment 0.073 0.00591 0.38 0.064 0.00225 0.16 0.38 0.9236 2066967 IFLab1_002658 Cn1cc(c2ccccc12)S(=O)(=O)CC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I19 compound treatment 0.058 -0.00909 -0.59 0.056 -0.00575 -0.4 -0.6979 -0.9831 2066968 IFLab1_002659 Cn1c(CCCNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I20 compound treatment 0.068 9.06E-4 0.06 0.072 0.0103 0.72 0.5476 0.7622 2066969 IFLab1_002660 Fc1ccc(Cn2cc(c3ccccc23)S(=O)(=O)CC(=O)N4CCCCC4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I21 compound treatment 0.054 -0.0131 -0.84 0.053 -0.00875 -0.61 -1.0282 -0.9876 2066970 IFLab1_002661 CCn1c(CCCNC(=O)c2ccc(OC)c(OC)c2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I22 compound treatment 0.091 0.0239 1.54 0.098 0.0362 2.53 2.8787 0.9715 2066971 IFLab1_002662 O=C(CSc1nnc(o1)c2ccccc2)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I23 mock treatment 0.062 -0.00509 -0.33 0.061 -7.5E-4 -0.05 -0.2689 -0.8098 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 I24 mock treatment 0.067 -9.37E-5 -0.01 0.061 -7.5E-4 -0.05 -0.0413 -0.7834 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J01 compound treatment 0.116 0.0489 3.15 0.103 0.0413 2.88 4.2635 0.999 2066972 IFLab1_002663 CC1CCCN(C1)C(=O)CSc2nnc(o2)c3ccc(Cl)s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J02 compound treatment 0.092 0.0249 1.6 0.086 0.0243 1.69 2.3315 0.9996 2066973 IFLab1_002664 CC(=O)Nc1nnc(o1)c2ccc3CCCCc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J03 compound treatment 0.074 0.00691 0.44 0.077 0.0153 1.07 1.0676 0.9249 2066974 IFLab1_002665 Clc1ccc(OCc2nnc(SCC(=O)N3CCc4ccccc34)o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J04 compound treatment 0.077 0.00991 0.64 0.072 0.0103 0.72 0.9572 0.9983 2066975 IFLab1_002666 COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)CC3CCCCC3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J05 compound treatment 0.314 0.247 15.89 0.285 0.223 15.6 22.2656 1.0 2066976 IFLab1_002667 O=C(CSc1ncnc2c3ccccc3oc12)NC4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J06 compound treatment 0.072 0.00491 0.32 0.075 0.0133 0.93 0.8778 0.8975 2066977 IFLab1_002668 COc1ccc(Cl)cc1C(=O)NCCc2cc3ccc(C)cc3[nH]c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J07 compound treatment 0.749 0.682 43.89 1.028 0.966 67.5 78.7667 0.9783 2066978 IFLab1_002669 CCCSc1ncnc2c3ccccc3oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J08 compound treatment 0.074 0.00691 0.44 0.07 0.00825 0.58 0.7219 0.9918 2066979 IFLab1_002670 CCC(=O)NCCc1cc2ccc(C)cc2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J09 compound treatment 0.095 0.0279 1.8 0.093 0.0313 2.18 2.8138 0.9953 2066980 IFLab1_002671 O=C(CSC1=NN2CCCC(=O)N=C2S1)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J10 compound treatment 0.071 0.00391 0.25 0.057 -0.00475 -0.33 -0.0569 -0.1366 2066981 IFLab1_002672 COc1ccc2cc(CCNC(=O)CC(C)C)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J11 compound treatment 0.059 -0.00809 -0.52 0.054 -0.00775 -0.54 -0.7512 -0.9998 2066982 IFLab1_002673 CCOc1ccc(NC(=O)CSc2nccn2c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J12 compound treatment 0.074 0.00691 0.44 0.073 0.0113 0.79 0.8701 0.9636 2066983 IFLab1_002674 COc1cccc(C(=O)NCCc2cc3c(C)ccc(C)c3[nH]c2=O)c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J13 compound treatment 0.059 -0.00809 -0.52 0.052 -0.00975 -0.68 -0.85 -0.9912 2066984 IFLab1_002675 COc1cccc(NC(=O)CSc2nccn2c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J14 compound treatment 0.085 0.0179 1.15 0.07 0.00825 0.58 1.2225 0.9487 2066985 IFLab1_002676 CCOc1ccccc1C(=O)NCCc2cc3ccc(C)c(C)c3[nH]c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J15 compound treatment 0.061 -0.00609 -0.39 0.054 -0.00775 -0.54 -0.6602 -0.9875 2066986 IFLab1_002677 COc1ccc(cc1)n2ccnc2SCC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J16 compound treatment 0.061 -0.00609 -0.39 0.06 -0.00175 -0.12 -0.3638 -0.8855 2066987 IFLab1_002678 CCS(=O)(=O)NCCc1cc2ccc(OC)cc2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J17 compound treatment 0.274 0.207 13.32 0.163 0.101 7.07 14.4185 0.9562 2066988 IFLab1_002679 COc1ccc(OC)c(NC(=O)CSc2nccn2c3cccc(Cl)c3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J18 compound treatment 0.571 0.504 32.43 0.462 0.4 27.96 42.7059 0.9973 2066989 IFLab1_002680 O=C(NCCn1ccc2ccccc12)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J19 compound treatment 0.07 0.00291 0.19 0.088 0.0262 1.83 1.429 0.7752 1410330 IFLab1_002681 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)Nc2nc3c(F)cc(F)cc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J20 compound treatment 0.288 0.221 14.22 0.467 0.405 28.31 30.0728 0.9492 2066990 IFLab1_002682 O=C(NCCn1ccc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J21 compound treatment 0.062 -0.00509 -0.33 0.064 0.00225 0.16 -0.1207 -0.3319 2066991 IFLab1_002683 Brc1ccc(cc1)c2nnc3sc(CN4CCCCCC4)cn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J22 compound treatment 0.165 0.0979 6.3 0.194 0.132 9.24 10.9889 0.9826 2066992 IFLab1_002684 CC(Oc1ccccc1)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J23 mock treatment 0.074 0.00691 0.44 0.064 0.00225 0.16 0.4255 0.9024 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 J24 mock treatment 0.069 0.00191 0.12 0.07 0.00825 0.58 0.4943 0.8388 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K01 compound treatment 0.072 0.00491 0.32 0.071 0.00925 0.65 0.6802 0.9458 2066993 IFLab1_002685 CC(NC(=O)C(C)(C)C)c1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K02 compound treatment 0.067 -9.37E-5 -0.01 0.068 0.00625 0.44 0.3045 0.6973 2066994 IFLab1_002686 CC(C)n1c(CCCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K03 compound treatment 0.067 -9.37E-5 -0.01 0.062 2.5E-4 0.02 0.0081 0.4374 2066995 IFLab1_002687 CCCn1c(nc2ccccc12)C(C)NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K04 compound treatment 0.064 -0.00309 -0.2 0.061 -7.5E-4 -0.05 -0.1779 -0.8638 2066996 IFLab1_002688 CC(=O)NCCCc1nc2ccccc2n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K05 compound treatment 0.075 0.00791 0.51 0.068 0.00625 0.44 0.6686 0.9971 2066997 IFLab1_002689 CC(NC(=O)C)c1nc2ccccc2n1Cc3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K06 compound treatment 0.068 9.06E-4 0.06 0.064 0.00225 0.16 0.1524 0.9089 2066998 IFLab1_002690 O=C(Cc1ccccc1)NCCCc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K07 compound treatment 0.06 -0.00709 -0.46 0.066 0.00425 0.3 -0.1129 -0.2073 2066999 IFLab1_002691 CC(NC(=O)C)c1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K08 compound treatment 0.077 0.00991 0.64 0.065 0.00325 0.23 0.6114 0.9033 2067000 IFLab1_002692 CCCn1c(nc2ccccc12)C(Cc3ccccc3)NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K09 compound treatment 0.062 -0.00509 -0.33 0.061 -7.5E-4 -0.05 -0.2689 -0.8098 2067001 IFLab1_002693 Cn1c(CCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K10 compound treatment 0.217 0.15 9.65 0.169 0.107 7.49 12.1206 0.9922 2067002 IFLab1_002694 CCOC(=O)c1[nH]c2ccccc2c1NC(=O)COc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K11 compound treatment 0.072 0.00491 0.32 0.062 2.5E-4 0.02 0.2356 0.7451 2067003 IFLab1_002695 CCn1c(CCNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K12 compound treatment 0.072 0.00491 0.32 0.064 0.00225 0.16 0.3344 0.9481 2067004 IFLab1_002696 CCC(=O)Nc1c(nc2ccccn12)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K13 compound treatment 0.065 -0.00209 -0.13 0.058 -0.00375 -0.26 -0.2805 -0.9522 2067005 IFLab1_002697 CCCCn1c(CCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K14 compound treatment 0.064 -0.00309 -0.2 0.062 2.5E-4 0.02 -0.1285 -0.6426 2067006 IFLab1_002698 CC(C)(C)CC(=O)Nc1c(nc2ccccn12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K15 compound treatment 0.061 -0.00609 -0.39 0.063 0.00125 0.09 -0.2156 -0.5365 2067007 IFLab1_002699 CC(C)Cn1c(CCNC(=O)C(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K16 compound treatment 0.065 -0.00209 -0.13 0.057 -0.00475 -0.33 -0.3299 -0.9212 2067008 IFLab1_002700 O=C(CS(=O)(=O)c1c[nH]c2ccccc12)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K17 compound treatment 0.065 -0.00209 -0.13 0.056 -0.00575 -0.4 -0.3793 -0.8953 2067009 IFLab1_002701 CC(=C)Cn1c(CCNC(=O)c2cccs2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K18 compound treatment 0.066 -0.00109 -0.07 0.073 0.0113 0.79 0.506 0.6412 2067010 IFLab1_002702 Cn1cc(c2ccccc12)S(=O)(=O)CC(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K19 compound treatment 0.046 -0.0211 -1.36 0.047 -0.0147 -1.03 -1.6887 -0.9907 2067011 IFLab1_002703 COc1ccc(cc1OC)C(=O)NCCCc2nc3ccccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K20 compound treatment 0.064 -0.00309 -0.2 0.068 0.00625 0.44 0.1679 0.3499 2067012 IFLab1_002704 Fc1ccc(Cn2cc(c3ccccc23)S(=O)(=O)CC(=O)NC4CCCCC4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K21 compound treatment 0.059 -0.00809 -0.52 0.052 -0.00975 -0.68 -0.85 -0.9912 2067013 IFLab1_002705 CCn1c(CCCNC(=O)c2cccs2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K22 compound treatment 0.073 0.00591 0.38 0.058 -0.00375 -0.26 0.0836 0.181 2067014 IFLab1_002706 O=C(CSc1nnc(o1)c2ccccc2)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K23 mock treatment 0.071 0.00391 0.25 0.059 -0.00275 -0.19 0.0419 0.1325 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 K24 mock treatment 0.062 -0.00509 -0.33 0.069 0.00725 0.51 0.1263 0.2093 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L01 compound treatment 0.089 0.0219 1.41 0.085 0.0233 1.62 2.1455 0.9975 2067015 IFLab1_002707 Clc1cccc(c1)c2nnc(SCC(=O)NC3CCCCC3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L02 compound treatment 0.04 -0.0271 -1.74 0.063 0.00125 0.09 -1.1714 -0.6709 2067016 IFLab1_002708 O=C(Nc1nnc(o1)c2ccc3CCCCc3c2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L03 compound treatment 0.795 0.728 46.85 0.811 0.749 52.34 70.1408 0.9985 2067017 IFLab1_002709 CC1CC(C)CN(C1)C(=O)CSc2nnc(COc3ccc(Cl)cc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L04 compound treatment 0.093 0.0259 1.67 0.071 0.00925 0.65 1.636 0.9148 2067018 IFLab1_002710 COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)c3ccc(F)c(F)c3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L05 compound treatment 0.08 0.0129 0.83 0.073 0.0113 0.79 1.1431 0.9996 2067019 IFLab1_002711 O=C(CSc1ncnc2c3ccccc3oc12)Nc4nccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L06 compound treatment 0.071 0.00391 0.25 0.065 0.00325 0.23 0.3383 0.9987 2067020 IFLab1_002712 CC(C)CC(=O)NCCc1cc2ccc(C)cc2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L07 compound treatment 1.296 1.23 79.1 1.25 1.19 83.01 114.6287 0.9997 2067021 IFLab1_002713 CC(C)Sc1ncnc2c3ccccc3oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L08 compound treatment 0.072 0.00491 0.32 0.062 2.5E-4 0.02 0.2356 0.7451 2067022 IFLab1_002714 Cc1ccc2cc(CCNC(=O)CCCc3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L09 compound treatment 0.197 0.13 8.36 0.172 0.11 7.7 11.3586 0.9992 2067023 IFLab1_002715 O=C1CCCN2N=C(SC/C=C/c3ccccc3)SC2=N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L10 compound treatment 0.077 0.00991 0.64 0.064 0.00225 0.16 0.562 0.8558 2067024 IFLab1_002716 COc1ccc2cc(CCNC(=O)C)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L11 compound treatment 0.057 -0.0101 -0.65 0.049 -0.0127 -0.89 -1.0892 -0.988 2067025 IFLab1_002717 O=C(CSc1nccn1c2ccccc2)Nc3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L12 compound treatment 0.078 0.0109 0.7 0.076 0.0143 1.0 1.2003 0.9854 2067026 IFLab1_002718 Cc1ccc(C)c2[nH]c(=O)c(CCNC(=O)c3cccs3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L13 compound treatment 0.061 -0.00609 -0.39 0.058 -0.00375 -0.26 -0.4626 -0.9808 2067027 IFLab1_002719 CCOc1ccccc1NC(=O)CSc2nccn2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L14 compound treatment 0.069 0.00191 0.12 0.069 0.00725 0.51 0.4449 0.8537 2067028 IFLab1_002720 Cc1ccc2cc(CCNC(=O)CCc3ccccc3)c(=O)[nH]c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L15 compound treatment 0.067 -9.37E-5 -0.01 0.061 -7.5E-4 -0.05 -0.0413 -0.7834 2067029 IFLab1_002721 COc1ccc(cc1)n2ccnc2SCC(=O)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L16 compound treatment 0.063 -0.00409 -0.26 0.061 -7.5E-4 -0.05 -0.2234 -0.8314 2067030 IFLab1_002722 Cc1ccc(C)c2[nH]c(=O)c(CCNS(=O)(=O)C)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L17 compound treatment 0.075 0.00791 0.51 0.065 0.00325 0.23 0.5204 0.9339 2067031 IFLab1_002723 Clc1cccc(c1)n2ccnc2SCC(=O)NC3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L18 compound treatment 0.073 0.00591 0.38 0.086 0.0243 1.69 1.4667 0.8448 2067032 IFLab1_002724 O=C(NCCn1ccc2ccccc12)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L19 compound treatment 0.063 -0.00409 -0.26 0.068 0.00625 0.44 0.1224 0.2401 2067033 IFLab1_002725 Fc1cccc2sc(NC(=O)c3cccs3)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L20 compound treatment 0.25 0.183 11.77 0.248 0.186 13.01 17.525 0.9988 2067034 IFLab1_002726 Brc1ccc(o1)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L21 compound treatment 0.066 -0.00109 -0.07 0.06 -0.00175 -0.12 -0.1362 -0.9656 2067035 IFLab1_002727 CCOC(=O)C1CCN(Cc2cn3c(nnc3s2)c4ccc(Br)cc4)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L22 compound treatment 0.088 0.0209 1.35 0.088 0.0262 1.83 2.2482 0.9884 2067036 IFLab1_002728 O=C(NCCn1ccc2ccccc12)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L23 mock treatment 0.069 0.00191 0.12 0.067 0.00525 0.37 0.3461 0.8949 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 L24 mock treatment 0.072 0.00491 0.32 0.058 -0.00375 -0.26 0.0381 0.0927 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M01 compound treatment 0.087 0.0199 1.28 0.072 0.0103 0.72 1.4123 0.9622 2067037 IFLab1_002729 COCC(=O)NC(C)c1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M02 compound treatment 0.077 0.00991 0.64 0.059 -0.00275 -0.19 0.315 0.473 2067038 IFLab1_002730 CCCCn1c(CCCNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M03 compound treatment 0.069 0.00191 0.12 0.064 0.00225 0.16 0.1979 0.9925 2067039 IFLab1_002731 CC(C)n1c(nc2ccccc12)C(C)NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M04 compound treatment 0.063 -0.00409 -0.26 0.054 -0.00775 -0.54 -0.5692 -0.9452 2067040 IFLab1_002732 CC(C)(C)C(=O)NCCCc1nc2ccccc2n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M05 compound treatment 0.084 0.0169 1.09 0.069 0.00725 0.51 1.1276 0.9395 2067041 IFLab1_002733 CCC(=O)NC(C)c1nc2ccccc2n1Cc3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M06 compound treatment 0.067 -9.37E-5 -0.01 0.062 2.5E-4 0.02 0.0081 0.4374 2067042 IFLab1_002734 COc1ccc(cc1OC)C(=O)NCCCc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M07 compound treatment 0.063 -0.00409 -0.26 0.065 0.00325 0.23 -0.0258 -0.0741 2067043 IFLab1_002735 CCC(=O)NC(C)c1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M08 compound treatment 0.09 0.0229 1.47 0.075 0.0133 0.93 1.6971 0.9748 2067044 IFLab1_002736 CCCCn1c(nc2ccccc12)C(Cc3ccccc3)NC(=O)COC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M09 compound treatment 0.066 -0.00109 -0.07 0.061 -7.5E-4 -0.05 -0.0868 -0.9894 2067045 IFLab1_002737 COCC(=O)NCCc1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M10 compound treatment 0.112 0.0449 2.89 0.083 0.0213 1.48 3.0935 0.9521 2067046 IFLab1_002738 CCOC(=O)c1[nH]c2ccccc2c1NC(=O)CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M11 compound treatment 0.064 -0.00309 -0.2 0.063 0.00125 0.09 -0.0791 -0.3636 2067047 IFLab1_002739 CCn1c(CCNC(=O)c2ccc(OC)c(OC)c2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M12 compound treatment 0.071 0.00391 0.25 0.065 0.00325 0.23 0.3383 0.9987 2067048 IFLab1_002740 CCCCC(=O)Nc1c(nc2ccccn12)c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M13 compound treatment 0.059 -0.00809 -0.52 0.059 -0.00275 -0.19 -0.5042 -0.9081 2067049 IFLab1_002741 CCCCn1c(CCNC(=O)Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M14 compound treatment 0.072 0.00491 0.32 0.061 -7.5E-4 -0.05 0.1862 0.5818 2067050 IFLab1_002742 O=C(Nc1c(nc2ccccn12)c3ccccc3)C4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M15 compound treatment 0.058 -0.00909 -0.59 0.056 -0.00575 -0.4 -0.6979 -0.9831 2067051 IFLab1_002743 CC(C)Cn1c(CCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M16 compound treatment 0.075 0.00791 0.51 0.065 0.00325 0.23 0.5204 0.9339 2067052 IFLab1_002744 Fc1cccc(CS(=O)(=O)c2c[nH]c3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M17 compound treatment 0.058 -0.00909 -0.59 0.059 -0.00275 -0.19 -0.5497 -0.8924 2067053 IFLab1_002745 CC(=O)NCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M18 compound treatment 0.073 0.00591 0.38 0.062 2.5E-4 0.02 0.2812 0.7388 2067054 IFLab1_002746 CCn1cc(c2ccccc12)S(=O)(=O)CC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M19 compound treatment 0.057 -0.0101 -0.65 0.053 -0.00875 -0.61 -0.8916 -0.9995 2067055 IFLab1_002747 Cn1c(CCCNC(=O)c2cccs2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M20 compound treatment 0.077 0.00991 0.64 0.063 0.00125 0.09 0.5126 0.7965 2067056 IFLab1_002748 Cc1ccccc1Cn2cc(c3ccccc23)S(=O)(=O)CC(=O)N4CCCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M21 compound treatment 0.062 -0.00509 -0.33 0.065 0.00325 0.23 -0.0713 -0.1788 2067057 IFLab1_002749 CCCn1c(CCCNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M22 compound treatment 0.061 -0.00609 -0.39 0.056 -0.00575 -0.4 -0.5614 -0.9999 2067058 IFLab1_002750 O=C(CSc1nnc(o1)c2ccccc2)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M23 mock treatment 0.077 0.00991 0.64 0.061 -7.5E-4 -0.05 0.4138 0.6468 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 M24 mock treatment 0.061 -0.00609 -0.39 0.059 -0.00275 -0.19 -0.4132 -0.9461 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N01 compound treatment 0.345 0.278 17.89 0.42 0.358 25.03 30.3453 0.9864 2067059 IFLab1_002751 CC1CCN(CC1)C(=O)CSc2nnc(Cc3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N02 compound treatment 0.121 0.0539 3.47 0.147 0.0853 5.96 6.6646 0.9669 2067060 IFLab1_002752 O=C(Nc1nnc(o1)c2ccc3CCCCc3c2)C4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N03 compound treatment 0.79 0.723 46.53 0.7 0.638 44.59 64.4301 0.9998 1987190 IFLab1_002753 CC1CCCCN1C(=O)CSc2nnc(COc3ccc(Cl)cc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N04 compound treatment 0.084 0.0169 1.09 0.069 0.00725 0.51 1.1276 0.9395 2067061 IFLab1_002754 Cc1ccc2cc(CCNC(=O)COc3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N05 compound treatment 0.168 0.101 6.49 0.142 0.0803 5.61 8.5568 0.9973 2067062 IFLab1_002755 NC(=O)CSc1ncnc2c3ccccc3oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N06 compound treatment 0.081 0.0139 0.9 0.063 0.00125 0.09 0.6947 0.7724 2067063 IFLab1_002756 CC(=O)NCCc1cc2ccc(C)cc2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N07 compound treatment 0.43 0.363 23.36 0.339 0.277 19.37 30.2126 0.9957 2067064 IFLab1_002757 COC(=O)c1ccc(CSc2ncnc3c4ccccc4oc23)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N08 compound treatment 0.071 0.00391 0.25 0.074 0.0123 0.86 0.7829 0.8778 2067065 IFLab1_002758 COc1ccc2cc(CCNC(=O)Cc3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N09 compound treatment 0.055 -0.0121 -0.78 0.055 -0.00675 -0.47 -0.8839 -0.9712 2067066 IFLab1_002759 O=C(CSc1nccn1c2ccccc2)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N10 compound treatment 0.065 -0.00209 -0.13 0.063 0.00125 0.09 -0.0335 -0.2089 2067067 IFLab1_002760 COc1ccc2cc(CCNC(=O)C(C)C)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N11 compound treatment 0.058 -0.00909 -0.59 0.056 -0.00575 -0.4 -0.6979 -0.9831 2067068 IFLab1_002761 FC(F)(F)Oc1ccc(NC(=O)CSc2nccn2c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N12 compound treatment 0.067 -9.37E-5 -0.01 0.102 0.0403 2.81 1.984 0.7056 2067069 IFLab1_002762 CCC(CC)C(=O)NCCc1cc2c(C)ccc(C)c2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N13 compound treatment 0.052 -0.0151 -0.97 0.053 -0.00875 -0.61 -1.1192 -0.9751 2067070 IFLab1_002763 O=C(CSc1nccn1c2ccccc2)NCc3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N14 compound treatment 0.062 -0.00509 -0.33 0.061 -7.5E-4 -0.05 -0.2689 -0.8098 2067071 IFLab1_002764 Cc1ccc2cc(CCNC(=O)C3CCCCC3)c(=O)[nH]c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N15 compound treatment 0.069 0.00191 0.12 0.061 -7.5E-4 -0.05 0.0497 0.3726 2067072 IFLab1_002765 COc1ccc(cc1)n2ccnc2SCC(=O)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N16 compound treatment 0.066 -0.00109 -0.07 0.066 0.00425 0.3 0.1602 0.5249 2067073 IFLab1_002766 CCCS(=O)(=O)NCCc1cc2ccc(C)c(C)c2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N17 compound treatment 0.084 0.0169 1.09 0.072 0.0103 0.72 1.2758 0.9794 2067074 IFLab1_002767 CCc1nnc(NC(=O)CSc2nccn2c3ccc(Cl)cc3)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N18 compound treatment 0.224 0.157 10.1 0.162 0.1 7.0 12.0934 0.984 2067075 IFLab1_002768 O=C(Cc1cccs1)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N19 compound treatment 0.047 -0.0201 -1.29 0.047 -0.0147 -1.03 -1.6432 -0.9937 2067076 IFLab1_002769 Fc1cccc2sc(NC(=O)c3ccco3)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N20 compound treatment 0.19 0.123 7.91 0.257 0.195 13.64 15.2389 0.9664 2067077 IFLab1_002770 CCOc1ccc(cc1)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N21 compound treatment 0.05 -0.0171 -1.1 0.052 -0.00975 -0.68 -1.2596 -0.9734 2067078 IFLab1_002771 CC1CCN(Cc2cn3c(nnc3s2)c4ccc(Br)cc4)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N22 compound treatment 0.303 0.236 15.18 0.245 0.183 12.8 19.789 0.9964 2067079 IFLab1_002772 Cc1cccc(c1)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N23 mock treatment 0.078 0.0109 0.7 0.071 0.00925 0.65 0.9533 0.9991 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 N24 mock treatment 0.069 0.00191 0.12 0.058 -0.00375 -0.26 -0.0985 -0.3404 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O01 compound treatment 0.087 0.0199 1.28 0.065 0.00325 0.23 1.0665 0.8196 2067080 IFLab1_002773 COc1ccc(cc1OC)C(=O)NC(C)c2nc3ccccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O02 compound treatment 0.091 0.0239 1.54 0.087 0.0253 1.76 2.3354 0.9977 2067081 IFLab1_002774 CCCCn1c(CCCNC(=O)CC)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O03 compound treatment 0.071 0.00391 0.25 0.062 2.5E-4 0.02 0.1901 0.7544 2067082 IFLab1_002775 CCCC(=O)NC(C)c1nc2ccccc2n1C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O04 compound treatment 0.07 0.00291 0.19 0.064 0.00225 0.16 0.2434 0.9963 2067083 IFLab1_002776 C=CCn1c(CCCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O05 compound treatment 0.068 9.06E-4 0.06 0.068 0.00625 0.44 0.35 0.7945 2067084 IFLab1_002777 CC(C)Cn1c(nc2ccccc12)C(C)NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O06 compound treatment 0.077 0.00991 0.64 0.071 0.00925 0.65 0.9078 1.0 2067085 IFLab1_002778 O=C(NCCCc1nc2ccccc2[nH]1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O07 compound treatment 0.062 -0.00509 -0.33 0.06 -0.00175 -0.12 -0.3183 -0.9096 2067086 IFLab1_002779 CC(NC(=O)C(C)(C)C)c1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O08 compound treatment 0.073 0.00591 0.38 0.066 0.00425 0.3 0.4788 0.9925 1363058 IFLab1_002780 O=C(NC(Cc1ccccc1)c2nc3ccccc3[nH]2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O09 compound treatment 0.066 -0.00109 -0.07 0.06 -0.00175 -0.12 -0.1362 -0.9656 2067087 IFLab1_002781 Cn1c(CCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O10 compound treatment 0.068 9.06E-4 0.06 0.063 0.00125 0.09 0.103 0.9808 2067088 IFLab1_002782 CCOC(=O)c1[nH]c2ccccc2c1NC(=O)CC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O11 compound treatment 0.063 -0.00409 -0.26 0.056 -0.00575 -0.4 -0.4704 -0.9791 2067089 IFLab1_002783 CCCn1c(CCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O12 compound treatment 0.079 0.0119 0.77 0.066 0.00425 0.3 0.7518 0.9148 2067090 IFLab1_002784 COc1ccc(cc1)c2nc3ccccn3c2NC(=O)CC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O13 compound treatment 0.066 -0.00109 -0.07 0.064 0.00225 0.16 0.0614 0.3563 2067091 IFLab1_002785 CCCCn1c(CCNC(=O)c2cccs2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O14 compound treatment 0.071 0.00391 0.25 0.053 -0.00875 -0.61 -0.2545 -0.385 2067092 IFLab1_002786 Cc1ccn2c(NC(=O)C(C)(C)C)c(nc2c1)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O15 compound treatment 0.063 -0.00409 -0.26 0.058 -0.00375 -0.26 -0.3716 -1.0 2067093 IFLab1_002787 COc1ccc(cc1OC)C(=O)NCCc2nc3ccccc3n2CC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O16 compound treatment 0.087 0.0199 1.28 0.082 0.0203 1.41 1.9063 0.9988 2067094 IFLab1_002788 Cc1ccccc1CS(=O)(=O)c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O17 compound treatment 0.063 -0.00409 -0.26 0.059 -0.00275 -0.19 -0.3222 -0.9879 2067095 IFLab1_002789 CC(C)(C)C(=O)NCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O18 compound treatment 0.066 -0.00109 -0.07 0.064 0.00225 0.16 0.0614 0.3563 2067096 IFLab1_002790 CCn1cc(c2ccccc12)S(=O)(=O)CC(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O19 compound treatment 0.064 -0.00309 -0.2 0.051 -0.0107 -0.75 -0.6718 -0.8647 2067097 IFLab1_002791 CCn1c(CCCNC(=O)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O20 compound treatment 0.079 0.0119 0.77 0.073 0.0113 0.79 1.0976 0.9999 2067098 IFLab1_002792 Cc1ccccc1Cn2cc(c3ccccc23)S(=O)(=O)CC(=O)Nc4nccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O21 compound treatment 0.066 -0.00109 -0.07 0.059 -0.00275 -0.19 -0.1856 -0.9072 1542607 IFLab1_002793 NS(=O)(=O)c1ccc2nc(NC(=O)c3ccc4CCCCc4c3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O22 compound treatment 0.074 0.00691 0.44 0.062 2.5E-4 0.02 0.3267 0.7343 2067099 IFLab1_002794 CC1CCCCN1C(=O)CSc2nnc(o2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O23 mock treatment 0.061 -0.00609 -0.39 0.063 0.00125 0.09 -0.2156 -0.5365 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 O24 mock treatment 0.069 0.00191 0.12 0.064 0.00225 0.16 0.1979 0.9925 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P01 compound treatment 0.112 0.0449 2.89 0.111 0.0493 3.44 4.4767 0.9962 2067100 IFLab1_002795 O=C(CSc1nnc(Cc2ccccc2)o1)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P02 compound treatment 0.123 0.0559 3.6 0.098 0.0362 2.53 4.3351 0.9852 2067101 IFLab1_002796 CC(C)(C)C(=O)Nc1nnc(o1)c2ccc3CCCCc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P03 compound treatment 0.108 0.0409 2.63 0.079 0.0173 1.21 2.7139 0.9372 2067102 IFLab1_002797 O=C(CSc1nnc(COc2ccccc2)o1)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P04 compound treatment 0.069 0.00191 0.12 0.065 0.00325 0.23 0.2473 0.9583 2067103 IFLab1_002798 Cc1ccc2cc(CCNC(=O)/C=C\c3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P05 compound treatment 0.209 0.142 9.13 0.146 0.0843 5.89 10.6204 0.9774 2067104 IFLab1_002799 O=C(CSc1ncnc2c3ccccc3oc12)NCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P06 compound treatment 0.069 0.00191 0.12 0.071 0.00925 0.65 0.5437 0.8266 2067105 IFLab1_002800 Cc1ccc2cc(CCNC(=O)c3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P07 compound treatment 0.075 0.00791 0.51 0.063 0.00125 0.09 0.4216 0.8165 2067106 IFLab1_002801 CCOC(=O)CSc1ncnc2c3ccccc3oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P08 compound treatment 0.071 0.00391 0.25 0.069 0.00725 0.51 0.5359 0.9478 2067107 IFLab1_002802 COc1ccc2cc(CCNC(=O)COc3ccccc3)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P09 compound treatment 0.064 -0.00309 -0.2 0.059 -0.00275 -0.19 -0.2767 -0.9998 2067108 IFLab1_002803 Cc1nnc(NC(=O)CSc2nccn2c3ccccc3)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P10 compound treatment 0.06 -0.00709 -0.46 0.06 -0.00175 -0.12 -0.4093 -0.8659 2067109 IFLab1_002804 CCC(CC)C(=O)NCCc1cc2ccc(OC)cc2[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P11 compound treatment 0.102 0.0349 2.25 0.098 0.0362 2.53 3.3794 0.9982 2067110 IFLab1_002805 Cc1ccc2nc(NC(=O)CSc3nccn3c4ccccc4)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P12 compound treatment 0.067 -9.37E-5 -0.01 0.061 -7.5E-4 -0.05 -0.0413 -0.7834 2067111 IFLab1_002806 CCC(C(=O)NCCc1cc2c(C)ccc(C)c2[nH]c1=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P13 compound treatment 0.071 0.00391 0.25 0.062 2.5E-4 0.02 0.1901 0.7544 2067112 IFLab1_002807 CCc1nnc(NC(=O)CSc2nccn2c3cc(C)cc(C)c3)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P14 compound treatment 0.067 -9.37E-5 -0.01 0.065 0.00325 0.23 0.1563 0.6881 2067113 IFLab1_002808 Cc1ccc2cc(CCNC(=O)c3ccc(F)c(F)c3)c(=O)[nH]c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P15 compound treatment 0.067 -9.37E-5 -0.01 0.065 0.00325 0.23 0.1563 0.6881 2067114 IFLab1_002809 COc1ccc(cc1)n2ccnc2SCC(=O)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P16 compound treatment 0.273 0.206 13.25 0.32 0.258 18.04 22.1285 0.9885 2067115 IFLab1_002810 COc1ccc(cc1)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P17 compound treatment 0.098 0.0309 1.99 0.074 0.0123 0.86 2.0118 0.929 2067116 IFLab1_002811 Fc1ccccc1NC(=O)CSc2nccn2c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P18 compound treatment 0.098 0.0309 1.99 0.093 0.0313 2.18 2.9503 0.9989 2067117 IFLab1_002812 COc1ccc(/C=C/C(=O)NCCn2ccc3ccccc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P19 compound treatment 0.084 0.0169 1.09 0.074 0.0123 0.86 1.3746 0.9929 2067118 IFLab1_002813 CC(=O)Nc1ccc2n(C)c(=NC(=O)c3ccco3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P20 compound treatment 0.077 0.00991 0.64 0.064 0.00225 0.16 0.562 0.8558 2067119 IFLab1_002814 CC(=O)NCCn1ccc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P21 compound treatment 0.071 0.00391 0.25 0.059 -0.00275 -0.19 0.0419 0.1325 2067120 IFLab1_002815 Brc1ccc(cc1)c2nnc3sc(CNC4CCCC4)cn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P22 compound treatment 0.075 0.00791 0.51 0.081 0.0193 1.34 1.3108 0.9116 2067121 IFLab1_002816 CC(C)(C)C(=O)NCCn1ccc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P23 mock treatment 0.066 -0.00109 -0.07 0.064 0.00225 0.16 0.0614 0.3563 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1419 P24 mock treatment 0.061 -0.00609 -0.39 0.059 -0.00275 -0.19 -0.4132 -0.9461 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A01 compound treatment 0.077 0.0184 1.18 0.081 0.0236 1.65 2.0042 0.9868 2067122 IFLab1_002817 CCC(=O)NCCn1ccc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A02 compound treatment 0.071 0.0124 0.8 0.071 0.0136 0.95 1.2371 0.9962 2067123 IFLab1_002818 O=C(CCn1c(=O)sc2ccccc12)NCCC3=CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A03 compound treatment 0.077 0.0184 1.18 0.082 0.0246 1.72 2.0536 0.9835 2067124 IFLab1_002819 Cc1cc2ccccc2n1CCNC(=O)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A04 compound treatment 0.073 0.0144 0.93 0.075 0.0176 1.23 1.5257 0.9903 2067125 IFLab1_002820 COc1ccc(NC(=O)CCn2c(=O)sc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A05 compound treatment 0.235 0.176 11.35 0.204 0.147 10.24 15.2712 0.9987 2067126 IFLab1_002821 Cc1cc2ccccc2n1CCNC(=O)c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A06 compound treatment 0.782 0.723 46.56 0.955 0.898 62.71 77.2649 0.9893 2067127 IFLab1_002822 Fc1cc(F)c2c(c1)sc3nnc(c4ccccc4)n32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A07 compound treatment 0.062 0.00341 0.22 0.068 0.0106 0.74 0.6793 0.8786 2067128 IFLab1_002823 CC(=O)Nc1ccc(cc1)S(=O)(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A08 compound treatment 0.068 0.00941 0.61 0.067 0.00961 0.67 0.903 0.9987 2067129 IFLab1_002824 Cc1c(sc2nc(cn12)c3ccccc3)C(=O)NC4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A09 compound treatment 0.072 0.0134 0.86 0.074 0.0166 1.16 1.4308 0.9894 2067130 IFLab1_002825 Cc1cc(NC(=O)c2ccccc2)nc3c4ccccc4oc(=O)c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A10 compound treatment 0.076 0.0174 1.12 0.072 0.0146 1.02 1.5141 0.9989 2067131 IFLab1_002826 CCCCC(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A11 compound treatment 1.127 1.07 68.77 0.858 0.801 55.93 88.1752 0.9947 2067132 IFLab1_002827 CCOC(=O)C1C(CC(=CC1=O)c2ccco2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A12 compound treatment 0.082 0.0234 1.51 0.083 0.0256 1.79 2.3305 0.9963 2067133 IFLab1_002828 COc1ccc(cc1OC)C(=O)NCc2ccc3[nH]c(C)cc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A13 compound treatment 0.057 -0.00159 -0.1 0.057 -3.87E-4 -0.03 -0.0917 -0.864 2067134 IFLab1_002829 CC1CCCN(C1)C(=O)CSCC(=O)N=c2sc3ccccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A14 compound treatment 0.093 0.0344 2.21 0.084 0.0266 1.86 2.8806 0.9962 2067135 IFLab1_002830 Cc1cc2cc(CNC(=O)Cc3cccs3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A15 compound treatment 0.054 -0.00459 -0.3 0.052 -0.00539 -0.38 -0.4752 -0.9929 2067136 IFLab1_002831 Cc1nc2sc(C(N3CCCCC3)c4ccccc4)c(O)n2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A16 compound treatment 0.062 0.00341 0.22 0.061 0.00361 0.25 0.3335 0.9975 1987774 IFLab1_002832 CCOC(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A17 compound treatment 0.057 -0.00159 -0.1 0.056 -0.00139 -0.1 -0.1411 -0.9996 2067137 IFLab1_002833 COc1ccc(cc1)C(=O)NCC(N(C)C)c2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A18 compound treatment 0.089 0.0304 1.96 0.088 0.0306 2.14 2.8961 0.999 2067138 IFLab1_002834 CC(C)CC(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A19 compound treatment 0.073 0.0144 0.93 0.076 0.0186 1.3 1.5751 0.9863 2067139 IFLab1_002835 CN(Cc1ccccc1)C(=O)CCn2c(=O)oc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A20 compound treatment 0.126 0.0674 4.34 0.129 0.0716 5.0 6.6054 0.9975 2067140 IFLab1_002836 Cc1cc2cc(CNC(=O)c3ccccc3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A21 compound treatment 0.059 4.06E-4 0.03 0.062 0.00461 0.32 0.2464 0.762 2067141 IFLab1_002837 O=C(CCn1c(=O)oc2ccccc12)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A22 compound treatment 0.11 0.0514 3.31 0.104 0.0466 3.26 4.6422 1.0 2067142 IFLab1_002838 Cc1cc2cc(CNC(=O)Cc3cccs3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A23 mock treatment 0.054 -0.00459 -0.3 0.052 -0.00539 -0.38 -0.4752 -0.9929 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 A24 mock treatment 0.056 -0.00259 -0.17 0.06 0.00261 0.18 0.011 0.0446 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B01 compound treatment 0.116 0.0574 3.69 0.129 0.0716 5.0 6.1503 0.9889 1987861 IFLab1_002839 CCOC(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B02 compound treatment 0.067 0.00841 0.54 0.073 0.0156 1.09 1.1538 0.9477 2067143 IFLab1_002840 CCN1CCN(CC1)C(C(C)NC(=O)c2cccc(OC)c2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B03 compound treatment 0.077 0.0184 1.18 0.077 0.0196 1.37 1.8066 0.9974 2067144 IFLab1_002841 CC(C)CC(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B04 compound treatment 0.062 0.00341 0.22 0.063 0.00561 0.39 0.4323 0.9623 2067145 IFLab1_002842 CCN1CCN(CC1)C(C(C)NC(=O)c2ccncc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B05 compound treatment 0.046 -0.0126 -0.81 0.05 -0.00739 -0.52 -0.9381 -0.9762 2067146 IFLab1_002843 O=C(NCc1ccc2[nH]c3CCCCc3c2c1)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B06 compound treatment 0.056 -0.00259 -0.17 0.056 -0.00139 -0.1 -0.1866 -0.9665 2067147 IFLab1_002844 CC(NS(=O)(=O)C)C(N1CCOCC1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B07 compound treatment 0.15 0.0914 5.88 0.145 0.0876 6.12 8.4881 0.9998 2067148 IFLab1_002845 CCCS(=O)(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B08 compound treatment 0.071 0.0124 0.8 0.075 0.0176 1.23 1.4347 0.9781 2067149 IFLab1_002846 Cn1cccc1Cc2nnc(SCC(=O)N3CCCC3)n2CCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B09 compound treatment 0.06 0.00141 0.09 0.067 0.00961 0.67 0.5389 0.7952 1987731 IFLab1_002847 Cn1c(SCC(=O)N2CCCC2)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B10 compound treatment 0.055 -0.00359 -0.23 0.062 0.00461 0.32 0.0643 0.1621 2067150 IFLab1_002848 CCn1c(nc2ccccc12)C3CN(Cc4ccccc4)C(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B11 compound treatment 0.058 -5.94E-4 -0.04 0.058 6.13E-4 0.04 0.0033 0.0567 2067151 IFLab1_002849 CCn1c(SC)nnc1c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B12 compound treatment 0.069 0.0104 0.67 0.064 0.00661 0.46 0.8003 0.9836 2067152 IFLab1_002850 CCSc1nnc(Cn2c(=O)sc3ccccc23)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B13 compound treatment 0.064 0.00541 0.35 0.06 0.00261 0.18 0.3751 0.9547 2067153 IFLab1_002851 COCCn1c(SC)nnc1c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B14 compound treatment 0.101 0.0424 2.73 0.105 0.0476 3.33 4.282 0.9952 2067154 IFLab1_002852 Cc1cc(NC(=O)CN2C(=O)CC(Sc3ccccc23)c4ccccc4)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B15 compound treatment 0.062 0.00341 0.22 0.063 0.00561 0.39 0.4323 0.9623 2067155 IFLab1_002853 COC(=O)CSc1nnc(c2c[nH]c3ccccc23)n1c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B16 compound treatment 0.107 0.0484 3.12 0.118 0.0606 4.23 5.1973 0.9886 2067156 IFLab1_002854 CCOC(=O)c1[nH]c(C)c(C(=O)N2CCN(CC2)c3ccccc3F)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B17 compound treatment 0.061 0.00241 0.15 0.061 0.00361 0.25 0.288 0.9725 2067157 IFLab1_002855 COc1ccc(CC(=O)NC(C)C(N2CCOCC2)c3cccs3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B18 compound treatment 0.493 0.434 27.96 0.405 0.348 24.28 36.9426 0.9975 2067158 IFLab1_002856 O=C(Nc1ccccc1)c2cccn(OCc3ccccc3)c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B19 compound treatment 0.057 -0.00159 -0.1 0.057 -3.87E-4 -0.03 -0.0917 -0.864 2067159 IFLab1_002857 COc1ccc(cc1OC)C(=O)NC(C)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B20 compound treatment 0.395 0.336 21.65 0.386 0.329 22.96 31.5438 0.9996 2067160 IFLab1_002858 COc1ccccc1NC(=O)CSc2ncnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B21 compound treatment 0.068 0.00941 0.61 0.069 0.0116 0.81 1.0018 0.9896 1260122 IFLab1_002859 Cc1ccc(cc1C)c2nnc(N3CCOCC3)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B22 compound treatment 0.064 0.00541 0.35 0.059 0.00161 0.11 0.3257 0.8906 2067161 IFLab1_002860 COC(=O)c1ccc(NC(=O)CSc2ncnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B23 mock treatment 0.054 -0.00459 -0.3 0.057 -3.87E-4 -0.03 -0.2282 -0.7686 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 B24 mock treatment 0.056 -0.00259 -0.17 0.059 0.00161 0.11 -0.0384 -0.1905 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C01 compound treatment 0.07 0.0114 0.73 0.076 0.0186 1.3 1.4386 0.9634 1987268 IFLab1_002861 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C02 compound treatment 0.059 4.06E-4 0.03 0.065 0.00761 0.53 0.3946 0.741 2067162 IFLab1_002862 CC1CCCCC1NC(=O)CCn2c(=O)sc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C03 compound treatment 0.075 0.0164 1.06 0.076 0.0186 1.3 1.6661 0.9947 2067163 IFLab1_002863 Cc1cc2ccccc2n1CCNC(=O)Cc3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C04 compound treatment 0.066 0.00741 0.48 0.066 0.00861 0.6 0.7625 0.9933 2067164 IFLab1_002864 CCOC(=O)c1ccc(NC(=O)CCn2c(=O)sc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C05 compound treatment 0.501 0.442 28.48 0.485 0.428 29.87 41.2586 0.9997 2067165 IFLab1_002865 CC(Oc1ccccc1)C(=O)NCCn2c(C)cc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C06 compound treatment 0.076 0.0174 1.12 0.07 0.0126 0.88 1.4153 0.9929 2067166 IFLab1_002866 CN(C1CCCCC1)C(=O)c2sc3nc(cn3c2C)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C07 compound treatment 0.085 0.0264 1.7 0.074 0.0166 1.16 2.0225 0.9827 2067167 IFLab1_002867 Cc1cc2ccccc2n1CCNS(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C08 compound treatment 0.195 0.136 8.78 0.182 0.125 8.71 12.3639 1.0 2067168 IFLab1_002868 Cc1c(sc2nc(cn12)c3ccccc3)C(=O)Nc4cccc(C)n4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C09 compound treatment 0.245 0.186 12.0 0.212 0.155 10.8 16.1215 0.9986 2067169 IFLab1_002869 CCC(CC)C(=O)Nc1cc(C)c2c(=O)oc3ccccc3c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C10 compound treatment 0.064 0.00541 0.35 0.063 0.00561 0.39 0.5233 0.9982 2067170 IFLab1_002870 CC(C)CC(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C11 compound treatment 0.825 0.766 49.33 0.636 0.579 40.42 63.4639 0.9951 2067171 IFLab1_002871 CCOC(=O)C1C(CC(=CC1=O)c2ccco2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C12 compound treatment 0.075 0.0164 1.06 0.072 0.0146 1.02 1.4685 0.9999 2067172 IFLab1_002872 Cc1cc2cc(CNC(=O)c3ccc4OCOc4c3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C13 compound treatment 0.059 4.06E-4 0.03 0.062 0.00461 0.32 0.2464 0.762 2067173 IFLab1_002873 CCn1c(=NC(=O)CSCC(=O)N2CCCc3ccccc23)sc4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C14 compound treatment 0.094 0.0354 2.28 0.096 0.0386 2.7 3.5189 0.9965 2067174 IFLab1_002874 Cc1cc2cc(CNC(=O)CCc3ccccc3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C15 compound treatment 0.062 0.00341 0.22 0.054 -0.00339 -0.24 -0.0123 -0.0381 2067175 IFLab1_002875 Cc1nc2sc(C(N3CCC(O)CC3)c4cccc(F)c4)c(O)n2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C16 compound treatment 0.061 0.00241 0.15 0.069 0.0116 0.81 0.6832 0.8272 2067176 IFLab1_002876 C/C=C\C(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C17 compound treatment 0.058 -5.94E-4 -0.04 0.051 -0.00639 -0.45 -0.3425 -0.7649 2067177 IFLab1_002877 CN(C)C(CNC(=O)c1cccs1)c2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C18 compound treatment 0.08 0.0214 1.38 0.088 0.0306 2.14 2.4865 0.9774 2067178 IFLab1_002878 CCC(CC)C(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C19 compound treatment 0.053 -0.00559 -0.36 0.052 -0.00539 -0.38 -0.5207 -0.9998 2067179 IFLab1_002879 O=C(CCn1c(=O)oc2ccccc12)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C20 compound treatment 0.152 0.0934 6.01 0.122 0.0646 4.51 7.443 0.99 2067180 IFLab1_002880 Cc1cc2cc(CNC(=O)c3ccc4OCOc4c3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C21 compound treatment 0.072 0.0134 0.86 0.064 0.00661 0.46 0.9368 0.9571 2067181 IFLab1_002881 COc1ccc(CCNC(=O)CCn2c(=O)oc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C22 compound treatment 0.125 0.0664 4.27 0.118 0.0606 4.23 6.0165 1.0 2067182 IFLab1_002882 Cc1cc2cc(CNC(=O)CCc3ccccc3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C23 mock treatment 0.057 -0.00159 -0.1 0.056 -0.00139 -0.1 -0.1411 -0.9996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 C24 mock treatment 0.056 -0.00259 -0.17 0.053 -0.00439 -0.31 -0.3348 -0.9592 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D01 compound treatment 0.108 0.0494 3.18 0.122 0.0646 4.51 5.4404 0.9853 2067183 IFLab1_002883 C/C=C\C(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D02 compound treatment 0.063 0.00441 0.28 0.064 0.00661 0.46 0.5272 0.9726 2067184 IFLab1_002884 CCN1CCN(CC1)C(C(C)NC(=O)c2ccc3OCOc3c2)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D03 compound treatment 0.076 0.0174 1.12 0.087 0.0296 2.07 2.255 0.9585 2067185 IFLab1_002885 CCC(CC)C(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D04 compound treatment 0.065 0.00641 0.41 0.064 0.00661 0.46 0.6182 0.9984 2067186 IFLab1_002886 CCN1CCN(CC1)C(C(C)NC(=O)c2ccc(cc2)N(C)C)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D05 compound treatment 0.047 -0.0116 -0.75 0.046 -0.0114 -0.8 -1.0902 -0.9995 2067187 IFLab1_002887 C/C=C\C(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D06 compound treatment 0.064 0.00541 0.35 0.077 0.0196 1.37 1.2149 0.8594 2067188 IFLab1_002888 CC(NS(=O)(=O)c1ccccc1)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D07 compound treatment 0.111 0.0524 3.37 0.11 0.0526 3.68 4.9842 0.9991 2067189 IFLab1_002889 CN(C)S(=O)(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D08 compound treatment 0.07 0.0114 0.73 0.063 0.00561 0.39 0.7964 0.9568 2067190 IFLab1_002890 Cn1cccc1Cc2nnc(SCC(=O)N)n2CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D09 compound treatment 0.056 -0.00259 -0.17 0.061 0.00361 0.25 0.0604 0.1997 2067191 IFLab1_002891 Cn1c(SCC(=O)N)nnc1c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D10 compound treatment 0.053 -0.00559 -0.36 0.06 0.00261 0.18 -0.1255 -0.3109 2067192 IFLab1_002892 CCCn1c(nc2ccccc12)C3CN(Cc4ccccc4)C(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D11 compound treatment 0.055 -0.00359 -0.23 0.057 -3.87E-4 -0.03 -0.1827 -0.7844 2067193 IFLab1_002893 CCSc1nnc(c2c[nH]c3ccccc23)n1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D12 compound treatment 0.562 0.503 32.4 0.65 0.593 41.4 52.1856 0.9926 1332791 IFLab1_002894 CN1C(=O)CC(Sc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D13 compound treatment 0.062 0.00341 0.22 0.066 0.00861 0.6 0.5805 0.9065 2067194 IFLab1_002895 COCCn1c(SC(C)C)nnc1c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D14 compound treatment 0.057 -0.00159 -0.1 0.061 0.00361 0.25 0.1059 0.3888 2067195 IFLab1_002896 COc1ccc(cc1OC)C2CC(=O)N(CC(=O)N)c3ccccc3S2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D15 compound treatment 0.081 0.0224 1.44 0.075 0.0176 1.23 1.8898 0.9969 2067196 IFLab1_002897 COC(=O)C(C)Sc1nnc(c2c[nH]c3ccccc23)n1c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D16 compound treatment 0.058 -5.94E-4 -0.04 0.057 -3.87E-4 -0.03 -0.0461 -0.9857 2067197 IFLab1_002898 CCOC(=O)c1[nH]c(C)c(C(=O)NC)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D17 compound treatment 0.052 -0.00659 -0.42 0.051 -0.00639 -0.45 -0.6156 -0.9997 2067198 IFLab1_002899 CC(NC(=O)Cc1ccc(F)cc1)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D18 compound treatment 0.804 0.745 47.98 0.621 0.564 39.37 61.7672 0.9952 2067199 IFLab1_002900 COc1ccccc1NC(=O)c2cccn(OCc3ccccc3)c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D19 compound treatment 0.055 -0.00359 -0.23 0.055 -0.00239 -0.17 -0.2815 -0.9871 2067200 IFLab1_002901 CC(NC(=O)c1c(F)cccc1F)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D20 compound treatment 0.588 0.529 34.08 0.566 0.509 35.53 49.2195 0.9998 2067201 IFLab1_002902 CCOc1ccccc1NC(=O)CSc2ncnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D21 compound treatment 0.058 -5.94E-4 -0.04 0.062 0.00461 0.32 0.2008 0.6189 2067202 IFLab1_002903 CC(C)OC(=O)NC1(Oc2ccccc2O1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D22 compound treatment 0.085 0.0264 1.7 0.073 0.0156 1.09 1.9731 0.977 2067203 IFLab1_002904 CC(=O)Nc1cccc(NC(=O)CSc2ncnc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D23 mock treatment 0.061 0.00241 0.15 0.061 0.00361 0.25 0.288 0.9725 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 D24 mock treatment 0.059 4.06E-4 0.03 0.122 0.0646 4.51 3.2103 0.7112 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E01 compound treatment 0.087 0.0284 1.83 0.085 0.0276 1.93 2.6569 0.9996 2067204 IFLab1_002905 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E02 compound treatment 0.069 0.0104 0.67 0.069 0.0116 0.81 1.0473 0.9955 2067205 IFLab1_002906 O=C(CCn1c(=O)sc2ccccc12)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E03 compound treatment 0.088 0.0294 1.89 0.101 0.0436 3.05 3.4928 0.9738 2067206 IFLab1_002907 Cc1cc2ccccc2n1CCNC(=O)C3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E04 compound treatment 0.067 0.00841 0.54 0.067 0.00961 0.67 0.8575 0.9943 2067207 IFLab1_002908 O=C(CCn1c(=O)sc2ccccc12)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E05 compound treatment 0.076 0.0174 1.12 0.079 0.0216 1.51 1.8599 0.9892 2067208 IFLab1_002909 Cc1cc2ccccc2n1CCNC(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E06 compound treatment 0.114 0.0554 3.57 0.103 0.0456 3.19 4.7749 0.9984 2067209 IFLab1_002910 Cc1c(sc2nc(cn12)c3ccccc3)C(=O)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E07 compound treatment 0.144 0.0854 5.5 0.171 0.114 7.94 9.4994 0.9839 2067210 IFLab1_002911 Cc1cc2ccccc2n1CCNS(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E08 compound treatment 0.054 -0.00459 -0.3 0.056 -0.00139 -0.1 -0.2776 -0.8922 2067211 IFLab1_002912 Cc1c(sc2nc(cn12)c3ccccc3)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E09 compound treatment 0.153 0.0944 6.08 0.127 0.0696 4.86 7.7355 0.9939 2067212 IFLab1_002913 CCC(=O)Nc1cc(C)c2c(=O)oc3ccccc3c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E10 compound treatment 0.069 0.0104 0.67 0.071 0.0136 0.95 1.1461 0.9853 2067213 IFLab1_002914 CCC(CC)C(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E11 compound treatment 0.071 0.0124 0.8 0.081 0.0236 1.65 1.7311 0.9446 2067214 IFLab1_002915 COc1ccc2n(C)c(=NC(=O)CSC(=O)C)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E12 compound treatment 0.075 0.0164 1.06 0.081 0.0236 1.65 1.9131 0.9768 2067215 IFLab1_002916 COc1ccc(/C=C\C(=O)NCc2ccc3[nH]c(C)cc3c2)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E13 compound treatment 0.064 0.00541 0.35 0.063 0.00561 0.39 0.5233 0.9982 2067216 IFLab1_002917 CCn1c(=NC(=O)CSCC(=O)Nc2nccs2)sc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E14 compound treatment 0.097 0.0384 2.47 0.106 0.0486 3.4 4.1494 0.9878 2067217 IFLab1_002918 Cc1cc2cc(CNC(=O)CCCc3ccccc3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E15 compound treatment 0.057 -0.00159 -0.1 0.054 -0.00339 -0.24 -0.2399 -0.93 2067218 IFLab1_002919 Cc1nc2sc(C(N3CCOCC3)c4cccc(F)c4)c(O)n2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E16 compound treatment 0.061 0.00241 0.15 0.064 0.00661 0.46 0.4362 0.8952 1987817 IFLab1_002920 Cc1cc2cc(CNC(=O)CCC(=O)O)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E17 compound treatment 0.052 -0.00659 -0.42 0.054 -0.00339 -0.24 -0.4674 -0.9619 2067219 IFLab1_002921 COc1ccccc1C(=O)NCC(N(C)C)c2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E18 compound treatment 0.079 0.0204 1.31 0.081 0.0236 1.65 2.0952 0.9936 2067220 IFLab1_002922 Cc1cc2cc(CNC(=O)C3CC3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E19 compound treatment 0.128 0.0694 4.47 0.13 0.0726 5.07 6.7458 0.998 2067221 IFLab1_002923 Clc1ccccc1N2CCN(CC2)C(=O)CCn3c(=O)oc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E20 compound treatment 0.12 0.0614 3.95 0.119 0.0616 4.3 5.8384 0.9991 2067222 IFLab1_002924 COc1cc(cc(OC)c1OC)C(=O)NCc2ccc3n(C)c(C)cc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E21 compound treatment 0.062 0.00341 0.22 0.059 0.00161 0.11 0.2347 0.9521 2067223 IFLab1_002925 CCN(C(=O)CCn1c(=O)oc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E22 compound treatment 0.091 0.0324 2.09 0.081 0.0236 1.65 2.6413 0.9932 2067224 IFLab1_002926 Cc1cc2cc(CNC(=O)CCCc3ccccc3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E23 mock treatment 0.056 -0.00259 -0.17 0.056 -0.00139 -0.1 -0.1866 -0.9665 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 E24 mock treatment 0.057 -0.00159 -0.1 0.059 0.00161 0.11 0.0071 0.0468 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F01 compound treatment 0.095 0.0364 2.34 0.103 0.0456 3.19 3.9102 0.9886 2067225 IFLab1_002927 Cc1cc2cc(CNC(=O)CCC(=O)O)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F02 compound treatment 0.069 0.0104 0.67 0.063 0.00561 0.39 0.7509 0.9675 2067226 IFLab1_002928 CCN1CCN(CC1)C(C(C)NC(=O)c2ccc(F)cc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F03 compound treatment 0.074 0.0154 0.99 0.076 0.0186 1.3 1.6206 0.9911 2067227 IFLab1_002929 O=C(NCc1ccc2[nH]c3CCCCc3c2c1)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F04 compound treatment 0.06 0.00141 0.09 0.062 0.00461 0.32 0.2919 0.872 2067228 IFLab1_002930 CC(C)CC(=O)NC(C)C(N1CCN(CC1)c2ccccc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F05 compound treatment 0.07 0.0114 0.73 0.073 0.0156 1.09 1.2904 0.9814 2067229 IFLab1_002931 OC(=O)CCC(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F06 compound treatment 0.059 4.06E-4 0.03 0.062 0.00461 0.32 0.2464 0.762 2067230 IFLab1_002932 CC(NS(=O)(=O)C)C(N1CCN(C)CC1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F07 compound treatment 0.333 0.274 17.66 0.232 0.175 12.2 21.1146 0.9837 2067231 IFLab1_002933 Cc1cc2cc(CNS(=O)(=O)c3ccc(C)cc3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F08 compound treatment 0.066 0.00741 0.48 0.068 0.0106 0.74 0.8613 0.9772 2067232 IFLab1_002934 Cn1cccc1Cc2nnc(SCC(=O)N3CCCCC3)n2c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F09 compound treatment 0.059 4.06E-4 0.03 0.069 0.0116 0.81 0.5921 0.7295 2067233 IFLab1_002935 Cn1c(SCC(=O)Nc2ccc(F)cc2F)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F10 compound treatment 0.058 -5.94E-4 -0.04 0.062 0.00461 0.32 0.2008 0.6189 2067234 IFLab1_002936 COc1ccc(OC)c(c1)N2CC(CC2=O)c3nc4ccccc4n3CC(=C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F11 compound treatment 0.058 -5.94E-4 -0.04 0.058 6.13E-4 0.04 0.0033 0.0567 2067235 IFLab1_002937 CCn1c(SCC(=O)N2CCC(C)CC2)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F12 compound treatment 0.914 0.855 55.06 0.895 0.838 58.52 80.3087 0.9995 2067236 IFLab1_002938 CCN1C(=O)CC(Sc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F13 compound treatment 0.073 0.0144 0.93 0.07 0.0126 0.88 1.2787 0.9997 2067237 IFLab1_002939 COCCn1c(SCc2ccccc2)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F14 compound treatment 0.067 0.00841 0.54 0.072 0.0146 1.02 1.1044 0.9559 2067238 IFLab1_002940 COc1cc(cc(OC)c1OC)C2CC(=O)N(C)c3ccccc3S2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F15 compound treatment 0.05 -0.00859 -0.55 0.058 6.13E-4 0.04 -0.3608 -0.6504 2067239 IFLab1_002941 CC(C)C(=O)NC(C)C(N1CCOCC1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F16 compound treatment 0.132 0.0734 4.72 0.14 0.0826 5.77 7.4219 0.9951 2067240 IFLab1_002942 CCOC(=O)c1[nH]c(C)c(C(=O)NC2CCCCC2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F17 compound treatment 0.059 4.06E-4 0.03 0.059 0.00161 0.11 0.0982 0.8486 2067241 IFLab1_002943 CC(NC(=O)Cc1cccs1)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F18 compound treatment 0.079 0.0204 1.31 0.074 0.0166 1.16 1.7494 0.9981 2067242 IFLab1_002944 FC(F)(F)c1ccccc1NC(=O)c2cccn(OCc3ccccc3)c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F19 compound treatment 0.061 0.00241 0.15 0.065 0.00761 0.53 0.4856 0.8766 2067243 IFLab1_002945 COc1ccc(CC(=O)NC(C)C(N2CCN(C)CC2)c3cccs3)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F20 compound treatment 0.062 0.00341 0.22 0.059 0.00161 0.11 0.2347 0.9521 2067244 IFLab1_002946 CCOc1ccc(NC(=O)CSc2ncnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F21 compound treatment 0.242 0.183 11.8 0.218 0.161 11.22 16.2814 0.9997 2067245 IFLab1_002947 S=c1[nH]c(nc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F22 compound treatment 0.058 -5.94E-4 -0.04 0.064 0.00661 0.46 0.2996 0.6464 2067246 IFLab1_002948 CC(=O)Nc1ccc(NC(=O)CSc2ncnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F23 mock treatment 0.06 0.00141 0.09 0.058 6.13E-4 0.04 0.0943 0.9416 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 F24 mock treatment 0.062 0.00341 0.22 0.06 0.00261 0.18 0.2841 0.9959 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G01 compound treatment 0.079 0.0204 1.31 0.085 0.0276 1.93 2.2928 0.9825 2067247 IFLab1_002949 O=C(NCCn1ccc2ccccc12)c3ccc(cc3)S(=O)(=O)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G02 compound treatment 0.064 0.00541 0.35 0.072 0.0146 1.02 0.9679 0.8974 2067248 IFLab1_002950 CC(NC(=O)CCn1c(=O)sc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G03 compound treatment 0.126 0.0674 4.34 0.167 0.11 7.66 8.4826 0.9638 2067249 IFLab1_002951 Cc1cc2ccccc2n1CCNC(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G04 compound treatment 0.053 -0.00559 -0.36 0.061 0.00361 0.25 -0.0761 -0.1731 2067250 IFLab1_002952 O=C(CCn1c(=O)sc2ccccc12)NC3=NCCS3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G05 compound treatment 0.061 0.00241 0.15 0.064 0.00661 0.46 0.4362 0.8952 2067251 IFLab1_002953 CCC(=O)NCCn1c(C)cc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G06 compound treatment 0.1 0.0414 2.67 0.097 0.0396 2.77 3.8413 0.9998 2067252 IFLab1_002954 Cc1c(sc2nc(cn12)c3ccccc3)C(=O)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G07 compound treatment 0.068 0.00941 0.61 0.079 0.0216 1.51 1.4957 0.9195 2067253 IFLab1_002955 Cc1cc(NC(=O)Cc2ccccc2)nc3c4ccccc4oc(=O)c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G08 compound treatment 0.051 -0.00759 -0.49 0.049 -0.00839 -0.59 -0.7599 -0.9959 2067254 IFLab1_002956 CN(C)CCNC(=O)c1sc2nc(cn2c1C)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G09 compound treatment 0.088 0.0294 1.89 0.098 0.0406 2.84 3.3446 0.9806 2067255 IFLab1_002957 COCC(=O)Nc1cc(C)c2c(=O)oc3ccccc3c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G10 compound treatment 0.059 4.06E-4 0.03 0.063 0.00561 0.39 0.2958 0.7526 2067256 IFLab1_002958 Cc1cc2cc(CNC(=O)C3CC3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G11 compound treatment 0.073 0.0144 0.93 0.077 0.0196 1.37 1.6245 0.9819 2067257 IFLab1_002959 CC(=O)SCC(=O)N=c1sc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G12 compound treatment 0.076 0.0174 1.12 0.091 0.0336 2.35 2.4526 0.9427 2067258 IFLab1_002960 Cc1cc2cc(CNC(=O)/C=C\c3ccc4OCOc4c3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G13 compound treatment 0.899 0.84 54.09 0.83 0.773 53.97 76.4151 1.0 2067259 IFLab1_002961 COc1ccc(cc1)C(=O)NCc2nnc(SC/C=C/c3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G14 compound treatment 0.087 0.0284 1.83 0.085 0.0276 1.93 2.6569 0.9996 2067260 IFLab1_002962 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCc2ccc3[nH]c(C)cc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G15 compound treatment 0.056 -0.00259 -0.17 0.057 -3.87E-4 -0.03 -0.1372 -0.8111 2067261 IFLab1_002963 CN1CCN(CC1)C(c2sc3nc(C)nn3c2O)c4cccc(F)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G16 compound treatment 0.067 0.00841 0.54 0.066 0.00861 0.6 0.8081 0.9986 2067262 IFLab1_002964 CC(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G17 compound treatment 0.056 -0.00259 -0.17 0.056 -0.00139 -0.1 -0.1866 -0.9665 2067263 IFLab1_002965 CN(C)C(CNC(=O)c1ccco1)c2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G18 compound treatment 0.085 0.0264 1.7 0.083 0.0256 1.79 2.4671 0.9997 2067264 IFLab1_002966 Cc1cc2cc(CNC(=O)C3CCCC3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G19 compound treatment 0.079 0.0204 1.31 0.082 0.0246 1.72 2.1446 0.9912 2067265 IFLab1_002967 Fc1ccc(cc1)N2CCN(CC2)C(=O)CCn3c(=O)oc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G20 compound treatment 0.092 0.0334 2.15 0.077 0.0196 1.37 2.4893 0.9763 2067266 IFLab1_002968 Cc1cc2cc(CNC(=O)/C=C\c3ccccc3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G21 compound treatment 0.068 0.00941 0.61 0.059 0.00161 0.11 0.5078 0.8245 2067267 IFLab1_002969 O=C(CCn1c(=O)oc2ccccc12)N(Cc3ccccc3)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G22 compound treatment 0.084 0.0254 1.64 0.082 0.0246 1.72 2.3721 0.9997 2067268 IFLab1_002970 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCc2ccc3n(C)c(C)cc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G23 mock treatment 0.054 -0.00459 -0.3 0.055 -0.00239 -0.17 -0.327 -0.9633 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 G24 mock treatment 0.057 -0.00159 -0.1 0.051 -0.00639 -0.45 -0.388 -0.8476 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H01 compound treatment 0.07 0.0114 0.73 0.077 0.0196 1.37 1.488 0.9572 2067269 IFLab1_002971 CC(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H02 compound treatment 0.058 -5.94E-4 -0.04 0.066 0.00861 0.6 0.3984 0.6609 2067270 IFLab1_002972 CCN1CCN(CC1)C(C(C)NC(=O)c2c(F)cccc2F)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H03 compound treatment 0.081 0.0224 1.44 0.11 0.0526 3.68 3.6188 0.9165 2067271 IFLab1_002973 O=C(NCc1ccc2[nH]c3CCCCc3c2c1)C4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H04 compound treatment 0.072 0.0134 0.86 0.071 0.0136 0.95 1.2826 0.9988 2067272 IFLab1_002974 CC(NC(=O)Cc1cccs1)C(N2CCN(CC2)c3ccccc3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H05 compound treatment 0.116 0.0574 3.69 0.137 0.0796 5.56 6.5455 0.9803 2067273 IFLab1_002975 CCCS(=O)(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H06 compound treatment 0.055 -0.00359 -0.23 0.06 0.00261 0.18 -0.0345 -0.117 2067274 IFLab1_002976 CC(NS(=O)(=O)c1ccccc1)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H07 compound treatment 0.062 0.00341 0.22 0.063 0.00561 0.39 0.4323 0.9623 2067275 IFLab1_002977 CCS(=O)(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H08 compound treatment 0.063 0.00441 0.28 0.061 0.00361 0.25 0.379 0.9983 2067276 IFLab1_002978 Cn1cccc1Cc2nnc(SCC(=O)N)n2c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H09 compound treatment 0.061 0.00241 0.15 0.064 0.00661 0.46 0.4362 0.8952 2067277 IFLab1_002979 Cn1c(SCC(=O)NC2CCCC2)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H10 compound treatment 0.06 0.00141 0.09 0.059 0.00161 0.11 0.1437 0.9941 2067278 IFLab1_002980 CCCCn1c(nc2ccccc12)C3CN(C(=O)C3)c4cc(OC)ccc4OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H11 compound treatment 0.053 -0.00559 -0.36 0.058 6.13E-4 0.04 -0.2243 -0.6187 2067279 IFLab1_002981 CCn1c(SCC(=O)N)nnc1c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H12 compound treatment 0.857 0.798 51.39 0.732 0.675 47.13 69.6626 0.9991 2067280 IFLab1_002982 CCCN1C(=O)CC(Sc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H13 compound treatment 0.061 0.00241 0.15 0.056 -0.00139 -0.1 0.041 0.2244 2067281 IFLab1_002983 COc1ccc(cc1)n2c(SC)nnc2c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H14 compound treatment 0.1 0.0414 2.67 0.095 0.0376 2.63 3.7425 1.0 2067282 IFLab1_002984 CCN1C(=O)CC(Sc2ccccc12)c3cc(OC)c(OC)c(OC)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H15 compound treatment 0.056 -0.00259 -0.17 0.051 -0.00639 -0.45 -0.4336 -0.9101 2067283 IFLab1_002985 COc1cccc(c1)C(=O)NC(C)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H16 compound treatment 0.071 0.0124 0.8 0.066 0.00861 0.6 0.9901 0.9903 2067284 IFLab1_002986 CCCCN(C(=O)c1c(C)[nH]c(C(=O)OCC)c1C)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H17 compound treatment 0.052 -0.00659 -0.42 0.061 0.00361 0.25 -0.1216 -0.2463 2067285 IFLab1_002987 CC(NC(=O)c1ccco1)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H18 compound treatment 0.538 0.479 30.86 0.43 0.373 26.03 40.2256 0.9964 2067286 IFLab1_002988 Cc1ccc(NC(=O)c2cccn(OCc3ccccc3)c2=O)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H19 compound treatment 0.058 -5.94E-4 -0.04 0.062 0.00461 0.32 0.2008 0.6189 2067287 IFLab1_002989 CC(NC(=O)Cc1ccc(F)cc1)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H20 compound treatment 0.071 0.0124 0.8 0.073 0.0156 1.09 1.3359 0.9883 2067288 IFLab1_002990 O=C(CSc1ncnc2ccccc12)Nc3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H21 compound treatment 0.068 0.00941 0.61 0.066 0.00861 0.6 0.8536 1.0 1354034 IFLab1_002991 Clc1ccccc1c2nnc(NC(=O)CSC3=NCCS3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H22 compound treatment 0.048 -0.0106 -0.68 0.056 -0.00139 -0.1 -0.5507 -0.7996 2067289 IFLab1_002992 O=C(CSc1ncnc2ccccc12)NC3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H23 mock treatment 0.06 0.00141 0.09 0.062 0.00461 0.32 0.2919 0.872 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 H24 mock treatment 0.053 -0.00559 -0.36 0.057 -3.87E-4 -0.03 -0.2737 -0.7581 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I01 compound treatment 0.08 0.0214 1.38 0.083 0.0256 1.79 2.2395 0.9917 2067290 IFLab1_002993 CC(C)(Oc1ccc(Cl)cc1)C(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I02 compound treatment 0.082 0.0234 1.51 0.247 0.19 13.25 10.4319 0.7825 2067291 IFLab1_002994 COc1ccc(CCNC(=O)CCn2c(=O)sc3ccccc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I03 compound treatment 0.482 0.423 27.25 0.466 0.409 28.55 39.4553 0.9997 2067292 IFLab1_002995 Cc1cc2ccccc2n1CCNC(=O)c3ccc(Br)o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I04 compound treatment 0.068 0.00941 0.61 0.065 0.00761 0.53 0.8042 0.9979 2067293 IFLab1_002996 O=C(CCn1c(=O)sc2ccccc12)Nc3ccon3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I05 compound treatment 0.096 0.0374 2.41 0.105 0.0476 3.33 4.0545 0.9874 2067294 IFLab1_002997 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCCn2c(C)cc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I06 compound treatment 0.195 0.136 8.78 0.24 0.183 12.76 15.229 0.9834 2067295 IFLab1_002998 CC1CCCCN1C(=O)c2sc3nc(cn3c2C)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I07 compound treatment 0.103 0.0444 2.86 0.105 0.0476 3.33 4.3731 0.9971 2067296 IFLab1_002999 Cc1cc(NC(=O)C2CC2)nc3c4ccccc4oc(=O)c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I08 compound treatment 0.052 -0.00659 -0.42 0.051 -0.00639 -0.45 -0.6156 -0.9997 2067297 IFLab1_003000 Cc1c(sc2nc(cn12)c3ccc(F)cc3)C(=O)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I09 compound treatment 0.063 0.00441 0.28 0.07 0.0126 0.88 0.8236 0.8897 2067298 IFLab1_003001 CCCn1cc(SCC(=O)N)c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I10 compound treatment 0.07 0.0114 0.73 0.073 0.0156 1.09 1.2904 0.9814 2067299 IFLab1_003002 Cc1cc2cc(CNC(=O)C3CCCC3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I11 compound treatment 0.078 0.0194 1.25 0.067 0.00961 0.67 1.3581 0.9576 2067300 IFLab1_003003 COc1ccc2n(C)c(=NC(=O)CSCC(=O)NC3CCCCC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I12 compound treatment 0.11 0.0514 3.31 0.124 0.0666 4.65 5.6302 0.986 2067301 IFLab1_003004 Cc1cc2cc(CNC(=O)COc3ccccc3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I13 compound treatment 0.254 0.195 12.58 0.064 0.00661 0.46 9.2202 0.7326 2067302 IFLab1_003005 Clc1ccc(OCC(=O)NCc2nnc(SC/C=C/c3ccccc3)o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I14 compound treatment 0.093 0.0344 2.21 0.106 0.0486 3.4 3.9673 0.9785 2067303 IFLab1_003006 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)NCc2ccc3[nH]c(C)cc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I15 compound treatment 0.057 -0.00159 -0.1 0.058 6.13E-4 0.04 -0.0423 -0.3802 2067304 IFLab1_003007 Cc1nc2sc(C(N3CCC(O)CC3)c4ccc(F)cc4)c(O)n2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I16 compound treatment 0.08 0.0214 1.38 0.077 0.0196 1.37 1.9431 1.0 2067305 IFLab1_003008 CCC(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I17 compound treatment 0.052 -0.00659 -0.42 0.055 -0.00239 -0.17 -0.418 -0.9167 2067306 IFLab1_003009 CN1CCN(CC1)C(CNS(=O)(=O)c2ccccc2)c3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I18 compound treatment 0.068 0.00941 0.61 0.07 0.0126 0.88 1.0512 0.9832 2067307 IFLab1_003010 Cc1cc2cc(CNC(=O)CC3CCCCC3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I19 compound treatment 0.057 -0.00159 -0.1 0.059 0.00161 0.11 0.0071 0.0468 2067308 IFLab1_003011 C=CCNC(=O)CCn1c(=O)oc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I20 compound treatment 0.168 0.109 7.04 0.204 0.147 10.24 12.2218 0.9833 2067309 IFLab1_003012 Cc1cc2cc(CNC(=O)COc3ccccc3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I21 compound treatment 0.057 -0.00159 -0.1 0.056 -0.00139 -0.1 -0.1411 -0.9996 1682201 IFLab1_003013 O=C(CCn1c(=O)oc2ccccc12)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I22 compound treatment 0.078 0.0194 1.25 0.079 0.0216 1.51 1.9509 0.9956 2067310 IFLab1_003014 Cc1cc2cc(CNC(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I23 mock treatment 0.068 0.00941 0.61 0.063 0.00561 0.39 0.7054 0.9779 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 I24 mock treatment 0.056 -0.00259 -0.17 0.059 0.00161 0.11 -0.0384 -0.1905 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J01 compound treatment 0.069 0.0104 0.67 0.075 0.0176 1.23 1.3437 0.9591 2067311 IFLab1_003015 CCC(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J02 compound treatment 0.072 0.0134 0.86 0.072 0.0146 1.02 1.332 0.9965 2067312 IFLab1_003016 CCN1CCN(CC1)C(C(C)NC(=O)Cc2ccc(OC)c(OC)c2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J03 compound treatment 0.041 -0.0176 -1.13 0.043 -0.0144 -1.01 -1.5114 -0.9982 2067313 IFLab1_003017 O=C(NCc1ccc2[nH]c3CCCCc3c2c1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J04 compound treatment 0.07 0.0114 0.73 0.075 0.0176 1.23 1.3892 0.9695 2067314 IFLab1_003018 CC(NC(=O)c1ccco1)C(N2CCN(CC2)c3ccccc3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J05 compound treatment 0.1 0.0414 2.67 0.122 0.0646 4.51 5.0763 0.9684 2067315 IFLab1_003019 CN(C)S(=O)(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J06 compound treatment 0.056 -0.00259 -0.17 0.062 0.00461 0.32 0.1098 0.3026 2067316 IFLab1_003020 CCN1CCN(CC1)C(C(C)NS(=O)(=O)C)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J07 compound treatment 0.094 0.0354 2.28 0.095 0.0376 2.63 3.4695 0.9975 2067317 IFLab1_003021 CN(C)S(=O)(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J08 compound treatment 0.078 0.0194 1.25 0.076 0.0186 1.3 1.8027 0.9998 2067318 IFLab1_003022 Cn1cccc1Cc2nnc(SCC(=O)Nc3ccccc3)n2c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J09 compound treatment 0.067 0.00841 0.54 0.065 0.00761 0.53 0.7587 1.0 2067319 IFLab1_003023 Cn1c(SCC(=O)NCc2ccccc2)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J10 compound treatment 0.046 -0.0126 -0.81 0.05 -0.00739 -0.52 -0.9381 -0.9762 2067320 IFLab1_003024 COc1ccc(Cl)cc1N2CC(CC2=O)c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J11 compound treatment 0.074 0.0154 0.99 0.071 0.0136 0.95 1.3736 0.9998 2067321 IFLab1_003025 CCn1c(SCC(=O)Nc2ccccc2)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J12 compound treatment 0.142 0.0834 5.37 0.136 0.0786 5.49 7.6794 0.9999 2067322 IFLab1_003026 O=C(CN1C(=O)CC(Sc2ccccc12)c3ccccc3)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J13 compound treatment 0.079 0.0204 1.31 0.062 0.00461 0.32 1.1566 0.8552 2067323 IFLab1_003027 CCSc1nnc(c2c[nH]c3ccccc23)n1c4ccc(OC)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J14 compound treatment 0.052 -0.00659 -0.42 0.08 0.0226 1.58 0.8169 0.4994 2067324 IFLab1_003028 CCOC(=O)c1[nH]c(C)c(C(=O)N(CC)CC)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J15 compound treatment 0.06 0.00141 0.09 0.063 0.00561 0.39 0.3413 0.848 2067325 IFLab1_003029 COc1ccc(C(=O)NC(C)C(N2CCOCC2)c3cccs3)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J16 compound treatment 0.101 0.0424 2.73 0.094 0.0366 2.56 3.7386 0.9995 2067326 IFLab1_003030 CCOC(=O)c1[nH]c(C)c(C(=O)Nc2cc(C)cc(C)c2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J17 compound treatment 0.051 -0.00759 -0.49 0.055 -0.00239 -0.17 -0.4635 -0.8976 2067327 IFLab1_003031 CC(NC(=O)c1cccs1)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J18 compound treatment 0.15 0.0914 5.88 0.095 0.0376 2.63 6.0182 0.934 2067328 IFLab1_003032 O=C(Nc1nc2ccccc2s1)c3cccn(OCc4ccccc4)c3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J19 compound treatment 0.068 0.00941 0.61 0.068 0.0106 0.74 0.9524 0.9949 2067329 IFLab1_003033 CC(NC(=O)Cc1cccs1)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J20 compound treatment 0.069 0.0104 0.67 0.066 0.00861 0.6 0.8991 0.9986 2067330 IFLab1_003034 FC(F)(F)c1ccccc1NC(=O)CSc2ncnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J21 compound treatment 0.084 0.0254 1.64 0.076 0.0186 1.3 2.0758 0.9936 2067331 IFLab1_003035 Brc1ccc(cc1)c2nnc(NC(=O)CSC3=NCCS3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J22 compound treatment 0.058 -5.94E-4 -0.04 0.058 6.13E-4 0.04 0.0033 0.0567 2067332 IFLab1_003036 O=C(CSc1ncnc2ccccc12)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J23 mock treatment 0.062 0.00341 0.22 0.062 0.00461 0.32 0.3829 0.9824 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 J24 mock treatment 0.061 0.00241 0.15 0.059 0.00161 0.11 0.1892 0.9878 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K01 compound treatment 0.392 0.333 21.46 0.35 0.293 20.44 29.6289 0.9997 2067333 IFLab1_003037 CCOc1ccc(CC(=O)NCCn2ccc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K02 compound treatment 0.069 0.0104 0.67 0.083 0.0256 1.79 1.7389 0.9101 2067334 IFLab1_003038 CC(CCc1ccccc1)NC(=O)CCn2c(=O)sc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K03 compound treatment 0.062 0.00341 0.22 0.069 0.0116 0.81 0.7287 0.8671 2067335 IFLab1_003039 CC(=O)NCCn1c(C)cc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K04 compound treatment 0.064 0.00541 0.35 0.065 0.00761 0.53 0.6221 0.9789 2067336 IFLab1_003040 Cc1cc(NC(=O)CCn2c(=O)sc3ccccc23)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K05 compound treatment 0.079 0.0204 1.31 0.074 0.0166 1.16 1.7494 0.9981 2067337 IFLab1_003041 Cc1cc2ccccc2n1CCNC(=O)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K06 compound treatment 0.067 0.00841 0.54 0.075 0.0176 1.23 1.2526 0.9319 2067338 IFLab1_003042 CC1CN(CC(C)O1)C(=O)c2sc3nc(cn3c2C)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K07 compound treatment 0.123 0.0644 4.15 0.11 0.0526 3.68 5.5303 0.9982 2067339 IFLab1_003043 Cc1cc(NC(=O)C2CCCC2)nc3c4ccccc4oc(=O)c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K08 compound treatment 0.062 0.00341 0.22 0.06 0.00261 0.18 0.2841 0.9959 2067340 IFLab1_003044 CC(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K09 compound treatment 0.075 0.0164 1.06 0.073 0.0156 1.09 1.5179 0.9999 2067341 IFLab1_003045 NC(=O)CSc1cn(Cc2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K10 compound treatment 0.077 0.0184 1.18 0.079 0.0216 1.51 1.9054 0.9928 2067342 IFLab1_003046 Cc1cc2cc(CNC(=O)CC3CCCCC3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K11 compound treatment 0.06 0.00141 0.09 0.068 0.0106 0.74 0.5883 0.7876 2067343 IFLab1_003047 COc1ccc2n(C)c(=NC(=O)CSCC(=O)N3CCc4ccccc34)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K12 compound treatment 0.164 0.105 6.78 0.122 0.0646 4.51 7.9891 0.9804 2067344 IFLab1_003048 CC(Oc1ccccc1)C(=O)NCc2ccc3[nH]c(C)cc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K13 compound treatment 0.261 0.202 13.03 0.264 0.207 14.43 19.4184 0.9987 2067345 IFLab1_003049 Fc1ccccc1C(=O)NCc2nnc(SC/C=C/c3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K14 compound treatment 0.099 0.0404 2.6 0.091 0.0336 2.35 3.4994 0.9987 2067346 IFLab1_003050 Cc1cc2cc(CNC(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K15 compound treatment 0.054 -0.00459 -0.3 0.05 -0.00739 -0.52 -0.574 -0.9651 2067347 IFLab1_003051 CN1CCN(CC1)C(c2sc3nc(C)nn3c2O)c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K16 compound treatment 0.081 0.0224 1.44 0.072 0.0146 1.02 1.7416 0.9857 2067348 IFLab1_003052 CCCC(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K17 compound treatment 0.058 -5.94E-4 -0.04 0.063 0.00561 0.39 0.2502 0.6352 2067349 IFLab1_003053 O=S(=O)(NCC(N1CCOCC1)c2cccnc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K18 compound treatment 0.079 0.0204 1.31 0.093 0.0356 2.49 2.688 0.9554 2067350 IFLab1_003054 Cc1cc2cc(CNC(=O)CCC3CCCC3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K19 compound treatment 0.054 -0.00459 -0.3 0.06 0.00261 0.18 -0.08 -0.2302 2067351 IFLab1_003055 O=C(CCn1c(=O)oc2ccccc12)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K20 compound treatment 0.299 0.24 15.47 0.338 0.281 19.6 24.8034 0.9931 2067352 IFLab1_003056 CC(Oc1ccccc1)C(=O)NCc2ccc3n(C)c(C)cc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K21 compound treatment 0.06 0.00141 0.09 0.058 6.13E-4 0.04 0.0943 0.9416 2067353 IFLab1_003057 O=C(CCn1c(=O)oc2ccccc12)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K22 compound treatment 0.093 0.0344 2.21 0.089 0.0316 2.21 3.1276 1.0 2067354 IFLab1_003058 Cc1cc2cc(CNC(=O)c3ccco3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K23 mock treatment 0.061 0.00241 0.15 0.055 -0.00239 -0.17 -0.0084 -0.0369 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 K24 mock treatment 0.06 0.00141 0.09 0.055 -0.00239 -0.17 -0.0539 -0.2842 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L01 compound treatment 0.068 0.00941 0.61 0.072 0.0146 1.02 1.15 0.9689 2067355 IFLab1_003059 CCCC(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L02 compound treatment 0.065 0.00641 0.41 0.062 0.00461 0.32 0.5194 0.9926 2067356 IFLab1_003060 CCN1CCN(CC1)C(C(C)NC(=O)Cc2ccc(F)cc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L03 compound treatment 0.422 0.363 23.39 0.451 0.394 27.5 35.9835 0.9968 2067357 IFLab1_003061 O=C(COc1ccccc1)NCc2ccc3[nH]c4CCCCc4c3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L04 compound treatment 0.075 0.0164 1.06 0.063 0.00561 0.39 1.024 0.909 2067358 IFLab1_003062 CC(NC(=O)c1ccncc1)C(N2CCN(CC2)c3ccccc3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L05 compound treatment 0.343 0.284 18.31 0.366 0.309 21.56 28.1891 0.9967 2067359 IFLab1_003063 Cc1cc2cc(CNS(=O)(=O)c3ccccc3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L06 compound treatment 0.053 -0.00559 -0.36 0.061 0.00361 0.25 -0.0761 -0.1731 2067360 IFLab1_003064 CCN1CCN(CC1)C(C(C)NS(=O)(=O)c2ccccc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L07 compound treatment 0.076 0.0174 1.12 0.078 0.0206 1.44 1.8105 0.9923 2067361 IFLab1_003065 CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc2ccc3[nH]c4CCCCc4c3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L08 compound treatment 0.06 0.00141 0.09 0.061 0.00361 0.25 0.2425 0.9043 2067362 IFLab1_003066 Cc1ccc(N2CC(CC2=O)c3nc4ccccc4[nH]3)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L09 compound treatment 0.063 0.00441 0.28 0.066 0.00861 0.6 0.626 0.9411 2067363 IFLab1_003067 Cn1c(SCc2ccccc2)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L10 compound treatment 0.063 0.00441 0.28 0.05 -0.00739 -0.52 -0.1644 -0.2791 2067364 IFLab1_003068 CSc1nnc(Cn2c(=O)sc3ccccc23)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L11 compound treatment 0.058 -5.94E-4 -0.04 0.059 0.00161 0.11 0.0527 0.4425 2067365 IFLab1_003069 CCn1c(SCC(=O)NC2CCCC2)nnc1c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L12 compound treatment 0.154 0.0954 6.14 0.114 0.0566 3.95 7.1388 0.9774 2067366 IFLab1_003070 O=C(CN1C(=O)CC(Sc2ccccc12)c3ccccc3)NC4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L13 compound treatment 0.065 0.00641 0.41 0.059 0.00161 0.11 0.3712 0.8685 2067367 IFLab1_003071 CCOc1ccc(cc1)n2c(SC)nnc2c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L14 compound treatment 0.058 -5.94E-4 -0.04 0.055 -0.00239 -0.17 -0.1449 -0.8472 2067368 IFLab1_003072 CCOC(=O)c1[nH]c(C)c(C(=O)N2CCCCCC2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L15 compound treatment 0.058 -5.94E-4 -0.04 0.056 -0.00139 -0.1 -0.0955 -0.9172 2067369 IFLab1_003073 CC(NC(=O)c1ccc2OCOc2c1)C(N3CCOCC3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L16 compound treatment 0.068 0.00941 0.61 0.061 0.00361 0.25 0.6066 0.9247 2067370 IFLab1_003074 CCOC(=O)c1c(C)c(C(=O)NC2CCCCC2)c(C)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L17 compound treatment 0.053 -0.00559 -0.36 0.05 -0.00739 -0.52 -0.6195 -0.9845 2067371 IFLab1_003075 CC(NC(=O)Oc1ccccc1)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L18 compound treatment 0.184 0.125 8.07 0.162 0.105 7.31 10.8753 0.9988 2067372 IFLab1_003076 Cc1csc(NC(=O)c2cccn(OCc3ccccc3)c2=O)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L19 compound treatment 0.061 0.00241 0.15 0.054 -0.00339 -0.24 -0.0578 -0.2044 2067373 IFLab1_003077 CC(NC(=O)c1ccco1)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L20 compound treatment 0.061 0.00241 0.15 0.057 -3.87E-4 -0.03 0.0904 0.5749 2067374 IFLab1_003078 FC(F)(F)c1ccc(Cl)c(NC(=O)CSc2ncnc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L21 compound treatment 0.073 0.0144 0.93 0.074 0.0166 1.16 1.4763 0.9938 1355836 IFLab1_003079 COc1ccccc1c2nnc(NC(=O)CSC3=NCCS3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L22 compound treatment 0.055 -0.00359 -0.23 0.061 0.00361 0.25 0.0149 0.0435 2067375 IFLab1_003080 O=C(CSc1ncnc2ccccc12)NCc3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L23 mock treatment 0.059 4.06E-4 0.03 0.057 -3.87E-4 -0.03 -6.0E-4 -0.0168 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 L24 mock treatment 0.054 -0.00459 -0.3 0.055 -0.00239 -0.17 -0.327 -0.9633 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M01 compound treatment 0.083 0.0244 1.57 0.076 0.0186 1.3 2.0302 0.9956 2067376 IFLab1_003081 O=C(NCCn1ccc2ccccc12)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M02 compound treatment 0.083 0.0244 1.57 0.078 0.0206 1.44 2.129 0.9991 2067377 IFLab1_003082 O=C(CCn1c(=O)sc2ccccc12)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M03 compound treatment 0.216 0.157 10.13 0.204 0.147 10.24 14.4065 1.0 2067378 IFLab1_003083 Cc1cc2ccccc2n1CCNC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M04 compound treatment 0.06 0.00141 0.09 0.073 0.0156 1.09 0.8353 0.7632 2067379 IFLab1_003084 Cc1nnc(NC(=O)CCn2c(=O)sc3ccccc23)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M05 compound treatment 0.129 0.0704 4.53 0.118 0.0606 4.23 6.1986 0.9994 2067380 IFLab1_003085 O=S(=O)(NCCn1ccc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M06 compound treatment 0.053 -0.00559 -0.36 0.058 6.13E-4 0.04 -0.2243 -0.6187 2067381 IFLab1_003086 COC(CNC(=O)c1sc2nc(cn2c1C)c3ccccc3)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M07 compound treatment 0.122 0.0634 4.08 0.087 0.0296 2.07 4.3486 0.9504 2067382 IFLab1_003087 CC(C)CC(=O)Nc1cc(C)c2c(=O)oc3ccccc3c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M08 compound treatment 0.06 0.00141 0.09 0.063 0.00561 0.39 0.3413 0.848 2067383 IFLab1_003088 CCC(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M09 compound treatment 0.074 0.0154 0.99 0.073 0.0156 1.09 1.4724 0.9989 2067384 IFLab1_003089 O=C(CSc1c[nH]c2ccccc12)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M10 compound treatment 0.089 0.0304 1.96 0.097 0.0396 2.77 3.3407 0.9856 2067385 IFLab1_003090 Cc1cc2cc(CNC(=O)CCC3CCCC3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M11 compound treatment 0.059 4.06E-4 0.03 0.061 0.00361 0.25 0.197 0.7762 2067386 IFLab1_003091 COc1ccc2n(C)c(=NC(=O)CSCC(=O)N3CCCc4ccccc34)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M12 compound treatment 0.121 0.0624 4.02 0.097 0.0396 2.77 4.7971 0.9835 2067387 IFLab1_003092 Cc1cc2cc(CNC(=O)Cc3ccccc3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M13 compound treatment 0.462 0.403 25.97 0.329 0.272 18.97 31.7774 0.9881 2067388 IFLab1_003093 O=C(NCc1nnc(SC/C=C/c2ccccc2)o1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M14 compound treatment 0.064 0.00541 0.35 0.063 0.00561 0.39 0.5233 0.9982 1628828 IFLab1_003094 Cc1cc2cc(CNC(=O)c3ccco3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M15 compound treatment 0.057 -0.00159 -0.1 0.158 0.101 7.03 4.8976 0.6967 2067389 IFLab1_003095 CC1CCN(CC1)C(c2cccs2)c3sc4nc(C)nn4c3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M16 compound treatment 0.109 0.0504 3.24 0.088 0.0306 2.14 3.8064 0.9795 2067390 IFLab1_003096 CC(C)C(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M17 compound treatment 0.05 -0.00859 -0.55 0.045 -0.0124 -0.87 -1.003 -0.9766 2067391 IFLab1_003097 CCN(CC)C(=O)CCn1c(=O)oc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M18 compound treatment 0.066 0.00741 0.48 0.073 0.0156 1.09 1.1083 0.9311 2067392 IFLab1_003098 COCC(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M19 compound treatment 0.056 -0.00259 -0.17 0.058 6.13E-4 0.04 -0.0878 -0.5093 2067393 IFLab1_003099 CC(NC(=O)CCn1c(=O)oc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M20 compound treatment 0.106 0.0474 3.05 0.107 0.0496 3.47 4.6084 0.998 2067394 IFLab1_003100 Cc1cc2cc(CNC(=O)Cc3ccccc3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M21 compound treatment 0.055 -0.00359 -0.23 0.052 -0.00539 -0.38 -0.4297 -0.9727 2067395 IFLab1_003101 O=C(CCn1c(=O)oc2ccccc12)NC3=NCCS3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M22 compound treatment 0.103 0.0444 2.86 0.098 0.0406 2.84 4.0273 1.0 2067396 IFLab1_003102 Cc1cc2cc(CNC(=O)c3cccs3)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M23 mock treatment 0.067 0.00841 0.54 0.058 6.13E-4 0.04 0.4129 0.7607 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 M24 mock treatment 0.06 0.00141 0.09 0.058 6.13E-4 0.04 0.0943 0.9416 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N01 compound treatment 0.088 0.0294 1.89 0.085 0.0276 1.93 2.7024 1.0 2067397 IFLab1_003103 CC(C)C(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N02 compound treatment 0.063 0.00441 0.28 0.066 0.00861 0.6 0.626 0.9411 2067398 IFLab1_003104 CCN1CCN(CC1)C(C(C)NC(=O)Cc2cccs2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N03 compound treatment 0.158 0.0994 6.4 0.158 0.101 7.03 9.4944 0.9989 2067399 IFLab1_003105 O=C(Cc1ccccc1)NCc2ccc3[nH]c4CCCCc4c3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N04 compound treatment 0.067 0.00841 0.54 0.067 0.00961 0.67 0.8575 0.9943 2067400 IFLab1_003106 CC(NC(=O)Oc1ccccc1)C(N2CCN(CC2)c3ccccc3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N05 compound treatment 0.112 0.0534 3.44 0.119 0.0616 4.3 5.4742 0.9938 2067401 IFLab1_003107 Cc1cc2cc(CNS(=O)(=O)C)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N06 compound treatment 0.062 0.00341 0.22 0.066 0.00861 0.6 0.5805 0.9065 2067402 IFLab1_003108 CC(NS(=O)(=O)C)C(N1CCN(CC1)c2ccccc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N07 compound treatment 0.063 0.00441 0.28 0.058 6.13E-4 0.04 0.2308 0.8047 2067403 IFLab1_003109 CSc1nnc(c2c[nH]c3ccccc23)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N08 compound treatment 0.062 0.00341 0.22 0.058 6.13E-4 0.04 0.1853 0.8295 2067404 IFLab1_003110 O=C1CC(CN1Cc2ccccc2)c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N09 compound treatment 0.058 -5.94E-4 -0.04 0.064 0.00661 0.46 0.2996 0.6464 2067405 IFLab1_003111 COC(=O)CSc1nnc(c2c[nH]c3ccccc23)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N10 compound treatment 0.072 0.0134 0.86 0.076 0.0186 1.3 1.5296 0.9802 2067406 IFLab1_003112 Cn1c(Cn2c(=O)sc3ccccc23)nnc1SC4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N11 compound treatment 0.061 0.00241 0.15 0.061 0.00361 0.25 0.288 0.9725 2067407 IFLab1_003113 CCn1c(SCC(=O)OC)nnc1c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N12 compound treatment 0.073 0.0144 0.93 0.069 0.0116 0.81 1.2293 0.9978 2067408 IFLab1_003114 O=C(CN1C(=O)CC(Sc2ccccc12)c3ccccc3)NCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N13 compound treatment 0.062 0.00341 0.22 0.058 6.13E-4 0.04 0.1853 0.8295 2067409 IFLab1_003115 CSc1nnc(c2c[nH]c3ccccc23)n1c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N14 compound treatment 0.062 0.00341 0.22 0.068 0.0106 0.74 0.6793 0.8786 2067410 IFLab1_003116 CCOC(=O)c1[nH]c(C)c(C(=O)N2CCCCC2C)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N15 compound treatment 0.056 -0.00259 -0.17 0.053 -0.00439 -0.31 -0.3348 -0.9592 2067411 IFLab1_003117 CC(NC(=O)c1ccc(F)cc1)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N16 compound treatment 0.277 0.218 14.06 0.354 0.297 20.72 24.5925 0.9821 2067412 IFLab1_003118 CCOC(=O)c1c(C)c(C(=O)NCc2ccccc2)c(C)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N17 compound treatment 0.051 -0.00759 -0.49 0.052 -0.00539 -0.38 -0.6117 -0.9917 2067413 IFLab1_003119 CC(C)C(=O)NC(C)C(N1CCN(C)CC1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N18 compound treatment 0.065 0.00641 0.41 0.054 -0.00339 -0.24 0.1242 0.2614 2067414 IFLab1_003120 O=C(CSc1ncnc2ccccc12)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N19 compound treatment 0.058 -5.94E-4 -0.04 0.057 -3.87E-4 -0.03 -0.0461 -0.9857 2067415 IFLab1_003121 CC(NC(=O)c1cccs1)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N20 compound treatment 0.135 0.0764 4.92 0.144 0.0866 6.05 7.756 0.9947 2067416 IFLab1_003122 CCOC(=O)c1ccccc1NC(=O)CSc2ncnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N21 compound treatment 0.24 0.181 11.68 0.195 0.138 9.61 15.0542 0.9953 2067417 IFLab1_003123 Cc1cc(C)c(c2nnc(NC(=O)CSC3=NCCS3)s2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N22 compound treatment 0.058 -5.94E-4 -0.04 0.053 -0.00439 -0.31 -0.2437 -0.7892 2067418 IFLab1_003124 O=C(CSc1ncnc2ccccc12)NCC3CCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N23 mock treatment 0.061 0.00241 0.15 0.061 0.00361 0.25 0.288 0.9725 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 N24 mock treatment 0.057 -0.00159 -0.1 0.056 -0.00139 -0.1 -0.1411 -0.9996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O01 compound treatment 0.099 0.0404 2.6 0.087 0.0296 2.07 3.3018 0.9936 2067419 IFLab1_003125 Cc1cc2ccccc2n1CCNC(=O)Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O02 compound treatment 0.062 0.00341 0.22 0.063 0.00561 0.39 0.4323 0.9623 2067420 IFLab1_003126 COc1ccccc1NC(=O)CCn2c(=O)sc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O03 compound treatment 0.068 0.00941 0.61 0.066 0.00861 0.6 0.8536 1.0 2067421 IFLab1_003127 CC(C)C(=O)NCCn1c(C)cc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O04 compound treatment 0.065 0.00641 0.41 0.067 0.00961 0.67 0.7664 0.9726 2067422 IFLab1_003128 CC(=O)Nc1cccc(NC(=O)CCn2c(=O)sc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O05 compound treatment 0.16 0.101 6.53 0.163 0.106 7.38 9.8324 0.9981 2067423 IFLab1_003129 COc1ccc(cc1)S(=O)(=O)NCCn2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O06 compound treatment 0.064 0.00541 0.35 0.065 0.00761 0.53 0.6221 0.9789 2067424 IFLab1_003130 Cc1c(sc2nc(cn12)c3ccccc3)C(=O)NCCN4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O07 compound treatment 0.073 0.0144 0.93 0.064 0.00661 0.46 0.9823 0.9482 2067425 IFLab1_003131 CC(=O)Nc1cc(C)c2c(=O)oc3ccccc3c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O08 compound treatment 0.068 0.00941 0.61 0.081 0.0236 1.65 1.5945 0.9074 2067426 IFLab1_003132 CC(C)C(=O)NCc1ccc2[nH]c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O09 compound treatment 0.067 0.00841 0.54 0.07 0.0126 0.88 1.0056 0.9726 2067427 IFLab1_003133 CCOC(=O)C1C(CC(=CC1=O)c2ccco2)c3ccc(cc3)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O10 compound treatment 0.082 0.0234 1.51 0.08 0.0226 1.58 2.1823 0.9997 2067428 IFLab1_003134 Cc1cc2cc(CNC(=O)c3ccccc3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O11 compound treatment 0.062 0.00341 0.22 0.059 0.00161 0.11 0.2347 0.9521 2067429 IFLab1_003135 CCn1c(=NC(=O)CSCC(=O)N2CCN(CC2)c3ccccc3)sc4cc(F)ccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O12 compound treatment 0.17 0.111 7.17 0.161 0.104 7.24 10.1887 1.0 2067430 IFLab1_003136 CCC(C(=O)NCc1ccc2[nH]c(C)cc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O13 compound treatment 0.16 0.101 6.53 0.202 0.145 10.1 11.7589 0.9777 2067431 IFLab1_003137 O=C(NCc1nnc(SC/C=C/c2ccccc2)o1)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O14 compound treatment 0.071 0.0124 0.8 0.076 0.0186 1.3 1.4841 0.9726 2067432 IFLab1_003138 Cc1cc2cc(CNC(=O)c3cccs3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O15 compound treatment 0.07 0.0114 0.73 0.061 0.00361 0.25 0.6976 0.8986 2067433 IFLab1_003139 CC1CC(C)CN(C1)C(c2cccs2)c3sc4nc(C)nn4c3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O16 compound treatment 0.086 0.0274 1.76 0.086 0.0286 2.0 2.6608 0.9981 2067434 IFLab1_003140 CCCCC(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O17 compound treatment 0.066 0.00741 0.48 0.059 0.00161 0.11 0.4168 0.8508 2067435 IFLab1_003141 CCCN(CCC)C(=O)CCn1c(=O)oc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O18 compound treatment 0.085 0.0264 1.7 0.078 0.0206 1.44 2.2201 0.9966 2067436 IFLab1_003142 CCOCC(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O19 compound treatment 0.053 -0.00559 -0.36 0.056 -0.00139 -0.1 -0.3231 -0.8666 2067437 IFLab1_003143 O=C(CCn1c(=O)oc2ccccc12)NCc3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O20 compound treatment 0.169 0.11 7.11 0.167 0.11 7.66 10.4396 0.9993 2067438 IFLab1_003144 CCC(C(=O)NCc1ccc2n(C)c(C)cc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O21 compound treatment 0.061 0.00241 0.15 0.054 -0.00339 -0.24 -0.0578 -0.2044 2067439 IFLab1_003145 O=C(CCn1c(=O)sc2ccccc12)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O22 compound treatment 0.065 0.00641 0.41 0.056 -0.00139 -0.1 0.223 0.5266 2067440 IFLab1_003146 Cc1cc2cc(CNC(=O)c3cc4ccccc4oc3=O)ccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O23 mock treatment 0.06 0.00141 0.09 0.053 -0.00439 -0.31 -0.1527 -0.4779 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 O24 mock treatment 0.059 4.06E-4 0.03 0.057 -3.87E-4 -0.03 -6.0E-4 -0.0168 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P01 compound treatment 0.124 0.0654 4.21 0.115 0.0576 4.02 5.8228 0.9997 2067441 IFLab1_003147 CCCCC(=O)NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P02 compound treatment 0.081 0.0224 1.44 0.069 0.0116 0.81 1.5934 0.963 2067442 IFLab1_003148 CCN1CCN(CC1)C(C(C)NC(=O)c2ccco2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P03 compound treatment 0.106 0.0474 3.05 0.111 0.0536 3.75 4.806 0.9948 2067443 IFLab1_003149 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCc2ccc3[nH]c4CCCCc4c3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P04 compound treatment 0.065 0.00641 0.41 0.069 0.0116 0.81 0.8652 0.9507 2067444 IFLab1_003150 CC(NC(=O)c1cccs1)C(N2CCN(Cc3ccccc3)CC2)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P05 compound treatment 0.127 0.0684 4.4 0.153 0.0956 6.68 7.8365 0.9795 2067445 IFLab1_003151 CCS(=O)(=O)NCc1ccc2n(C)c(C)cc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P06 compound treatment 0.078 0.0194 1.25 0.067 0.00961 0.67 1.3581 0.9576 2067446 IFLab1_003152 CC(NS(=O)(=O)c1ccccc1)C(N2CCN(CC2)c3ccccc3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P07 compound treatment 0.064 0.00541 0.35 0.066 0.00861 0.6 0.6715 0.9661 2067447 IFLab1_003153 Cn1c(SCC=C)nnc1c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P08 compound treatment 0.055 -0.00359 -0.23 0.061 0.00361 0.25 0.0149 0.0435 2067448 IFLab1_003154 Cn1c(nc2ccccc12)C3CN(Cc4ccccc4)C(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P09 compound treatment 0.071 0.0124 0.8 0.07 0.0126 0.88 1.1877 0.9988 2067449 IFLab1_003155 CCOC(=O)C(CC)Sc1nnc(c2c[nH]c3ccccc23)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P10 compound treatment 0.068 0.00941 0.61 0.073 0.0156 1.09 1.1994 0.9614 2067450 IFLab1_003156 CSc1nnc(Cn2c(=O)sc3ccccc23)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P11 compound treatment 0.06 0.00141 0.09 0.062 0.00461 0.32 0.2919 0.872 2067451 IFLab1_003157 CCC(Sc1nnc(c2c[nH]c3ccccc23)n1CC)C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P12 compound treatment 0.065 0.00641 0.41 0.061 0.00361 0.25 0.47 0.9723 2067452 IFLab1_003158 O=C(CN1C(=O)CC(Sc2ccccc12)c3ccccc3)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P13 compound treatment 0.066 0.00741 0.48 0.066 0.00861 0.6 0.7625 0.9933 2067453 IFLab1_003159 NC(=O)CSc1nnc(c2c[nH]c3ccccc23)n1c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P14 compound treatment 0.059 4.06E-4 0.03 0.059 0.00161 0.11 0.0982 0.8486 2067454 IFLab1_003160 CCOC(=O)c1[nH]c(C)c(C(=O)N2CCOCC2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P15 compound treatment 0.059 4.06E-4 0.03 0.06 0.00261 0.18 0.1476 0.8002 2067455 IFLab1_003161 CC(NC(=O)c1c(F)cccc1F)C(N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P16 compound treatment 0.058 -5.94E-4 -0.04 0.059 0.00161 0.11 0.0527 0.4425 2067456 IFLab1_003162 CCOC(=O)c1c(C)c(C(=O)Nc2ccc(C)cc2)c(C)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P17 compound treatment 0.054 -0.00459 -0.3 0.057 -3.87E-4 -0.03 -0.2282 -0.7686 2067457 IFLab1_003163 COc1ccccc1C(=O)NC(C)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P18 compound treatment 0.056 -0.00259 -0.17 0.057 -3.87E-4 -0.03 -0.1372 -0.8111 2067458 IFLab1_003164 O=C(CSc1ncnc2ccccc12)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P19 compound treatment 0.061 0.00241 0.15 0.062 0.00461 0.32 0.3374 0.9436 2067459 IFLab1_003165 CC(NC(=O)c1ccc(cc1)N(C)C)C(N2CCN(C)CC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P20 compound treatment 0.071 0.0124 0.8 0.065 0.00761 0.53 0.9407 0.9805 2067460 IFLab1_003166 CCOC(=O)c1ccc(NC(=O)CSc2ncnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P21 compound treatment 0.073 0.0144 0.93 0.075 0.0176 1.23 1.5257 0.9903 2067461 IFLab1_003167 CCSc1nnc(NC(=O)CSC2=NCCS2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P22 compound treatment 0.064 0.00541 0.35 0.064 0.00661 0.46 0.5727 0.9902 2067462 IFLab1_003168 CCOC(=O)C1CCN(CC1)C(=O)c2sc3nc(cn3c2C)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P23 mock treatment 0.062 0.00341 0.22 0.058 6.13E-4 0.04 0.1853 0.8295 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1420 P24 mock treatment 0.056 -0.00259 -0.17 0.057 -3.87E-4 -0.03 -0.1372 -0.8111 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A01 compound treatment 0.108 0.0399 2.57 0.106 0.047 3.28 4.1393 0.9927 2067463 IFLab1_003169 O=C(CSc1ncnc2ccccc12)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A02 compound treatment 0.117 0.0489 3.15 0.111 0.052 3.63 4.7959 0.9975 1707401 IFLab1_003170 Cc1nc2c(ccc3nc(NC(=O)C4CC4)sc32)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A03 compound treatment 0.098 0.0299 1.93 0.085 0.026 1.82 2.6468 0.9996 2067464 IFLab1_003171 Cc1ccc(C)c(CSc2ncnc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A04 compound treatment 0.084 0.0159 1.03 0.079 0.02 1.4 1.7132 0.9884 1243518 IFLab1_003172 Cc1cc(C)c(c(C)c1)S(=O)(=O)N2CCNC(=O)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A05 compound treatment 0.092 0.0239 1.54 0.081 0.022 1.54 2.1761 1.0 2067465 IFLab1_003173 Fc1ccc(cc1)c2nnc3ccc(SCC(=O)OCc4ccccc4)nn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A06 compound treatment 0.041 -0.0271 -1.74 0.052 -0.007 -0.49 -1.5776 -0.8719 2067466 IFLab1_003174 N#CC(=C(/C=C/c1ccccc1)C2CC2)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A07 compound treatment 0.053 -0.0151 -0.97 0.052 -0.007 -0.49 -1.0314 -0.9498 1486765 IFLab1_003175 CCOC(=O)c1csc(NC(=O)COc2ccc(Cl)cc2Cl)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A08 compound treatment 0.157 0.0889 5.72 0.128 0.069 4.82 7.4562 0.9963 1453180 IFLab1_003176 Cc1ccc2nc(NCCO)nc(c3ccccc3)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A09 compound treatment 0.087 0.0189 1.22 0.073 0.014 0.98 1.5534 0.994 1125483 IFLab1_003177 CC(C)c1cc(NS(=O)(=O)c2ccccc2)c(C)cc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A10 compound treatment 0.125 0.0569 3.66 0.102 0.043 3.0 4.7154 0.9951 1290154 IFLab1_003178 O=C(N1CCN(CC1)c2ccccc2)C3(CC3)S(=O)(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A11 compound treatment 0.066 -0.00206 -0.13 0.065 0.006 0.42 0.2024 0.4604 1449642 IFLab1_003179 COc1ccc(NC(=O)c2csc3CCCCc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A12 compound treatment 0.131 0.0629 4.05 0.121 0.062 4.33 5.9271 0.9994 2067467 IFLab1_003180 Cc1ccc(o1)c2csc(NC(=O)/C=C/c3ccccc3)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A13 compound treatment 0.104 0.0359 2.31 0.086 0.027 1.89 2.9693 0.9949 1682012 IFLab1_003181 C=CCN(CC=C)S(=O)(=O)c1ccc(cc1)C(=O)N2CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A14 compound treatment 0.082 0.0139 0.9 0.077 0.018 1.26 1.5234 0.9863 1382951 IFLab1_003182 COC(=O)c1ccc(Oc2coc3cc(O)ccc3c2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A15 compound treatment 0.086 0.0179 1.15 0.081 0.022 1.54 1.9031 0.9901 2067468 IFLab1_003183 Clc1cc(C(=O)Nc2ccc3OCOc3c2)c(Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A16 compound treatment 0.099 0.0309 1.99 0.086 0.027 1.89 2.7417 0.9996 1506201 IFLab1_003184 COc1cc(C)c2c(=O)c(Oc3ccccc3)c(C)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A17 compound treatment 0.062 -0.00606 -0.39 0.058 -0.001 -0.07 -0.3254 -0.8206 1429516 IFLab1_003185 CC1CCCN(CC(O)COCc2ccc3OCOc3c2)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A18 compound treatment 0.116 0.0479 3.09 0.092 0.033 2.31 3.8118 0.9897 2067469 IFLab1_003186 Fc1ccc(cc1)c2csc3nc[nH]c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A19 compound treatment 0.064 -0.00406 -0.26 0.065 0.006 0.42 0.1114 0.2255 1692215 IFLab1_003187 OC(COc1ccc(Cl)cc1)CN2CCC(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A20 compound treatment 0.122 0.0539 3.47 0.106 0.047 3.28 4.7765 0.9996 1726881 IFLab1_003188 C1Cc2sc3ncnc(N4CCCCC4)c3c2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A21 compound treatment 0.508 0.44 28.32 0.287 0.228 15.93 31.2856 0.963 1983497 IFLab1_003189 Brc1ccccc1C(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A22 compound treatment 0.089 0.0209 1.35 0.079 0.02 1.4 1.9408 0.9998 1308511 IFLab1_003190 O=S(=O)(Nc1cccnc1)c2ccc3OCCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A23 mock treatment 0.074 0.00594 0.38 0.081 0.022 1.54 1.3569 0.8568 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 A24 mock treatment 0.095 0.0269 1.73 0.08 0.021 1.47 2.2633 0.9965 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B01 compound treatment 0.107 0.0389 2.51 0.09 0.031 2.17 3.3034 0.9974 2067470 IFLab1_003191 COc1ccc2c(C)cc(SCc3c(C)noc3C)nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B02 compound treatment 0.081 0.0129 0.83 0.087 0.028 1.96 1.9719 0.9276 2067471 IFLab1_003192 CC(=O)Nc1ccc(N/C=C(/C#N)\c2nc(cs2)c3ccc(Cl)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B03 compound treatment 0.125 0.0569 3.66 0.107 0.048 3.35 4.9624 0.999 2067472 IFLab1_003193 CCc1nc2sc3CCCc3c2c4nncn14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B04 compound treatment 0.101 0.0329 2.12 0.092 0.033 2.31 3.1291 0.9991 2067473 IFLab1_003194 CCOC(=O)CCN1C(=O)/C(=C\c2cccs2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B05 compound treatment 0.135 0.0669 4.31 0.108 0.049 3.42 5.4669 0.9935 1355776 IFLab1_003195 CC1CN(CC(C)O1)c2nc(C)nc3sc4CCCc4c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B06 compound treatment 0.089 0.0209 1.35 0.082 0.023 1.61 2.089 0.9962 1517771 IFLab1_003196 OC(=O)C1CCCN(C1)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B07 compound treatment 0.392 0.324 20.85 0.283 0.224 15.65 25.8085 0.99 1371219 IFLab1_003197 COc1ccc(cc1OC)c2csc3ncn(n4c(C)ccc4C)c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B08 compound treatment 0.13 0.0619 3.99 0.148 0.089 6.22 7.2153 0.9769 1238926 IFLab1_003198 O=C(Nc1ccc2ccccc2c1)C3CCCN(C3)S(=O)(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B09 compound treatment 0.31 0.242 15.57 0.178 0.119 8.31 16.8896 0.9568 2067474 IFLab1_003199 CCSc1nnc(NC(=O)C(C)SC2=NCCS2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B10 compound treatment 0.08 0.0119 0.77 0.075 0.016 1.12 1.3336 0.9833 1285934 IFLab1_003200 CC1(CC2CC(C)(C)C1)CN2C(=O)C3CCN(CC3)S(=O)(=O)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B11 compound treatment 0.137 0.0689 4.44 0.097 0.038 2.65 5.0146 0.9698 2067475 IFLab1_003201 COc1cccc(/C=C/2\SC(=S)N(CCCC(=O)NC(C)(C)C)C2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B12 compound treatment 0.081 0.0129 0.83 0.076 0.017 1.19 1.4285 0.9849 1414036 IFLab1_003202 OC(=O)CCC(=O)Nc1nc(cs1)c2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B13 compound treatment 0.077 0.00894 0.58 0.071 0.012 0.84 0.9995 0.9831 1644254 IFLab1_003203 OC(=O)c1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B14 compound treatment 0.935 0.867 55.8 0.761 0.702 49.04 74.1344 0.9979 2067476 IFLab1_003204 Oc1ccccc1/C=N/c2oc(c3ccco3)c(c2C#N)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B15 compound treatment 0.649 0.581 37.39 0.525 0.466 32.55 49.4597 0.9976 2067477 IFLab1_003205 Cc1nn(CO)c(C)c1Sc2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B16 compound treatment 0.13 0.0619 3.99 0.139 0.08 5.59 6.7707 0.9863 1224211 IFLab1_003206 CCOC(=O)c1c(NC(=O)c2ccccc2C(=O)O)scc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B17 compound treatment 0.276 0.208 13.38 0.248 0.189 13.2 18.8 1.0 1405871 IFLab1_003207 Cc1[nH]nc(c1c2ccccc2C)c3ccc(O)c(C)c3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B18 compound treatment 0.126 0.0579 3.73 0.114 0.055 3.84 5.3537 0.9999 2067478 IFLab1_003208 Cc1nc(c(C)s1)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B19 compound treatment 0.984 0.916 58.95 0.838 0.779 54.42 80.1682 0.9992 1180360 IFLab1_003209 COc1ccc(c2n[nH]cc2c3ccccc3)c(O)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B20 compound treatment 0.105 0.0369 2.38 0.092 0.033 2.31 3.3112 0.9999 2067479 IFLab1_003210 Cc1sc(/N=C/c2ccco2)c(C#N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B21 compound treatment 0.104 0.0359 2.31 0.078 0.019 1.33 2.5741 0.9652 2067480 IFLab1_003211 Cc1cccc(N/C=C(\C#N)/c2nc(cs2)c3ccc4OCOc4c3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B22 compound treatment 0.072 0.00394 0.25 0.046 -0.013 -0.91 -0.4631 -0.4911 1468849 IFLab1_003212 COc1ccc2oc(=O)c(cc2c1)C(=O)n3ccnc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B23 mock treatment 0.099 0.0309 1.99 0.086 0.027 1.89 2.7417 0.9996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 B24 mock treatment 0.087 0.0189 1.22 0.073 0.014 0.98 1.5534 0.994 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C01 compound treatment 0.087 0.0189 1.22 0.085 0.026 1.82 2.1462 0.9812 2067481 IFLab1_003213 COc1ccc(CCNC(=O)CSc2ncnc3ccccc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C02 compound treatment 0.066 -0.00206 -0.13 0.065 0.006 0.42 0.2024 0.4604 1357765 IFLab1_003214 Cc1nc2c(ccc3nc(NC(=O)c4ccco4)sc32)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C03 compound treatment 0.323 0.255 16.41 0.271 0.212 14.81 22.0753 0.9987 2067482 IFLab1_003215 COC(=O)c1ccc(CSc2ncnc3ccccc23)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C04 compound treatment 0.084 0.0159 1.03 0.073 0.014 0.98 1.4168 0.9997 1225861 IFLab1_003216 Clc1ccc(cc1)S(=O)(=O)N2CCNC(=O)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C05 compound treatment 0.186 0.118 7.59 0.121 0.062 4.33 8.4303 0.9646 2067483 IFLab1_003217 CCCCC(Sc1ccc2nnc(c3ccc(F)cc3)n2n1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C06 compound treatment 0.067 -0.00106 -0.07 0.05 -0.009 -0.63 -0.493 -0.7795 2067484 IFLab1_003218 CCOC(=O)CSc1nc(cc(c1C#N)c2ccccc2)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C07 compound treatment 0.144 0.0759 4.89 0.1 0.041 2.86 5.4814 0.9676 2067485 IFLab1_003219 CSc1nc2ccc(NC(=O)/C=C/c3cccs3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C08 compound treatment 0.497 0.429 27.61 0.476 0.417 29.13 40.1212 0.9996 1289522 IFLab1_003220 OCCNC(=O)c1ccc(Nc2nc(c3ccccc3)c4cc(Cl)ccc4n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C09 compound treatment 0.574 0.506 32.56 0.462 0.403 28.15 42.9341 0.9974 1726978 IFLab1_003221 CCC(=O)Nc1ccc(cc1)c2csc(n2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C10 compound treatment 0.055 -0.0131 -0.84 0.05 -0.009 -0.63 -1.0392 -0.9897 1607111 IFLab1_003222 O=S(N1CCCCCC1)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C11 compound treatment 0.189 0.121 7.78 0.145 0.086 6.01 9.7524 0.9918 1402860 IFLab1_003223 Clc1ccccc1NC(=O)c2csc3CCCCc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C12 compound treatment 0.232 0.164 10.55 0.177 0.118 8.24 13.2902 0.9925 2067486 IFLab1_003224 Clc1cc(C(=O)OCc2nc3ccccc3s2)c(Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C13 compound treatment 0.094 0.0259 1.67 0.071 0.012 0.84 1.7732 0.9492 1259546 IFLab1_003225 Clc1cc(C(=O)Nc2nc3ccccc3s2)c(Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C14 compound treatment 0.146 0.0779 5.02 0.134 0.075 5.24 7.2519 0.9998 1465254 IFLab1_003226 CCc1cc(c2n[nH]cc2Oc3ccccc3)c(O)cc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C15 compound treatment 0.094 0.0259 1.67 0.067 0.008 0.56 1.5756 0.895 1677596 IFLab1_003227 O=C(Nc1nc(cs1)c2csc(NC(=O)C3CC3)n2)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C16 compound treatment 0.061 -0.00706 -0.45 0.059 0.0 0.0 -0.3215 -0.7071 2067487 IFLab1_003228 Oc1ccc(c2n[nH]cc2Oc3ccccc3)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C17 compound treatment 0.066 -0.00206 -0.13 0.057 -0.002 -0.14 -0.1928 -0.9997 1188084 IFLab1_003229 CC1CCCC(C)N1CC(O)COCC2COc3ccccc3O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C18 compound treatment 0.113 0.0449 2.89 0.099 0.04 2.79 4.0211 0.9999 2067488 IFLab1_003230 Cc1noc(C)c1CSc2ncnc3sc4CCCc4c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C19 compound treatment 0.087 0.0189 1.22 0.069 0.01 0.7 1.3558 0.9651 1369316 IFLab1_003231 COc1cc(CC=C)ccc1OCC(O)CN2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C20 compound treatment 0.1 0.0319 2.06 0.084 0.025 1.75 2.6884 0.9967 2067489 IFLab1_003232 Cc1cc2nnc(SCC(=O)O)n2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C21 compound treatment 0.072 0.00394 0.25 0.057 -0.002 -0.14 0.0803 0.2776 2067490 IFLab1_003233 Fc1cccc(/C=C\2/N=C(OC2=O)c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C22 compound treatment 0.132 0.0639 4.12 0.091 0.032 2.24 4.4906 0.9589 2067491 IFLab1_003234 NC(=O)c1cnn(c1N)c2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C23 mock treatment 0.09 0.0219 1.41 0.074 0.015 1.05 1.7393 0.9892 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 C24 mock treatment 0.089 0.0209 1.35 0.077 0.018 1.26 1.842 0.9994 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D01 compound treatment 0.545 0.477 30.7 0.454 0.395 27.59 41.2191 0.9986 2067492 IFLab1_003235 Cc1noc(C)c1CSc2nnnn2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D02 compound treatment 0.086 0.0179 1.15 0.071 0.012 0.84 1.4091 0.9877 2067493 IFLab1_003236 CCOc1ccc(cc1)c2csc(n2)/C(=C\Nc3ccc(NC(=O)C)cc3)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D03 compound treatment 0.105 0.0369 2.38 0.107 0.048 3.35 4.0522 0.9858 2067494 IFLab1_003237 CCc1nc2sc3CCCc3c2c4nnc(C)n14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D04 compound treatment 0.083 0.0149 0.96 0.077 0.018 1.26 1.5689 0.9912 2067495 IFLab1_003238 O=C(CCN1C(=O)/C(=C/c2ccc3OCOc3c2)/SC1=S)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D05 compound treatment 0.232 0.164 10.55 0.151 0.092 6.43 12.0058 0.9717 2067496 IFLab1_003239 Cc1nc(SCC(=O)Nc2cccc(c2)C(F)(F)F)c3cnn(c4ccccc4)c3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D06 compound treatment 0.072 0.00394 0.25 0.072 0.013 0.91 0.8213 0.8711 1238050 IFLab1_003240 Cc1cc(C)c(c(C)c1)S(=O)(=O)N2CCCC(C2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D07 compound treatment 0.382 0.314 20.21 0.289 0.23 16.07 25.6497 0.9936 1257742 IFLab1_003241 CCc1nnc(NC(=O)C(C)Sc2ccccc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D08 compound treatment 0.085 0.0169 1.09 0.074 0.015 1.05 1.5118 0.9998 1358391 IFLab1_003242 Cc1ccc(cc1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D09 compound treatment 0.079 0.0109 0.7 0.065 0.006 0.42 0.7941 0.9693 1335988 IFLab1_003243 CCC(Sc1ccc(Cl)cc1)C(=O)Nc2nnc(C)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D10 compound treatment 1.305 1.24 79.62 1.219 1.16 81.04 113.5986 1.0 2067497 IFLab1_003244 CCOC(=O)c1c(C)c(C)sc1NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D11 compound treatment 0.094 0.0259 1.67 0.066 0.007 0.49 1.5262 0.8774 2067498 IFLab1_003245 OC(=O)c1ccc(/C=C/2\S\C(=N/c3ccc(O)cc3)\NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D12 compound treatment 0.263 0.195 12.55 0.182 0.123 8.59 14.9481 0.983 1645660 IFLab1_003246 CCOC(=O)c1c(C)c(C)sc1NC(=O)CCCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D13 compound treatment 0.089 0.0209 1.35 0.071 0.012 0.84 1.5456 0.9739 1255590 IFLab1_003247 OC(=O)c1ccccc1N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D14 compound treatment 0.085 0.0169 1.09 0.065 0.006 0.42 1.0672 0.9138 1593881 IFLab1_003248 COc1ccccc1NC(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D15 compound treatment 0.183 0.115 7.4 0.108 0.049 3.42 7.6516 0.9387 1175935 IFLab1_003249 COc1ccc(C(=O)COc2ccccc2)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D16 compound treatment 0.053 -0.0151 -0.97 0.053 -0.006 -0.42 -0.982 -0.9296 1028611 IFLab1_003250 OC(=O)c1ccccc1C(=O)Nc2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D17 compound treatment 0.106 0.0379 2.44 0.086 0.027 1.89 3.0603 0.9919 1721182 IFLab1_003251 Cc1ccccc1c2c(C)oc3cc(O)ccc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D18 compound treatment 0.094 0.0259 1.67 0.076 0.017 1.19 2.0202 0.9861 1113514 IFLab1_003252 CCC(=O)Nc1ccc(C)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D19 compound treatment 0.117 0.0489 3.15 0.085 0.026 1.82 3.5116 0.9658 1450543 IFLab1_003253 CCOc1ccc(c2nn(C)c(C)c2Oc3ccccc3)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D20 compound treatment 0.306 0.238 15.31 0.243 0.184 12.85 19.9184 0.9962 1448679 IFLab1_003254 CC(Sc1nc2ccccc2o1)C(=O)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D21 compound treatment 0.084 0.0159 1.03 0.07 0.011 0.77 1.2687 0.9899 2067499 IFLab1_003255 CCOc1ccc(cc1)c2csc(n2)/C(=C/Nc3ccccc3OC)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D22 compound treatment 0.098 0.0299 1.93 0.07 0.011 0.77 1.9058 0.9187 1568669 IFLab1_003256 COc1ccccc1Nc2nc(cs2)c3cc4cccc(OC)c4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D23 mock treatment 0.092 0.0239 1.54 0.085 0.026 1.82 2.3737 0.9966 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 D24 mock treatment 0.075 0.00694 0.45 0.066 0.007 0.49 0.6614 0.999 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E01 compound treatment 0.17 0.102 6.56 0.118 0.059 4.12 7.5539 0.9749 2067500 IFLab1_003257 O=C(CSc1ncnc2ccccc12)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E02 compound treatment 0.084 0.0159 1.03 0.099 0.04 2.79 2.7012 0.9075 1377062 IFLab1_003258 O=C(Nc1ccc(cc1)c2nc3ccccc3[nH]2)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E03 compound treatment 0.085 0.0169 1.09 0.08 0.021 1.47 1.8081 0.9893 2067501 IFLab1_003259 O=C(CSc1ccc2nnc(c3ccccc3)n2n1)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E04 compound treatment 0.087 0.0189 1.22 0.072 0.013 0.91 1.504 0.9895 1595210 IFLab1_003260 COc1ccc(cc1)S(=O)(=O)N2CCNC(=O)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E05 compound treatment 0.088 0.0199 1.28 0.084 0.025 1.75 2.1423 0.9885 2067502 IFLab1_003261 Fc1ccc(cc1)c2nnc3ccc(SCC(=O)c4ccccc4)nn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E06 compound treatment 1.354 1.29 82.77 1.348 1.29 90.05 122.2011 0.9991 1343158 IFLab1_003262 COc1ccc(cc1)c2cc(nc3sc(C(=O)N)c(N)c23)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E07 compound treatment 0.087 0.0189 1.22 0.084 0.025 1.75 2.0968 0.9845 1713395 IFLab1_003263 CSc1nc2ccc(NC(=O)CN3C(=O)CCC3=O)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E08 compound treatment 0.087 0.0189 1.22 0.071 0.012 0.84 1.4546 0.9833 1724848 IFLab1_003264 CN(C1CCS(=O)(=O)C1)S(=O)(=O)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E09 compound treatment 1.253 1.18 76.27 1.219 1.16 81.04 111.2319 0.9995 1536646 IFLab1_003265 COc1cccc(c1)C(=O)Nc2ccc(cc2)c3csc(C)n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E10 compound treatment 0.087 0.0189 1.22 0.07 0.011 0.77 1.4052 0.9753 1545984 IFLab1_003266 CN1CCN(CC1)S(=O)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E11 compound treatment 0.08 0.0119 0.77 0.065 0.006 0.42 0.8396 0.9594 1370968 IFLab1_003267 Cc1ccc(CCC(=O)Nc2ccc(C)cc2)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E12 compound treatment 0.089 0.0209 1.35 0.072 0.013 0.91 1.595 0.9816 1626673 IFLab1_003268 CCCc1ccc(OCC(=O)c2ccc(O)cc2O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E13 compound treatment 0.095 0.0269 1.73 0.076 0.017 1.19 2.0657 0.983 2067503 IFLab1_003269 Cc1ccc2n(C)c(=NC(=O)c3cc(Cl)sc3Cl)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E14 compound treatment 0.115 0.0469 3.02 0.091 0.032 2.24 3.7169 0.989 1259259 IFLab1_003270 COc1ccc2c(=O)c(Oc3ccccc3)c(C)oc2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E15 compound treatment 0.379 0.311 20.01 0.268 0.209 14.6 24.4758 0.988 2067504 IFLab1_003271 COc1ccc(c2csc(NC(=O)/C=C/c3cccs3)n2)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E16 compound treatment 0.265 0.197 12.68 0.163 0.104 7.27 14.1005 0.9651 2067505 IFLab1_003272 COC(=O)c1ccc(Oc2c(oc3cc(O)ccc3c2=O)C(F)(F)F)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E17 compound treatment 0.065 -0.00306 -0.2 0.06 0.001 0.07 -0.0901 -0.4305 1145970 IFLab1_003273 CC(C)C1CCC(C)CC1OCC(O)CN2CCN(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E18 compound treatment 0.087 0.0189 1.22 0.057 -0.002 -0.14 0.763 0.622 2067506 IFLab1_003274 OC(=O)c1c(NC(=O)/C=C/c2cccs2)scc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E19 compound treatment 0.06 -0.00806 -0.52 0.058 -0.001 -0.07 -0.4164 -0.7951 1429811 IFLab1_003275 COc1ccc(COCC(O)CN2C(C)CCCC2C)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E20 compound treatment 0.14 0.0719 4.63 0.115 0.056 3.91 6.0403 0.9965 2067507 IFLab1_003276 Cc1cc(C(=O)CSc2nnc3ccccn23)c(C)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E21 compound treatment 0.05 -0.0181 -1.16 0.048 -0.011 -0.77 -1.3656 -0.9798 2067508 IFLab1_003277 COc1ccccc1/C=C/2\N=C(OC2=O)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E22 compound treatment 0.188 0.12 7.72 0.12 0.061 4.26 8.4719 0.9608 1551354 IFLab1_003278 Cc1ccc(cc1C)c2nn3nnnc3c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E23 mock treatment 0.075 0.00694 0.45 0.068 0.009 0.63 0.7602 0.9859 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 E24 mock treatment 0.082 0.0139 0.9 0.064 0.005 0.35 0.8812 0.9155 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F01 compound treatment 0.079 0.0109 0.7 0.061 0.002 0.14 0.5965 0.8313 2067509 IFLab1_003279 COc1ccc(/C=C/C(=O)Nc2sc3CCCCc3c2C(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F02 compound treatment 0.094 0.0259 1.67 0.085 0.026 1.82 2.4648 0.9991 2067510 IFLab1_003280 COc1cccc(c1)c2csc(n2)/C(=C\Nc3ccc(NC(=O)C)cc3)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F03 compound treatment 0.216 0.148 9.52 0.216 0.157 10.97 14.4885 0.9975 1278829 IFLab1_003281 C1CN(CCO1)c2ncnc3scc(c4ccccc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F04 compound treatment 0.094 0.0259 1.67 0.076 0.017 1.19 2.0202 0.9861 1284006 IFLab1_003282 COc1ccc(NC(=O)CCCC(=O)O)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F05 compound treatment 0.133 0.0649 4.18 0.095 0.036 2.51 4.7337 0.9704 1175385 IFLab1_003283 COc1cc(cc(OC)c1OC)c2nc3sc4CCCc4c3c(=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F06 compound treatment 0.111 0.0429 2.76 0.088 0.029 2.03 3.3867 0.9883 1353868 IFLab1_003284 Cc1cc(C)c(c(C)c1)S(=O)(=O)N2CCCCC2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F07 compound treatment 0.055 -0.0131 -0.84 0.048 -0.011 -0.77 -1.138 -0.999 2067511 IFLab1_003285 CC(Sc1nc2ccccc2s1)C(=O)Nc3nnc(s3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F08 compound treatment 0.096 0.0279 1.8 0.082 0.023 1.61 2.4076 0.9984 1615740 IFLab1_003286 Cc1ccc(NC(=O)C2CCCN(C2)S(=O)(=O)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F09 compound treatment 0.157 0.0889 5.72 0.127 0.068 4.75 7.4068 0.9957 1263143 IFLab1_003287 CCC(Sc1ccccc1)C(=O)Nc2nnc(s2)c3ccc(OC)cc3OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F10 compound treatment 0.201 0.133 8.56 0.144 0.085 5.94 10.2491 0.9841 1419097 IFLab1_003288 CCC(=O)Nc1ccc(cc1)c2nc3ccc(C)cc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F11 compound treatment 0.08 0.0119 0.77 0.086 0.027 1.89 1.877 0.9216 2067512 IFLab1_003289 Oc1ccc(/N=C\2/NC(=O)/C(=C/c3ccc(Cl)cc3Cl)/S2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F12 compound treatment 0.101 0.0329 2.12 0.079 0.02 1.4 2.487 0.9795 2067513 IFLab1_003290 Cc1sc(/N=C/c2ccc(O)cc2)c(C#N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F13 compound treatment 0.113 0.0449 2.89 0.089 0.03 2.1 3.5271 0.9875 2067514 IFLab1_003291 Cc1nn(C(=O)c2ccco2)c(C)c1Sc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F14 compound treatment 0.088 0.0199 1.28 0.08 0.021 1.47 1.9447 0.9978 1179283 IFLab1_003292 COc1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F15 compound treatment 0.13 0.0619 3.99 0.103 0.044 3.07 4.9924 0.9917 1640181 IFLab1_003293 Cc1oc2cc(O)ccc2c(=O)c1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F16 compound treatment 0.347 0.279 17.95 0.238 0.179 12.5 21.5375 0.9844 1049198 IFLab1_003294 CCOC(=O)c1c(C)c(C)sc1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F17 compound treatment 0.041 -0.0271 -1.74 0.042 -0.017 -1.19 -2.0716 -0.9826 2067515 IFLab1_003295 CCOc1ccc(c2n[nH]c(c2Oc3ccccc3)C(F)(F)F)c(O)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F18 compound treatment 0.058 -0.0101 -0.65 0.061 0.002 0.14 -0.3593 -0.5421 1663501 IFLab1_003296 CC(C)CC(=O)Nc1ccc(cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F19 compound treatment 0.961 0.893 57.47 0.912 0.853 59.59 82.7769 0.9998 1195788 IFLab1_003297 COc1ccc(c2n[nH]c(C)c2c3ccccc3)c(O)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F20 compound treatment 0.074 0.00594 0.38 0.063 0.004 0.28 0.4677 0.9882 1355410 IFLab1_003298 Cc1c(Cl)cccc1NC(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F21 compound treatment 0.075 0.00694 0.45 0.055 -0.004 -0.28 0.1181 0.2242 2067516 IFLab1_003299 COc1ccc(N/C=C(\C#N)/c2nc(cs2)c3ccc4OCOc4c3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F22 compound treatment 0.121 0.0529 3.41 0.082 0.023 1.61 3.5454 0.9412 1601988 IFLab1_003300 COc1cccc2cc(C(=O)NCCc3ccccc3)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F23 mock treatment 0.066 -0.00206 -0.13 0.052 -0.007 -0.49 -0.4398 -0.8678 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 F24 mock treatment 0.067 -0.00106 -0.07 0.055 -0.004 -0.28 -0.246 -0.8552 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G01 compound treatment 0.142 0.0739 4.76 0.124 0.065 4.54 6.5759 0.9997 2067517 IFLab1_003301 Cc1csc(NC(=O)CSc2ncnc3ccccc23)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G02 compound treatment 0.075 0.00694 0.45 0.075 0.016 1.12 1.106 0.9189 1254381 IFLab1_003302 CCC(=O)Nc1ccc(cc1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G03 compound treatment 0.096 0.0279 1.8 0.077 0.018 1.26 2.1606 0.9847 2067518 IFLab1_003303 O=C(CSc1ccc2nnc(c3ccccc3)n2n1)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G04 compound treatment 0.089 0.0209 1.35 0.068 0.009 0.63 1.3974 0.9398 1606394 IFLab1_003304 O=C1CCN(CCN1)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G05 compound treatment 0.133 0.0649 4.18 0.109 0.05 3.49 5.4253 0.996 2067519 IFLab1_003305 CCOc1ccc(cc1)c2nnc3ccc(SC)nn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G06 compound treatment 0.046 -0.0221 -1.42 0.043 -0.016 -1.12 -1.7946 -0.993 1623658 IFLab1_003306 Nc1c(sc2nc(cc(c3ccc(Cl)cc3)c12)C4CC4)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G07 compound treatment 0.199 0.131 8.43 0.153 0.094 6.57 10.6027 0.9924 1470386 IFLab1_003307 O=C(OCc1nc2ccccc2s1)c3cccc(c3)N4C(=O)CCC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G08 compound treatment 0.093 0.0249 1.6 0.069 0.01 0.7 1.6289 0.9306 1159893 IFLab1_003308 CN1CCN(CC1)S(=O)c2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G09 compound treatment 0.104 0.0359 2.31 0.081 0.022 1.54 2.7223 0.9803 1418753 IFLab1_003309 OC(=O)CCC(=O)Nc1ccc(cc1)c2csc(n2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G10 compound treatment 1.104 1.04 66.68 1.061 1.0 70.0 96.6456 0.9997 2067520 IFLab1_003310 S(c1c(nc2ncccn12)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G11 compound treatment 0.093 0.0249 1.6 0.08 0.021 1.47 2.1723 0.999 1214346 IFLab1_003311 CN(C)c1ccc(cc1)P(=O)(OCc2ccccc2)C(O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G12 compound treatment 0.097 0.0289 1.86 0.078 0.019 1.33 2.2555 0.9862 1208321 IFLab1_003312 Cc1c(O)ccc2c(=O)c(Oc3ccccc3)coc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G13 compound treatment 0.048 -0.0201 -1.29 0.048 -0.011 -0.77 -1.4566 -0.9692 1466716 IFLab1_003313 CCOC(=O)Cc1csc(NC(=O)c2cc(Cl)sc2Cl)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G14 compound treatment 0.057 -0.0111 -0.71 0.061 0.002 0.14 -0.4048 -0.5577 2067521 IFLab1_003314 Cc1[nH]nc(c1Oc2ccccc2)c3ccc(O)cc3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G15 compound treatment 0.042 -0.0261 -1.68 0.045 -0.014 -0.98 -1.8778 -0.967 1675481 IFLab1_003315 COc1ccc(cc1)C(=O)Nc2nc(cs2)c3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G16 compound treatment 0.04 -0.0281 -1.81 0.04 -0.019 -1.33 -2.2159 -0.9885 1477422 IFLab1_003316 CCCOc1ccc(c2n[nH]cc2Oc3ccccc3)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G17 compound treatment 0.06 -0.00806 -0.52 0.057 -0.002 -0.14 -0.4658 -0.8666 1171118 IFLab1_003317 OC(COc1ccc2OCOc2c1)CN3CCCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G18 compound treatment 0.091 0.0229 1.48 0.068 0.009 0.63 1.4884 0.9276 1523521 IFLab1_003318 C1CN(CCO1)c2nnc(N3CCOCC3)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G19 compound treatment 0.072 0.00394 0.25 0.059 0.0 0.0 0.1791 0.7071 1119823 IFLab1_003319 Cc1cccc(C)c1OCC(O)CN2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G20 compound treatment 0.079 0.0109 0.7 0.061 0.002 0.14 0.5965 0.8313 1366277 IFLab1_003320 CN1CCN(CC1)c2nnc(c3ccccc3)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G21 compound treatment 0.044 -0.0241 -1.55 0.043 -0.016 -1.12 -1.8856 -0.9872 1446410 IFLab1_003321 Clc1ccc2n(COC(=O)NC3CCCCC3)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G22 compound treatment 0.044 -0.0241 -1.55 0.042 -0.017 -1.19 -1.935 -0.9914 2067522 IFLab1_003322 Cc1ccc(cc1)c2nn3cnnc3c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G23 mock treatment 0.046 -0.0221 -1.42 0.042 -0.017 -1.19 -1.844 -0.996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 G24 mock treatment 0.064 -0.00406 -0.26 0.05 -0.009 -0.63 -0.6296 -0.9245 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H01 compound treatment 0.107 0.0389 2.51 0.119 0.06 4.19 4.736 0.9698 2067523 IFLab1_003323 CC(C)(C)c1ccc(NC(=O)CSc2nnnn2c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H02 compound treatment 0.085 0.0169 1.09 0.083 0.024 1.68 1.9563 0.9783 2067524 IFLab1_003324 COc1ccc(Cl)cc1N/C=C(\C#N)/c2nc(cs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H03 compound treatment 0.162 0.0939 6.05 0.153 0.094 6.57 8.9187 0.9991 2067525 IFLab1_003325 S=c1[nH]cnc2scc(c3ccccc3)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H04 compound treatment 0.083 0.0149 0.96 0.076 0.017 1.19 1.5195 0.9945 1669631 IFLab1_003326 OC(=O)CCCC(=O)Nc1cccc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H05 compound treatment 0.072 0.00394 0.25 0.067 0.008 0.56 0.5743 0.9359 2067526 IFLab1_003327 CN(C)c1ccc(/C=C\2/N=C(OC2=O)c3cccs3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H06 compound treatment 0.129 0.0609 3.92 0.116 0.057 3.98 5.5891 1.0 2067527 IFLab1_003328 FC(F)(F)C1CCCN(C1)S(=O)(=O)c2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H07 compound treatment 0.105 0.0369 2.38 0.082 0.023 1.61 2.8172 0.9818 1561214 IFLab1_003329 CC(SC1=NCCS1)C(=O)Nc2nnc(s2)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H08 compound treatment 0.107 0.0389 2.51 0.089 0.03 2.1 3.254 0.996 1250459 IFLab1_003330 CN(C(=O)C1CCCN(C1)S(=O)(=O)c2ccc(C)cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H09 compound treatment 0.114 0.0459 2.96 0.091 0.032 2.24 3.6714 0.9905 1656241 IFLab1_003331 CCSc1nnc(NC(=O)C(CC)Sc2ccc(Cl)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H10 compound treatment 0.111 0.0429 2.76 0.089 0.03 2.1 3.4361 0.9907 1720041 IFLab1_003332 OC(=O)c1cccc(NC(=O)c2cc3ccccc3oc2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H11 compound treatment 0.109 0.0409 2.63 0.086 0.027 1.89 3.1968 0.9866 2067528 IFLab1_003333 Cc1ccc(/C=C\2/S/C(=N/c3ccc(O)cc3)/NC2=O)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H12 compound treatment 0.075 0.00694 0.45 0.082 0.023 1.61 1.4518 0.8706 1520208 IFLab1_003334 CC(=O)Nc1ccc(OC(=O)c2cc3ccccc3oc2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H13 compound treatment 0.059 -0.00906 -0.58 0.063 0.004 0.28 -0.215 -0.3323 1435135 IFLab1_003335 Cc1nn(C(=O)c2cccnc2)c(C)c1Sc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H14 compound treatment 0.046 -0.0221 -1.42 0.045 -0.014 -0.98 -1.6958 -0.9834 1129935 IFLab1_003336 O=C(Oc1ccccc1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H15 compound treatment 0.137 0.0689 4.44 0.095 0.036 2.51 4.9158 0.9638 1051974 IFLab1_003337 COc1ccc(cc1)c2c(C)oc3cc(OC(=O)C)ccc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H16 compound treatment 0.093 0.0249 1.6 0.045 -0.014 -0.98 0.4433 0.2359 2067529 IFLab1_003338 N(c1nc(cs1)c2cccs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H17 compound treatment 0.16 0.0919 5.92 0.113 0.054 3.77 6.8518 0.9764 2067530 IFLab1_003339 Cc1c(O)ccc2c(=O)c(c3ccc(F)cc3)c(oc12)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H18 compound treatment 0.147 0.0789 5.08 0.112 0.053 3.7 6.2107 0.9879 2067531 IFLab1_003340 Cc1nc(cs1)c2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H19 compound treatment 0.212 0.144 9.26 0.144 0.085 5.94 10.7498 0.9769 1187065 IFLab1_003341 COc1ccc2c(=O)c(Oc3ccccc3)c(C)oc2c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H20 compound treatment 0.054 -0.0141 -0.91 0.05 -0.009 -0.63 -1.0847 -0.9841 1626157 IFLab1_003342 CC1CCCC(C)N1C(=O)c2ccccc2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H21 compound treatment 0.042 -0.0261 -1.68 0.043 -0.016 -1.12 -1.9766 -0.9805 2067532 IFLab1_003343 Fc1ccc(cc1)c2csc(n2)/C(=C\Nc3cccc(Cl)c3)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H22 compound treatment 0.037 -0.0311 -2.0 0.039 -0.02 -1.4 -2.4018 -0.9846 1212413 IFLab1_003344 Clc1cc(Cl)c2oc(=O)c(cc2c1)C(=O)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H23 mock treatment 0.043 -0.0251 -1.61 0.044 -0.015 -1.05 -1.8817 -0.9782 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 H24 mock treatment 0.053 -0.0151 -0.97 0.048 -0.011 -0.77 -1.229 -0.9934 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I01 compound treatment 0.085 0.0169 1.09 0.079 0.02 1.4 1.7588 0.9925 2067533 IFLab1_003345 CCOC(=O)c1c(NC(=O)CSc2ncnc3ccccc23)sc4CCCc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I02 compound treatment 0.096 0.0279 1.8 0.085 0.026 1.82 2.5558 1.0 2067534 IFLab1_003346 O=C(Nc1ccc(cc1)c2nc3ccccc3[nH]2)/C=C/c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I03 compound treatment 0.089 0.0209 1.35 0.071 0.012 0.84 1.5456 0.9739 2067535 IFLab1_003347 NC(=O)CSc1ccc2nnc(c3ccccc3)n2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I04 compound treatment 0.11 0.0419 2.7 0.081 0.022 1.54 2.9954 0.9644 1327413 IFLab1_003348 O=S(=O)(N1CCN(CC1)S(=O)(=O)c2cccs2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I05 compound treatment 0.626 0.558 35.91 0.587 0.528 36.89 51.4756 0.9999 2067536 IFLab1_003349 CCOc1ccc(cc1)c2nnc3ccc(SCC)nn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I06 compound treatment 0.213 0.145 9.33 0.161 0.102 7.13 11.6351 0.9912 2067537 IFLab1_003350 OC(=O)CSc1nc(cc(c1C#N)c2ccccc2)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I07 compound treatment 0.1 0.0319 2.06 0.076 0.017 1.19 2.2932 0.966 1060520 IFLab1_003351 COc1ccc(cc1)C2=CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I08 compound treatment 0.224 0.156 10.04 0.192 0.133 9.29 13.6671 0.9993 1502026 IFLab1_003352 Cc1ccc(cc1)N(Cc2ccco2)C(=O)CNS(=O)(=O)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I09 compound treatment 0.324 0.256 16.47 0.241 0.182 12.71 20.6389 0.9918 2067538 IFLab1_003353 CC(C)OC(=O)c1cc2ccccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I10 compound treatment 0.433 0.365 23.49 0.24 0.181 12.64 25.5504 0.9578 2067539 IFLab1_003354 CC1Cc2ccccc2N1C(=O)COc3c(F)c(F)c(F)c(F)c3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I11 compound treatment 0.094 0.0259 1.67 0.079 0.02 1.4 2.1684 0.9961 1698498 IFLab1_003355 CN(C)c1ccc(cc1)P(=O)(OC2CCCCC2)C(O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I12 compound treatment 0.064 -0.00406 -0.26 0.071 0.012 0.84 0.4078 0.4644 1383363 IFLab1_003356 CC(=O)Oc1ccc2c(=O)c(Oc3ccccc3)c(C)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I13 compound treatment 0.051 -0.0171 -1.1 0.046 -0.013 -0.91 -1.4188 -0.9955 1142618 IFLab1_003357 Clc1cc(C(=O)Nc2nccs2)c(Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I14 compound treatment 0.04 -0.0281 -1.81 0.04 -0.019 -1.33 -2.2159 -0.9885 1346302 IFLab1_003358 CCc1cc(c2n[nH]cc2Oc3ccccc3)c(O)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I15 compound treatment 0.07 0.00194 0.12 0.058 -0.001 -0.07 0.0387 0.2709 1652338 IFLab1_003359 O=C(Nc1nc(cs1)c2ccncc2)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I16 compound treatment 0.084 0.0159 1.03 0.075 0.016 1.12 1.5156 0.9991 1645418 IFLab1_003360 Oc1ccc(cc1)c2nc(c3ccccc3)c4ccccn24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I17 compound treatment 0.064 -0.00406 -0.26 0.063 0.004 0.28 0.0126 0.0329 1406699 IFLab1_003361 CCC1CCCCN1CC(O)COc2ccc3OCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I18 compound treatment 0.091 0.0229 1.48 0.08 0.021 1.47 2.0812 1.0 1146596 IFLab1_003362 CN1CCN(CC1)c2ncnc3scc(c4ccc(F)cc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I19 compound treatment 0.067 -0.00106 -0.07 0.058 -0.001 -0.07 -0.0978 -1.0 2067540 IFLab1_003363 CN1CCN(CC1)C(=O)CN2C(=O)S/C(=C\c3ccccc3F)/C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I20 compound treatment 0.133 0.0649 4.18 0.068 0.009 0.63 3.4 0.8044 2067541 IFLab1_003364 COC(=O)c1cc(cc(c1)n2c(C)ccc2C)C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I21 compound treatment 0.044 -0.0241 -1.55 0.043 -0.016 -1.12 -1.8856 -0.9872 2067542 IFLab1_003365 Fc1cccc(Cl)c1C2SCC(=O)N2c3cccc(c3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I22 compound treatment 0.044 -0.0241 -1.55 0.045 -0.014 -0.98 -1.7868 -0.9754 2067543 IFLab1_003366 COC(=O)/C(=C\c1cccnc1)/NC(=O)c2ccc(OCc3ccccc3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I23 mock treatment 0.047 -0.0211 -1.36 0.046 -0.013 -0.91 -1.6009 -0.981 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 I24 mock treatment 0.056 -0.0121 -0.78 0.052 -0.007 -0.49 -0.8949 -0.9752 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J01 compound treatment 0.064 -0.00406 -0.26 0.06 0.001 0.07 -0.1356 -0.5007 1166892 IFLab1_003367 CCOC(=O)c1c(NC(=O)CCN2CCC(C)CC2)sc3CCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J02 compound treatment 0.093 0.0249 1.6 0.079 0.02 1.4 2.1229 0.9976 2067544 IFLab1_003368 N#C/C(=C/Nc1cccc2ccccc12)/c3nc(cs3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J03 compound treatment 0.504 0.436 28.06 0.444 0.385 26.9 38.8591 0.9998 2067545 IFLab1_003369 CC(=O)Oc1cc2sc(C)nc2c3sccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J04 compound treatment 0.176 0.108 6.95 0.145 0.086 6.01 9.1607 0.9974 2067546 IFLab1_003370 Cc1cccc(NC(=O)CCCOc2ccc(Cl)cc2Cl)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J05 compound treatment 0.117 0.0489 3.15 0.093 0.034 2.38 3.9067 0.9903 2067547 IFLab1_003371 N#CCSc1nnc(c2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J06 compound treatment 0.104 0.0359 2.31 0.088 0.029 2.03 3.0681 0.9978 2067548 IFLab1_003372 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCC(C2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J07 compound treatment 0.182 0.114 7.33 0.136 0.077 5.38 8.9892 0.9884 1356576 IFLab1_003373 CC(Sc1nc2ccccc2[nH]1)C(=O)Nc3nnc(s3)c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J08 compound treatment 0.086 0.0179 1.15 0.088 0.029 2.03 2.2488 0.9644 1361432 IFLab1_003374 O=C(C1CCN(CC1)S(=O)(=O)c2cccs2)N3CCc4ccccc4C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J09 compound treatment 0.098 0.0299 1.93 0.091 0.032 2.24 2.9432 0.9973 2067549 IFLab1_003375 Cc1ccc(cc1)C(=O)NCS(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J10 compound treatment 0.776 0.708 45.57 0.681 0.622 43.45 62.946 0.9997 1627846 IFLab1_003376 CCOC(=O)c1c(NC(=O)CCCC(=O)O)scc1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J11 compound treatment 0.283 0.215 13.83 0.266 0.207 14.46 20.0078 0.9998 2067550 IFLab1_003377 CN1C(=O)/C(=C\2/S/C(=N\c3ccc(C)c(C)c3)/NC2=O)/c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J12 compound treatment 0.083 0.0149 0.96 0.067 0.008 0.56 1.0749 0.9667 1648362 IFLab1_003378 Brc1ccc(cc1)C(=O)COC(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J13 compound treatment 0.048 -0.0201 -1.29 0.048 -0.011 -0.77 -1.4566 -0.9692 2067551 IFLab1_003379 Cc1ccc(SC(C(=O)c2ccccc2)C(=O)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J14 compound treatment 0.056 -0.0121 -0.78 0.053 -0.006 -0.42 -0.8455 -0.9581 1161503 IFLab1_003380 COc1ccc(OC(=O)c2cc3ccccc3oc2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J15 compound treatment 0.122 0.0539 3.47 0.104 0.045 3.14 4.6777 0.9988 1370114 IFLab1_003381 COc1ccc(cc1)c2c(C)oc3cc(O)ccc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J16 compound treatment 0.064 -0.00406 -0.26 0.069 0.01 0.7 0.309 0.4142 1075844 IFLab1_003382 CCc1ccc(NC(=O)c2ccccc2C(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J17 compound treatment 0.251 0.183 11.77 0.178 0.119 8.31 14.2043 0.9855 1151392 IFLab1_003383 CCOc1ccc2c(=O)c(coc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J18 compound treatment 0.038 -0.0301 -1.94 0.04 -0.019 -1.33 -2.3069 -0.9831 2067552 IFLab1_003384 CCOC(=O)c1c(NC(=O)/C=C\C(=O)O)sc(C)c1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J19 compound treatment 0.192 0.124 7.98 0.143 0.084 5.87 9.7901 0.9886 1293115 IFLab1_003385 Cc1c(O)ccc2c(=O)c(coc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J20 compound treatment 0.113 0.0449 2.89 0.075 0.016 1.12 2.8355 0.9145 1625895 IFLab1_003386 CCN(C(=O)c1cc2ccccc2oc1=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J21 compound treatment 0.069 9.35E-4 0.06 0.048 -0.011 -0.77 -0.5008 -0.6497 2067553 IFLab1_003387 Clc1cccc(N/C=C(\C#N)/c2nc(cs2)c3ccc4OCOc4c3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J22 compound treatment 0.058 -0.0101 -0.65 0.05 -0.009 -0.63 -0.9027 -0.9999 1182925 IFLab1_003388 CC(NC(=O)C(c1ccccc1)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J23 mock treatment 0.057 -0.0111 -0.71 0.052 -0.007 -0.49 -0.8494 -0.9832 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 J24 mock treatment 0.063 -0.00506 -0.33 0.049 -0.01 -0.7 -0.7245 -0.9398 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K01 compound treatment 0.649 0.581 37.39 0.421 0.362 25.29 44.3223 0.9819 1039953 IFLab1_003389 C(Sc1ncnc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K02 compound treatment 0.074 0.00594 0.38 0.072 0.013 0.91 0.9123 0.926 1175995 IFLab1_003390 COC(=O)c1ccc(cc1)C(=O)Nc2ccc(cc2)c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K03 compound treatment 0.083 0.0149 0.96 0.07 0.011 0.77 1.2231 0.9938 2067554 IFLab1_003391 O=C(CSc1ccc2nnc(c3ccccc3)n2n1)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K04 compound treatment 0.65 0.582 37.46 0.512 0.453 31.65 48.863 0.9965 1382032 IFLab1_003392 CCSc1nc(cc(c2ccco2)c1C#N)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K05 compound treatment 0.127 0.0589 3.79 0.1 0.041 2.86 4.7077 0.9904 2067555 IFLab1_003393 COc1ccc(cc1OC)c2nnc3ccc(SCc4ccccc4F)nn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K06 compound treatment 0.104 0.0359 2.31 0.094 0.035 2.45 3.3645 0.9996 1640446 IFLab1_003394 NC(=O)CSc1nc(cc(c2cccs2)c1C#N)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K07 compound treatment 0.094 0.0259 1.67 0.074 0.015 1.05 1.9214 0.9748 1032557 IFLab1_003395 C=CC(=O)N1CCN(CC1)C(=O)C=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K08 compound treatment 0.111 0.0429 2.76 0.09 0.031 2.17 3.4855 0.9927 1408889 IFLab1_003396 COC(=O)C1=C(C)NC(=C(C#N)C1c2cccs2)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K09 compound treatment 0.127 0.0589 3.79 0.086 0.027 1.89 4.0161 0.948 2067556 IFLab1_003397 Cc1ccc(/C=C/C(=O)Nc2ccccc2)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K10 compound treatment 0.341 0.273 17.57 0.206 0.147 10.27 19.6836 0.9673 1307317 IFLab1_003398 O=C(N(Cc1ccccc1)c2ccccn2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K11 compound treatment 0.099 0.0309 1.99 0.083 0.024 1.68 2.5935 0.9963 1485325 IFLab1_003399 CC(C)C(O)P(=O)(OCc1ccccc1)c2ccc(cc2)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K12 compound treatment 0.159 0.0909 5.85 0.124 0.065 4.54 7.3496 0.9921 2067557 IFLab1_003400 Cc1c(O)ccc2c(=O)c(Oc3ccccc3)c(oc12)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K13 compound treatment 0.476 0.408 26.26 0.456 0.397 27.73 38.1775 0.9996 1298394 IFLab1_003401 CCOC(=O)c1ccc(NC(=O)c2cc(Cl)sc2Cl)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K14 compound treatment 0.041 -0.0271 -1.74 0.04 -0.019 -1.33 -2.1704 -0.991 1488365 IFLab1_003402 CCOc1cc(O)c(cc1CC)c2n[nH]cc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K15 compound treatment 0.079 0.0109 0.7 0.067 0.008 0.56 0.8929 0.9935 1558600 IFLab1_003403 COC(=O)c1ccc(cc1)C(=O)Nc2nc(cs2)c3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K16 compound treatment 0.099 0.0309 1.99 0.078 0.019 1.33 2.3465 0.9806 1220961 IFLab1_003404 OCc1cc(=O)c(O)c(o1)C(Nc2nccs2)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K17 compound treatment 0.058 -0.0101 -0.65 0.054 -0.005 -0.35 -0.7051 -0.958 2067558 IFLab1_003405 OC(COCCC1(CC2CC3CC(C2)C1)C3)CN4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K18 compound treatment 0.687 0.619 39.84 0.602 0.543 37.93 54.9929 0.9997 1074365 IFLab1_003406 CCOC(=O)c1c(N)sc2CCCCCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K19 compound treatment 0.061 -0.00706 -0.45 0.05 -0.009 -0.63 -0.7661 -0.9873 2067559 IFLab1_003407 Brc1ccc2cc(OC(=O)c3ccncc3)ccc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K20 compound treatment 0.103 0.0349 2.25 0.08 0.021 1.47 2.6274 0.9786 2067560 IFLab1_003408 FC(F)(F)c1ccc(Cl)c(NC(=O)CCSc2nnnn2c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K21 compound treatment 0.063 -0.00506 -0.33 0.052 -0.007 -0.49 -0.5763 -0.9806 2067561 IFLab1_003409 CC(=O)Nc1ccc(cc1)N2C(SCC2=O)c3c(F)cccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K22 compound treatment 0.101 0.0329 2.12 0.058 -0.001 -0.07 1.4496 0.6834 2067562 IFLab1_003410 C(Sc1nnc2ccccn12)c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K23 mock treatment 0.054 -0.0141 -0.91 0.048 -0.011 -0.77 -1.1835 -0.9967 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 K24 mock treatment 0.081 0.0129 0.83 0.052 -0.007 -0.49 0.2429 0.2516 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L01 compound treatment 0.085 0.0169 1.09 0.073 0.014 0.98 1.4624 0.9985 1258224 IFLab1_003411 COc1ccc(C=c2sc3nc4ccccc4n3c2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L02 compound treatment 0.076 0.00794 0.51 0.07 0.011 0.77 0.9045 0.9803 2067563 IFLab1_003412 CCOc1ccc(cc1)c2csc(n2)/C(=C/Nc3ccc4OCOc4c3)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L03 compound treatment 0.278 0.21 13.51 0.304 0.245 17.12 21.6574 0.9932 1239454 IFLab1_003413 Cc1ccc(C)n1n2cnc3sc4CCCc4c3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L04 compound treatment 0.128 0.0599 3.86 0.103 0.044 3.07 4.9014 0.9937 1612805 IFLab1_003414 CCc1cc2c(=O)c(coc2cc1OC(C)C(=O)O)c3nc(C)cs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L05 compound treatment 0.091 0.0229 1.48 0.084 0.025 1.75 2.2788 0.9965 1442760 IFLab1_003415 Fc1ccc(NC(=O)CCSc2nnc3ccccn23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L06 compound treatment 0.608 0.54 34.75 0.534 0.475 33.18 48.0383 0.9997 1983592 IFLab1_003416 O=S(=O)(c1cccs1)n2nnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L07 compound treatment 0.302 0.234 15.06 0.255 0.196 13.69 20.3292 0.9989 1554770 IFLab1_003417 CC(SC1=NCCS1)C(=O)Nc2nnc(s2)c3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L08 compound treatment 0.087 0.0189 1.22 0.082 0.023 1.61 1.998 0.9907 1455385 IFLab1_003418 O=C(NCc1ccccc1)C2CCN(CC2)S(=O)(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L09 compound treatment 0.156 0.0879 5.66 0.135 0.076 5.31 7.7565 0.9995 2067564 IFLab1_003419 CCOc1ccc(/C=C/2\SC(=S)N(CC(=O)N3CCCc4ccccc34)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L10 compound treatment 0.086 0.0179 1.15 0.073 0.014 0.98 1.5079 0.9966 1587902 IFLab1_003420 CCN(CC)c1ccc(cc1)C(=O)OCC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L11 compound treatment 0.09 0.0219 1.41 0.077 0.018 1.26 1.8875 0.9983 2067565 IFLab1_003421 Cc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccc4OCOc4c3)/SC2=S)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L12 compound treatment 0.743 0.675 43.44 0.67 0.611 42.68 60.9007 1.0 1160289 IFLab1_003422 CCOC(=O)c1cc2cccc(CC=C)c2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L13 compound treatment 0.083 0.0149 0.96 0.07 0.011 0.77 1.2231 0.9938 2067566 IFLab1_003423 COc1ccc(cc1)S(=O)(=O)Nc2nc(cs2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L14 compound treatment 0.052 -0.0161 -1.03 0.059 0.0 0.0 -0.7311 -0.7071 1597206 IFLab1_003424 NC(=O)c1cc2cc(Br)cc(Br)c2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L15 compound treatment 0.213 0.145 9.33 0.168 0.109 7.61 11.9809 0.9949 1218304 IFLab1_003425 COc1ccc(cc1)c2c(C)oc3cc(OC)ccc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L16 compound treatment 0.052 -0.0161 -1.03 0.054 -0.005 -0.35 -0.9781 -0.8962 1075853 IFLab1_003426 OC(=O)c1ccccc1C(=O)Nc2ccccc2F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L17 compound treatment 0.181 0.113 7.27 0.166 0.107 7.48 10.4256 0.9999 2067567 IFLab1_003427 COc1ccc(cc1)c2c(n[nH]c2C(F)(F)F)c3ccc(O)cc3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L18 compound treatment 0.085 0.0169 1.09 0.07 0.011 0.77 1.3142 0.9854 1709284 IFLab1_003428 CCOc1ccccc1NC(=O)c2cc3cc(Br)ccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L19 compound treatment 0.219 0.151 9.71 0.172 0.113 7.89 12.4515 0.9947 1176804 IFLab1_003429 CC(=O)Oc1ccc2c(=O)c(coc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L20 compound treatment 0.082 0.0139 0.9 0.06 0.001 0.07 0.6836 0.7599 1620579 IFLab1_003430 C=CCc1cccc2cc(C(=O)NCCC3=CCCCC3)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L21 compound treatment 0.052 -0.0161 -1.03 0.047 -0.012 -0.84 -1.3239 -0.9946 2067568 IFLab1_003431 Brc1ccc(N/C=C(\C#N)/c2nc(cs2)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L22 compound treatment 0.044 -0.0241 -1.55 0.038 -0.021 -1.47 -2.1326 -0.9996 2067569 IFLab1_003432 Oc1c(Cl)cc(Cl)cc1/C=N/c2nc3CCCCc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L23 mock treatment 0.051 -0.0171 -1.1 0.045 -0.014 -0.98 -1.4682 -0.9983 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 L24 mock treatment 0.064 -0.00406 -0.26 0.051 -0.008 -0.56 -0.5802 -0.9402 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M01 compound treatment 0.569 0.501 32.24 0.553 0.494 34.51 47.2018 0.9994 2067570 IFLab1_003433 Fc1ccc(CSc2ncnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M02 compound treatment 0.257 0.189 12.16 0.178 0.119 8.31 14.4774 0.9828 1329441 IFLab1_003434 CCC(=O)Nc1cccc(c1)c2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M03 compound treatment 0.098 0.0299 1.93 0.087 0.028 1.96 2.7456 1.0 2067571 IFLab1_003435 Cc1cc(C)c(NC(=O)CSc2ccc3nnc(c4ccccc4)n3n2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M04 compound treatment 1.35 1.28 82.51 1.285 1.23 85.65 118.907 0.9998 1129291 IFLab1_003436 NC(=O)c1sc2nc(cc(c3cccs3)c2c1N)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M05 compound treatment 0.145 0.0769 4.95 0.16 0.101 7.06 8.4908 0.985 1277302 IFLab1_003437 CC1(C)CC(=O)c2sc(NC(=O)CCSc3ccccc3)nc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M06 compound treatment 0.104 0.0359 2.31 0.09 0.031 2.17 3.1669 0.9995 1526878 IFLab1_003438 C1CCN(C1)c2nc(c3ccccc3)c4ccccc4n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M07 compound treatment 0.154 0.0859 5.53 0.108 0.049 3.42 6.3317 0.9734 2067572 IFLab1_003439 CC(=Cc1ccc(O)cc1)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M08 compound treatment 0.168 0.0999 6.43 0.185 0.126 8.8 10.7725 0.9881 1492730 IFLab1_003440 CCOC(=O)c1c(C)c(C)sc1NC(=O)C2(CC2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M09 compound treatment 0.646 0.578 37.2 0.188 0.129 9.01 32.6759 0.8537 1377193 IFLab1_003441 Cc1ccccc1NC(=O)c2csc3CCCCc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M10 compound treatment 0.965 0.897 57.73 0.867 0.808 56.45 80.736 0.9999 1278533 IFLab1_003442 Cc1nn(C(=O)CNS(=O)(=O)c2ccccc2)c(C)c1Sc3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M11 compound treatment 0.099 0.0309 1.99 0.082 0.023 1.61 2.5441 0.9943 1274575 IFLab1_003443 C=CCN(CC=C)S(=O)(=O)c1ccc(cc1)C(=O)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M12 compound treatment 0.105 0.0369 2.38 0.094 0.035 2.45 3.41 0.9999 2067573 IFLab1_003444 CCc1cc2c(=O)c(Oc3ccccc3)c(oc2cc1O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M13 compound treatment 0.07 0.00194 0.12 0.094 0.035 2.45 1.817 0.7422 2067574 IFLab1_003445 Clc1cc(C(=O)N2CCc3ccccc23)c(Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M14 compound treatment 0.082 0.0139 0.9 0.072 0.013 0.91 1.2764 1.0 1369842 IFLab1_003446 Cc1cc(O)cc2oc(C)c(Oc3ccccc3)c(=O)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M15 compound treatment 0.086 0.0179 1.15 0.074 0.015 1.05 1.5573 0.9988 1641075 IFLab1_003447 Oc1n(nc2ncncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M16 compound treatment 1.222 1.15 74.27 1.193 1.13 79.22 108.5367 0.9995 2067575 IFLab1_003448 Cc1ccc(C)n1n2cnc3scc(c4ccc(F)cc4)c3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M17 compound treatment 0.084 0.0159 1.03 0.066 0.007 0.49 1.0711 0.9426 1720875 IFLab1_003449 CC(C)C1CCC(C)CC1OCC(O)CN2CC(C)OC(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M18 compound treatment 1.001 0.933 60.05 0.991 0.932 65.11 88.4999 0.9992 2067576 IFLab1_003450 Cc1nc(SCCO)c2c3CCCc3sc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M19 compound treatment 0.088 0.0199 1.28 0.068 0.009 0.63 1.3519 0.9461 1219582 IFLab1_003451 NCC(c1ccco1)c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M20 compound treatment 0.085 0.0169 1.09 0.057 -0.002 -0.14 0.672 0.6115 1478257 IFLab1_003452 OC(=O)c1cc(cc(c1)C(=O)O)N2C(=O)CSC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M21 compound treatment 0.058 -0.0101 -0.65 0.053 -0.006 -0.42 -0.7545 -0.9778 1349251 IFLab1_003453 COc1ccc(cc1Cl)N2C(SCC2=O)c3cccc(OC)c3OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M22 compound treatment 0.047 -0.0211 -1.36 0.047 -0.012 -0.84 -1.5515 -0.9733 1584606 IFLab1_003454 CCN1CCN(CC1)S(=O)(=O)c2c(C)c(C)cc(C)c2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M23 mock treatment 0.054 -0.0141 -0.91 0.047 -0.012 -0.84 -1.2329 -0.9993 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 M24 mock treatment 0.07 0.00194 0.12 0.057 -0.002 -0.14 -0.0107 -0.0572 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N01 compound treatment 0.092 0.0239 1.54 0.085 0.026 1.82 2.3737 0.9966 1739652 IFLab1_003455 Cc1cc2nnc(SCC(=O)NCc3ccco3)n2c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N02 compound treatment 0.095 0.0269 1.73 0.082 0.023 1.61 2.3621 0.9993 2067577 IFLab1_003456 Cc1ccc(cc1C)c2csc(n2)/C(=C/Nc3ccccc3)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N03 compound treatment 0.081 0.0129 0.83 0.073 0.014 0.98 1.2803 0.9968 2067578 IFLab1_003457 COc1ncnc2n(ncc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N04 compound treatment 0.138 0.0699 4.5 0.136 0.077 5.38 6.9866 0.9961 1554368 IFLab1_003458 Cc1ccc2OC(CC(=O)c2c1)c3cc(Br)cc4COCOc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N05 compound treatment 0.074 0.00594 0.38 0.067 0.008 0.56 0.6653 0.9828 2067579 IFLab1_003459 C=CCNc1nc(c(s1)C(=O)Nc2cccnc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N06 compound treatment 0.071 0.00294 0.19 0.081 0.022 1.54 1.2204 0.7881 1290098 IFLab1_003460 COc1cc(cc(OC)c1OC)C(=O)N2Cc3ccccc3CC2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N07 compound treatment 0.258 0.19 12.23 0.211 0.152 10.62 16.1531 0.9975 1694396 IFLab1_003461 COc1ccccc1c2nnc(NC(=O)C(C)SC3=NCCS3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N08 compound treatment 0.087 0.0189 1.22 0.081 0.022 1.54 1.9486 0.9934 1174227 IFLab1_003462 CN(Cc1ccccc1)C(=O)C2CCCCN2S(=O)(=O)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N09 compound treatment 0.36 0.292 18.79 0.242 0.183 12.78 22.3267 0.9824 2067580 IFLab1_003463 CCOC(=O)CCCN1C(=O)/C(=C/c2cccc(OC)c2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N10 compound treatment 0.051 -0.0171 -1.1 0.051 -0.008 -0.56 -1.1718 -0.9509 1584745 IFLab1_003464 Oc1ccc(C(=O)OCC(=O)c2ccccc2)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N11 compound treatment 0.084 0.0159 1.03 0.068 0.009 0.63 1.1699 0.9724 1581754 IFLab1_003465 O=C1C2C3CC(C=C3)C2C(=O)N1C4CCS(=O)(=O)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N12 compound treatment 0.085 0.0169 1.09 0.072 0.013 0.91 1.413 0.9959 1330006 IFLab1_003466 Cc1sc(NC(=O)CCC(=O)O)c(C#N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N13 compound treatment 0.083 0.0149 0.96 0.076 0.017 1.19 1.5195 0.9945 2067581 IFLab1_003467 N/C(=N/c1ccccc1)/C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N14 compound treatment 0.141 0.0729 4.69 0.091 0.032 2.24 4.9003 0.9424 1571895 IFLab1_003468 OC(=O)CCCC(=O)Nc1nc(cs1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N15 compound treatment 0.158 0.0899 5.79 0.121 0.062 4.33 7.1559 0.9898 2067582 IFLab1_003469 COc1ccc(cc1)c2c(oc3cc(O)ccc3c2=O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N16 compound treatment 0.08 0.0119 0.77 0.064 0.005 0.35 0.7902 0.9364 1113394 IFLab1_003470 Clc1ccccc1NC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N17 compound treatment 0.158 0.0899 5.79 0.128 0.069 4.82 7.5017 0.9959 1164418 IFLab1_003471 Cc1c(O)ccc(c2n[nH]cc2c3ccccc3)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N18 compound treatment 0.071 0.00294 0.19 0.06 0.001 0.07 0.183 0.9084 1552580 IFLab1_003472 CCOc1ccc(NC(=O)c2cc3cc(Br)ccc3oc2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N19 compound treatment 0.156 0.0879 5.66 0.107 0.048 3.35 6.3733 0.9688 1143498 IFLab1_003473 CC(=O)Oc1ccc2c(=O)c(coc2c1C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N20 compound treatment 0.081 0.0129 0.83 0.063 0.004 0.28 0.7863 0.8953 1407757 IFLab1_003474 CCN(C1CCCCC1)C(=O)c2cc3cc(OC)ccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N21 compound treatment 0.063 -0.00506 -0.33 0.051 -0.008 -0.56 -0.6257 -0.9671 2067583 IFLab1_003475 Cc1ccc(cc1)c2csc(n2)/C(=C\Nc3ccc(cc3)S(=O)(=O)N)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N22 compound treatment 0.041 -0.0271 -1.74 0.041 -0.018 -1.26 -2.121 -0.9872 2067584 IFLab1_003476 Oc1c(Cl)cc(Cl)cc1/C=N/C2=C(CCC2)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N23 mock treatment 0.057 -0.0111 -0.71 0.05 -0.009 -0.63 -0.9482 -0.9981 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 N24 mock treatment 0.076 0.00794 0.51 0.057 -0.002 -0.14 0.2624 0.4955 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O01 compound treatment 0.18 0.112 7.2 0.145 0.086 6.01 9.3428 0.9959 2067585 IFLab1_003477 Fc1cccc(Cl)c1CSc2ncnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O02 compound treatment 0.074 0.00594 0.38 0.077 0.018 1.26 1.1593 0.8821 2067586 IFLab1_003478 C(Sc1nc2ccccc2s1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O03 compound treatment 0.111 0.0429 2.76 0.092 0.033 2.31 3.5843 0.9959 2067587 IFLab1_003479 Fc1ccc(cc1)c2nnc3ccc(SCc4ccccc4)nn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O04 compound treatment 0.163 0.0949 6.11 0.111 0.052 3.63 6.8895 0.9692 2067588 IFLab1_003480 N#CC(=C(/C=C/c1cccs1)C2CC2)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O05 compound treatment 0.064 -0.00406 -0.26 0.06 0.001 0.07 -0.1356 -0.5007 1312621 IFLab1_003481 O=C(CCSc1ccccc1)Nc2nc(cs2)c3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O06 compound treatment 0.525 0.457 29.41 0.388 0.329 22.98 37.0485 0.9926 1732274 IFLab1_003482 OCCNc1nc(c2ccccc2)c3cc(Cl)ccc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O07 compound treatment 0.097 0.0289 1.86 0.077 0.018 1.26 2.2061 0.9817 2067589 IFLab1_003483 Oc1ccc(N/C(=N\S(=O)(=O)c2ccccc2)/c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O08 compound treatment 0.134 0.0659 4.24 0.118 0.059 4.12 5.9154 0.9999 1441706 IFLab1_003484 O=C(NCc1ccc2OCOc2c1)c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O09 compound treatment 0.531 0.463 29.8 0.406 0.347 24.24 38.2108 0.9948 1247662 IFLab1_003485 COc1ccccc1NC(=O)c2csc3CCCCc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O10 compound treatment 0.094 0.0259 1.67 0.073 0.014 0.98 1.872 0.9676 1295311 IFLab1_003486 Brc1ccc(s1)C(=O)Nc2nc(cs2)c3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O11 compound treatment 0.128 0.0599 3.86 0.098 0.039 2.72 4.6544 0.9855 1427279 IFLab1_003487 C=CCN(CC=C)S(=O)(=O)c1ccc(cc1)C(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O12 compound treatment 0.169 0.101 6.5 0.113 0.054 3.77 7.2614 0.9666 2067590 IFLab1_003488 Oc1ccc2c(=O)c(Oc3ccccc3)c(oc2c1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O13 compound treatment 0.162 0.0939 6.05 0.109 0.05 3.49 6.7452 0.966 1581630 IFLab1_003489 CCc1ccccc1NC(=O)c2cc(Cl)sc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O14 compound treatment 0.142 0.0739 4.76 0.09 0.031 2.17 4.8964 0.9365 2067591 IFLab1_003490 Cc1cc(O)cc2oc(c(Oc3ccccc3)c(=O)c12)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O15 compound treatment 0.057 -0.0111 -0.71 0.055 -0.004 -0.28 -0.7012 -0.9165 2067592 IFLab1_003491 CC1CCCN(CC(O)COCCC2(CC3CC4CC(C3)C2)C4)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O16 compound treatment 0.104 0.0359 2.31 0.086 0.027 1.89 2.9693 0.9949 1176174 IFLab1_003492 CC(=O)Nc1cccc(Oc2nc(C)nc3sc4CCCCc4c23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O17 compound treatment 0.073 0.00494 0.32 0.062 0.003 0.21 0.3728 0.9796 1592437 IFLab1_003493 OC(COc1ccc(Cl)cc1)CN2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O18 compound treatment 0.143 0.0749 4.82 0.098 0.039 2.72 5.3371 0.9634 1705824 IFLab1_003494 CCOC(=O)c1c(C)[nH]c(C(=O)CSc2ccc(Cl)cc2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O19 compound treatment 0.107 0.0389 2.51 0.075 0.016 1.12 2.5624 0.9338 2067593 IFLab1_003495 Cc1ccccc1NC(=O)c2cccc(NC(=O)C(F)(F)F)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O20 compound treatment 0.146 0.0779 5.02 0.08 0.021 1.47 4.5844 0.8772 2067594 IFLab1_003496 O=C1CSC(=S)N1CC2CCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O21 compound treatment 0.087 0.0189 1.22 0.064 0.005 0.35 1.1088 0.8746 1073429 IFLab1_003497 O=C(Nc1ccc(cc1)C(=O)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O22 compound treatment 0.058 -0.0101 -0.65 0.05 -0.009 -0.63 -0.9027 -0.9999 2067595 IFLab1_003498 Fc1ccc(cc1)N2CCN(CC2)S(=O)(=O)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O23 mock treatment 0.066 -0.00206 -0.13 0.059 0.0 0.0 -0.094 -0.7071 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 O24 mock treatment 0.089 0.0209 1.35 0.057 -0.002 -0.14 0.854 0.6304 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P01 compound treatment 0.068 -6.45E-5 0.0 0.07 0.011 0.77 0.5404 0.7033 2067596 IFLab1_003499 COc1ccc(cc1OC)C2=N/C(=C/c3ccco3)/C(=O)O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P02 compound treatment 0.079 0.0109 0.7 0.069 0.01 0.7 0.9917 1.0 2067597 IFLab1_003500 COc1cccc(N/C=C(\C#N)/c2nc(cs2)c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P03 compound treatment 0.095 0.0269 1.73 0.089 0.03 2.1 2.7079 0.9956 1597962 IFLab1_003501 Fc1ccc(cc1)c2nnc(N3CCOCC3)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P04 compound treatment 0.084 0.0159 1.03 0.073 0.014 0.98 1.4168 0.9997 1290708 IFLab1_003502 OC(=O)C1CCN(CC1)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P05 compound treatment 0.097 0.0289 1.86 0.078 0.019 1.33 2.2555 0.9862 2067598 IFLab1_003503 Cc1cc(=O)oc2cc(OCCOc3ccccc3)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P06 compound treatment 0.083 0.0149 0.96 0.074 0.015 1.05 1.4207 0.9991 2067599 IFLab1_003504 FC(F)(F)C1CCCC(C1)NC(=O)c2ccncc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P07 compound treatment 0.108 0.0399 2.57 0.083 0.024 1.68 3.0031 0.9786 1742215 IFLab1_003505 COc1ccc(cc1)c2nnc(NC(=O)C(C)Sc3ccc(C)cc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P08 compound treatment 0.086 0.0179 1.15 0.074 0.015 1.05 1.5573 0.9988 2067600 IFLab1_003506 CC1CCCN(C1)c2ccc(cn2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P09 compound treatment 0.078 0.00994 0.64 0.069 0.01 0.7 0.9462 0.999 2067601 IFLab1_003507 COc1cccc(/C=C/2\SC(=S)N(CCCC(=O)Nc3ccccc3C(F)(F)F)C2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P10 compound treatment 0.12 0.0519 3.34 0.116 0.057 3.98 5.1794 0.9962 1192861 IFLab1_003508 O=C(OC1CCCCC1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P11 compound treatment 0.086 0.0179 1.15 0.067 0.008 0.56 1.2115 0.9446 1430028 IFLab1_003509 CCS(=O)(=O)c1ccc(O)c(c1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P12 compound treatment 0.066 -0.00206 -0.13 0.07 0.011 0.77 0.4494 0.5763 1374110 IFLab1_003510 COc1cccc(OC(=O)c2cc3ccccc3oc2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P13 compound treatment 0.058 -0.0101 -0.65 0.057 -0.002 -0.14 -0.5569 -0.8403 1314980 IFLab1_003511 O=S(=O)(N=S(N1CCCCC1)N2CCCCC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P14 compound treatment 0.081 0.0129 0.83 0.098 0.039 2.72 2.5153 0.8829 2067602 IFLab1_003512 Cc1sc(/N=C/c2c[nH]c3ccccc23)c(C#N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P15 compound treatment 0.269 0.201 12.93 0.223 0.164 11.46 17.2465 0.9982 1451504 IFLab1_003513 Cc1ccccc1CC(=O)c2ccc(O)cc2O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P16 compound treatment 0.079 0.0109 0.7 0.065 0.006 0.42 0.7941 0.9693 1313479 IFLab1_003514 CN(C)S(=O)(=O)c1cccc2c(cccc12)S(=O)(=O)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P17 compound treatment 0.102 0.0339 2.18 0.101 0.042 2.93 3.6192 0.9894 1542694 IFLab1_003515 COc1ccc(c2n[nH]cc2c3ccccc3)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P18 compound treatment 0.078 0.00994 0.64 0.076 0.017 1.19 1.292 0.9578 1661708 IFLab1_003516 CC(NC(=O)c1cc2ccccc2oc1=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P19 compound treatment 0.082 0.0139 0.9 0.071 0.012 0.84 1.227 0.9994 1270685 IFLab1_003517 CN(C)Cc1c(O)ccc2c(=O)c(c(C)oc12)c3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P20 compound treatment 0.055 -0.0131 -0.84 0.056 -0.003 -0.21 -0.7428 -0.8571 2067603 IFLab1_003518 COc1ccc(O)c(/C=N/CCc2ccccc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P21 compound treatment 0.074 0.00594 0.38 0.064 0.005 0.35 0.5171 0.999 2067604 IFLab1_003519 NS(=O)(=O)c1ccc(N/C=C(/C#N)\c2nc(cs2)c3ccc(Cl)c(Cl)c3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P22 compound treatment 0.076 0.00794 0.51 0.07 0.011 0.77 0.9045 0.9803 1237246 IFLab1_003520 COc1ccc(Br)cc1S(=O)(=O)NCc2ccc3OCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P23 mock treatment 0.07 0.00194 0.12 0.07 0.011 0.77 0.6315 0.8111 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1421 P24 mock treatment 0.057 -0.0111 -0.71 0.051 -0.008 -0.56 -0.8988 -0.9928 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A01 compound treatment 0.099 0.0312 2.01 0.095 0.0301 2.1 2.906 0.9997 1409745 IFLab1_003521 O=C(NCc1ccc2OCOc2c1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A02 compound treatment 0.078 0.0102 0.66 0.077 0.0121 0.84 1.0611 0.9921 1784445 IFLab1_003522 CC/C(=C(\C#N)/c1nc2ccccc2[nH]1)/O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A03 compound treatment 0.067 -8.12E-4 -0.05 0.07 0.00509 0.36 0.2146 0.5968 2067605 IFLab1_003523 Cc1ccc(/C=N/c2sc(C)c(C)c2C#N)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A04 compound treatment 0.069 0.00119 0.08 0.06 -0.00491 -0.34 -0.1883 -0.5362 2067606 IFLab1_003524 COC1CS(=O)(=O)CC1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A05 compound treatment 0.08 0.0122 0.78 0.069 0.00409 0.29 0.7569 0.9065 1227048 IFLab1_003525 CC1CN(CCN1C(=O)c2cccc(Cl)c2)C(=O)c3cccc(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A06 compound treatment 0.074 0.00619 0.4 0.074 0.00909 0.64 0.7308 0.9747 1326007 IFLab1_003526 COc1cccc2cc(c3nnc(Nc4ccccc4F)s3)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A07 compound treatment 0.065 -0.00281 -0.18 0.069 0.00409 0.29 0.0742 0.2193 1345083 IFLab1_003527 O=C(Nc1ccncc1NC(=O)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A08 compound treatment 0.076 0.00819 0.53 0.088 0.0231 1.61 1.5134 0.8917 1656482 IFLab1_003528 Clc1cccc(c1)C2SCCN2C(=O)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A09 compound treatment 0.061 -0.00681 -0.44 0.069 0.00409 0.29 -0.1078 -0.206 1520132 IFLab1_003529 CC(C)N(C(=O)Cn1cnc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A10 compound treatment 1.101 1.03 66.5 0.93 0.865 60.44 89.7576 0.9989 1637825 IFLab1_003530 COC(=O)c1sc2ccccc2c1NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A11 compound treatment 0.067 -8.12E-4 -0.05 0.066 0.00109 0.08 0.0171 0.1841 1230553 IFLab1_003531 Clc1ccc(OCc2nc3ccccc3[nH]2)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A12 compound treatment 0.108 0.0402 2.59 0.096 0.0311 2.17 3.365 0.9962 2067607 IFLab1_003532 FC(F)(F)c1cccc(c1)C(=O)Nc2ccccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A13 compound treatment 0.065 -0.00281 -0.18 0.069 0.00409 0.29 0.0742 0.2193 1243864 IFLab1_003533 COc1ccc(NC(=O)CSc2nc(C)cc(=O)[nH]2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A14 compound treatment 0.093 0.0252 1.62 0.095 0.0301 2.1 2.6329 0.9918 2067608 IFLab1_003534 CCNc1nc(NCC)nc(SCC(=O)c2ccccc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A15 compound treatment 0.078 0.0102 0.66 0.068 0.00309 0.22 0.6165 0.8929 2067609 IFLab1_003535 C=CCn1nnnc1SCC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A16 compound treatment 0.059 -0.00881 -0.57 0.061 -0.00391 -0.27 -0.594 -0.9438 1331694 IFLab1_003536 COc1ccc(cc1)c2cc3ccccn3c2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A17 compound treatment 0.064 -0.00381 -0.25 0.071 0.00609 0.43 0.1275 0.2595 1166854 IFLab1_003537 C(N1CCN(CC1)c2ccccc2)c3cn4cccnc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A18 compound treatment 0.068 1.88E-4 0.01 0.065 9.38E-5 0.01 0.0132 0.9588 2067610 IFLab1_003538 O=C(Nc1nccs1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A19 compound treatment 0.06 -0.00781 -0.5 0.06 -0.00491 -0.34 -0.5979 -0.9825 2067611 IFLab1_003539 COc1ccc(cc1)C(=O)CNC2=NCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A20 compound treatment 0.069 0.00119 0.08 0.074 0.00909 0.64 0.5033 0.7865 1700419 IFLab1_003540 CCOc1ccc(cc1)S(=O)(=O)NCCO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A21 compound treatment 0.07 0.00219 0.14 0.064 -9.06E-4 -0.06 0.0548 0.3549 1164353 IFLab1_003541 OC(=O)CNC(=O)COc1cccc(Br)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A22 compound treatment 0.096 0.0282 1.81 0.093 0.0281 1.96 2.6707 0.9992 1152002 IFLab1_003542 COc1ccccc1NC(=O)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A23 mock treatment 0.065 -0.00281 -0.18 0.058 -0.00691 -0.48 -0.4692 -0.9104 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 A24 mock treatment 0.069 0.00119 0.08 0.077 0.0121 0.84 0.6515 0.7679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B01 compound treatment 0.078 0.0102 0.66 0.062 -0.00291 -0.2 0.3201 0.4663 1677123 IFLab1_003543 Cc1cc(=O)cc(C)n1c2ccc(cc2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B02 compound treatment 0.066 -0.00181 -0.12 0.063 -0.00191 -0.13 -0.1767 -0.9978 2067612 IFLab1_003544 CC(=C)C(=O)Oc1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B03 compound treatment 0.08 0.0122 0.78 0.087 0.0221 1.54 1.6461 0.9507 1207063 IFLab1_003545 CCOC(=O)C1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B04 compound treatment 0.096 0.0282 1.81 0.097 0.0321 2.24 2.8683 0.9945 1980352 IFLab1_003546 CCCc1nnc2SCC(=Nn12)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B05 compound treatment 0.079 0.0112 0.72 0.073 0.00809 0.57 0.909 0.9928 1398133 IFLab1_003547 Cn1c(=NC(=O)c2nc3ccccc3s2)sc4cc(Cl)ccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B06 compound treatment 0.059 -0.00881 -0.57 0.066 0.00109 0.08 -0.3471 -0.6064 2067613 IFLab1_003548 COc1ccc(cc1)C(=O)CSc2nnc3CCCCCn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B07 compound treatment 0.192 0.124 7.99 0.17 0.105 7.34 10.8436 0.9991 2067614 IFLab1_003549 O=C(Nc1ccc2sccc2c1)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B08 compound treatment 0.079 0.0112 0.72 0.076 0.0111 0.78 1.0572 0.9993 2067615 IFLab1_003550 CCc1ccc(/C=C/2\SC(=S)N(CCCC(=O)Nc3cccnc3)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B09 compound treatment 0.684 0.616 39.66 0.76 0.695 48.56 62.381 0.995 1145470 IFLab1_003551 O=C(Nc1ccc(cc1)c2nc3ccccc3o2)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B10 compound treatment 0.07 0.00219 0.14 0.071 0.00609 0.43 0.4006 0.8934 2067616 IFLab1_003552 Cn1c(=NC(=O)c2ccc(Br)s2)sc3cc(F)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B11 compound treatment 0.058 -0.00981 -0.63 0.06 -0.00491 -0.34 -0.689 -0.9588 1265904 IFLab1_003553 CCC(=O)Nc1ccc(cc1)c2nnc3CCCCCn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B12 compound treatment 0.118 0.0502 3.23 0.096 0.0311 2.17 3.8202 0.9814 2067617 IFLab1_003554 NC(=O)c1ccc(N/C=C(\C#N)/c2nc(cs2)c3cccc4ccccc34)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B13 compound treatment 0.09 0.0222 1.43 0.092 0.0271 1.89 2.3482 0.9904 2067618 IFLab1_003555 CC(Sc1nnc(o1)c2cccc(Br)c2)C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B14 compound treatment 0.065 -0.00281 -0.18 0.058 -0.00691 -0.48 -0.4692 -0.9104 1134927 IFLab1_003556 CC(C)(C)NC(=O)C1C2CC(C)(NC1=O)Oc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B15 compound treatment 0.256 0.188 12.11 0.244 0.179 12.51 17.4119 0.9999 1650896 IFLab1_003557 CCOC(=O)c1c(C)[nH]c(C(=O)CC(=O)OC)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B16 compound treatment 0.06 -0.00781 -0.5 0.063 -0.00191 -0.13 -0.4497 -0.8646 1545249 IFLab1_003558 Cc1ccc(OCC(O)CN2CCCCC2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B17 compound treatment 0.058 -0.00981 -0.63 0.059 -0.00591 -0.41 -0.7384 -0.9787 2067619 IFLab1_003559 OC(=O)c1cccc(c1)N2C(=O)/C(=C\c3ccc4OCOc4c3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B18 compound treatment 0.297 0.229 14.75 0.066 0.00109 0.08 10.485 0.7108 1351386 IFLab1_003560 COc1ccccc1N2CCN(CC(O)COc3ccccc3CC=C)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B19 compound treatment 0.047 -0.0208 -1.34 0.049 -0.0159 -1.11 -1.733 -0.9957 1166032 IFLab1_003561 CC(C)c1ccc(OCC(C)NC(=O)c2cccs2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B20 compound treatment 0.164 0.0962 6.19 0.162 0.0971 6.78 9.174 0.999 1068756 IFLab1_003562 Cc1ccc(cc1)S(=O)(=O)CC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B21 compound treatment 0.061 -0.00681 -0.44 0.063 -0.00191 -0.13 -0.4042 -0.8821 1597132 IFLab1_003563 CCC(=O)Oc1ccc(cc1)N2C(=O)CCC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B22 compound treatment 0.075 0.00719 0.46 0.068 0.00309 0.22 0.48 0.9399 1604489 IFLab1_003564 O=S(=O)(N1CCc2ccccc12)c3cccc4cccnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B23 mock treatment 0.054 -0.0138 -0.89 0.066 0.00109 0.08 -0.5746 -0.644 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 B24 mock treatment 0.061 -0.00681 -0.44 0.061 -0.00391 -0.27 -0.503 -0.974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C01 compound treatment 0.077 0.00919 0.59 0.075 0.0101 0.71 0.9168 0.9962 1280715 IFLab1_003565 COc1ccc(Br)cc1S(=O)(=O)n2ccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C02 compound treatment 0.236 0.168 10.83 0.224 0.159 11.11 15.5137 0.9999 2067620 IFLab1_003566 FC(F)(F)SCC(=O)Nc1ccc(I)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C03 compound treatment 0.063 -0.00481 -0.31 0.06 -0.00491 -0.34 -0.4614 -0.9987 1475116 IFLab1_003567 COc1ccc2cc(ccc2c1)S(=O)(=O)N3CCN(C)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C04 compound treatment 0.068 1.88E-4 0.01 0.065 9.38E-5 0.01 0.0132 0.9588 1224373 IFLab1_003568 OC1CS(=O)(=O)CC1N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C05 compound treatment 0.069 0.00119 0.08 0.073 0.00809 0.57 0.4539 0.7955 1490334 IFLab1_003569 CC1CN(CCN1C(=O)c2ccccc2Cl)C(=O)c3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C06 compound treatment 0.067 -8.12E-4 -0.05 0.063 -0.00191 -0.13 -0.1311 -0.9166 1327035 IFLab1_003570 CCOc1cccc2cc(C(=O)N)c(=Nc3ccccc3F)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C07 compound treatment 0.062 -0.00581 -0.37 0.064 -9.06E-4 -0.06 -0.3093 -0.8152 1117794 IFLab1_003571 O=C(Nc1ccncc1NC(=O)C2CC2)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C08 compound treatment 0.063 -0.00481 -0.31 0.065 9.38E-5 0.01 -0.2144 -0.692 1303507 IFLab1_003572 CCC(=O)Nc1cccc(c1)c2cn3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C09 compound treatment 0.052 -0.0158 -1.02 0.051 -0.0139 -0.97 -1.4066 -0.9997 2067621 IFLab1_003573 CCCn1c(CCCO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C10 compound treatment 0.583 0.515 33.16 0.391 0.326 22.78 39.5562 0.9832 1383855 IFLab1_003574 COC(=O)c1sc2ccccc2c1NC(=O)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C11 compound treatment 0.068 1.88E-4 0.01 0.065 9.38E-5 0.01 0.0132 0.9588 1142340 IFLab1_003575 COc1cc(Cn2c(nc3ccccc23)c4ccc(O)c(OC)c4)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C12 compound treatment 0.157 0.0892 5.74 0.181 0.116 8.11 9.794 0.9857 1385320 IFLab1_003576 O=C(Nc1ccccc1C#N)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C13 compound treatment 0.055 -0.0128 -0.82 0.056 -0.00891 -0.62 -1.0231 -0.9903 2067622 IFLab1_003577 Brc1ccc(NC2=Nc3ccccc3SC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C14 compound treatment 0.076 0.00819 0.53 0.06 -0.00491 -0.34 0.1303 0.2072 1455353 IFLab1_003578 O=C(CSc1nc2ccccc2c(=O)n1c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C15 compound treatment 0.084 0.0162 1.04 0.072 0.00709 0.5 1.0872 0.9423 1569227 IFLab1_003579 COc1ccc(cc1)C(=O)CSc2nnnn2CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C16 compound treatment 0.074 0.00619 0.4 0.072 0.00709 0.5 0.632 0.9941 1182009 IFLab1_003580 CC(C)N(C(=O)CSc1ccccc1C(=O)O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C17 compound treatment 0.056 -0.0118 -0.76 0.061 -0.00391 -0.27 -0.7306 -0.9044 2067623 IFLab1_003581 Cn1cnn2cc(c3ccccc3)[n+](C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C18 compound treatment 0.089 0.0212 1.36 0.078 0.0131 0.91 1.6111 0.9811 1360104 IFLab1_003582 COc1ccccc1N2CCN(CC2)C(=O)Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C19 compound treatment 0.112 0.0442 2.84 0.098 0.0331 2.31 3.6459 0.9947 1730817 IFLab1_003583 COC(=O)c1ccccc1Sc2c(nc3ncccn23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C20 compound treatment 0.057 -0.0108 -0.7 0.065 9.38E-5 0.01 -0.4875 -0.7004 1207062 IFLab1_003584 OCCNS(=O)(=O)c1cc(Cl)ccc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C21 compound treatment 0.079 0.0112 0.72 0.075 0.0101 0.71 1.0078 0.9999 1720395 IFLab1_003585 O=C(COc1cccc2ccccc12)OC3CCS(=O)(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C22 compound treatment 0.134 0.0662 4.26 0.141 0.0761 5.32 6.7713 0.994 1409165 IFLab1_003586 COc1ccc(cc1)S(=O)(=O)N2C(C)CCCC2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C23 mock treatment 0.077 0.00919 0.59 0.061 -0.00391 -0.27 0.2252 0.3458 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 C24 mock treatment 0.073 0.00519 0.33 0.068 0.00309 0.22 0.3889 0.9778 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D01 compound treatment 0.066 -0.00181 -0.12 0.066 0.00109 0.08 -0.0285 -0.2041 2067624 IFLab1_003587 OC(=O)CC1(OCCO1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D02 compound treatment 0.077 0.00919 0.59 0.062 -0.00291 -0.2 0.2746 0.4392 1400553 IFLab1_003588 Oc1cccc(c1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D03 compound treatment 0.064 -0.00381 -0.25 0.065 9.38E-5 0.01 -0.1689 -0.688 1107771 IFLab1_003589 CN1CCN(Cc2oc(CO)cc(=O)c2O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D04 compound treatment 0.929 0.861 55.43 0.836 0.771 53.87 77.2859 0.9999 2067625 IFLab1_003590 CCCc1nnc2SCC(=Nn12)c3ccc(OC)c(OC)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D05 compound treatment 0.068 1.88E-4 0.01 0.069 0.00409 0.29 0.2108 0.7363 1309648 IFLab1_003591 Fc1cccc(F)c1C(=O)Nc2ccc(cc2)c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D06 compound treatment 0.076 0.00819 0.53 0.071 0.00609 0.43 0.6737 0.9944 2067626 IFLab1_003592 Cc1nnc2SCC(=Nn12)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D07 compound treatment 0.228 0.16 10.31 0.223 0.158 11.04 15.1002 0.9994 1710483 IFLab1_003593 O=C(Nc1ccc2sccc2c1)c3ccc(cc3)S(=O)(=O)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D08 compound treatment 0.063 -0.00481 -0.31 0.058 -0.00691 -0.48 -0.5602 -0.9771 2067627 IFLab1_003594 CCc1ccc(/C=C/2\SC(=S)N(CCCC(=O)NC3CCCC3)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D09 compound treatment 0.043 -0.0248 -1.6 0.041 -0.0239 -1.67 -2.3102 -0.9998 2067628 IFLab1_003595 OC(=O)c1sc2cc(Cl)ccc2c1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D10 compound treatment 0.06 -0.00781 -0.5 0.066 0.00109 0.08 -0.3015 -0.5929 2067629 IFLab1_003596 COc1cccc2sc(=NC(=O)c3cccc(c3)C(F)(F)F)n(C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D11 compound treatment 0.069 0.00119 0.08 0.074 0.00909 0.64 0.5033 0.7865 2067630 IFLab1_003597 Cc1ccc(cc1)C(=O)CSc2nnc3[nH]c(=O)cc(C)n23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D12 compound treatment 0.077 0.00919 0.59 0.075 0.0101 0.71 0.9168 0.9962 1220393 IFLab1_003598 COc1ccc(Br)cc1S(=O)(=O)n2ccnc2C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D13 compound treatment 0.065 -0.00281 -0.18 0.063 -0.00191 -0.13 -0.2222 -0.9886 2067631 IFLab1_003599 Cc1ccc(NC2=NCCOC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D14 compound treatment 0.066 -0.00181 -0.12 0.055 -0.00991 -0.69 -0.5718 -0.8148 1631142 IFLab1_003600 Cc1nc2ccccc2n1CC(=O)N3CC(=O)Nc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D15 compound treatment 0.07 0.00219 0.14 0.072 0.00709 0.5 0.45 0.8734 2067632 IFLab1_003601 O=c1ccc2ccc(OCCOc3ccc4ccc(=O)oc4c3)cc2o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D16 compound treatment 0.055 -0.0128 -0.82 0.05 -0.0149 -1.04 -1.3195 -0.9933 1559652 IFLab1_003602 CC1CCCN(CC(O)COCc2ccc(Cl)cc2)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D17 compound treatment 0.058 -0.00981 -0.63 0.054 -0.0109 -0.76 -0.9853 -0.9957 2067633 IFLab1_003603 O=S(=O)(/C=C/c1ccccc1)N2CCN(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D18 compound treatment 0.066 -0.00181 -0.12 0.066 0.00109 0.08 -0.0285 -0.2041 1444119 IFLab1_003604 Cc1cc(OCC(O)CN2CCN(CC2)c3ccccn3)ccc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D19 compound treatment 0.083 0.0152 0.98 0.08 0.0151 1.05 1.4368 0.9993 1432502 IFLab1_003605 Cc1ccc(cc1)N(C2CS(=O)(=O)C=C2)C(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D20 compound treatment 0.142 0.0742 4.78 0.107 0.0421 2.94 5.4559 0.9729 1559961 IFLab1_003606 Oc1c(ccc2cccnc12)C(N3CCCC3)c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D21 compound treatment 0.06 -0.00781 -0.5 0.053 -0.0119 -0.83 -0.9437 -0.9709 1239975 IFLab1_003607 CCC(=O)Oc1cccc(c1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D22 compound treatment 0.155 0.0872 5.61 0.52 0.455 31.79 26.449 0.8193 1400810 IFLab1_003608 O=S(=O)(N1CCc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D23 mock treatment 0.073 0.00519 0.33 0.066 0.00109 0.08 0.2901 0.847 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 D24 mock treatment 0.063 -0.00481 -0.31 0.062 -0.00291 -0.2 -0.3626 -0.979 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E01 compound treatment 0.125 0.0572 3.68 0.13 0.0651 4.55 5.8183 0.9945 1627518 IFLab1_003609 Cc1ccc(C(=O)O)c(c1)C(=O)Nc2nccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E02 compound treatment 0.069 0.00119 0.08 0.065 9.38E-5 0.01 0.0587 0.7649 2067634 IFLab1_003610 FC(F)(F)c1ccc2sc(CC#N)nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E03 compound treatment 0.067 -8.12E-4 -0.05 0.068 0.00309 0.22 0.1158 0.521 1530960 IFLab1_003611 COc1ccc2cc(ccc2c1)S(=O)(=O)n3nnc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E04 compound treatment 0.057 -0.0108 -0.7 0.07 0.00509 0.36 -0.2405 -0.3077 1083304 IFLab1_003612 O=S1(=O)CC(SC#N)C=C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E05 compound treatment 0.065 -0.00281 -0.18 0.07 0.00509 0.36 0.1236 0.3096 1193288 IFLab1_003613 COc1ccc(C)cc1S(=O)(=O)N2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E06 compound treatment 0.074 0.00619 0.4 0.059 -0.00591 -0.41 -0.0101 -0.0177 1737734 IFLab1_003614 CCOc1cccc2cc(C(=O)N)c(=Nc3ccc(F)cc3)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E07 compound treatment 1.413 1.35 86.58 1.308 1.24 86.84 122.6302 1.0 1655301 IFLab1_003615 COC(=O)c1sc(cc1NC(=O)C)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E08 compound treatment 0.063 -0.00481 -0.31 0.061 -0.00391 -0.27 -0.412 -0.998 1496658 IFLab1_003616 Cc1nc(cs1)c2cccc(NC(=O)c3cc4ccccc4oc3=O)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E09 compound treatment 0.053 -0.0148 -0.95 0.053 -0.0119 -0.83 -1.2623 -0.9977 2067635 IFLab1_003617 C=CCn1c(nc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E10 compound treatment 0.383 0.315 20.29 0.489 0.424 29.63 35.2946 0.9829 1221120 IFLab1_003618 COC(=O)c1sc2ccccc2c1NC(=O)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E11 compound treatment 0.072 0.00419 0.27 0.076 0.0111 0.78 0.7386 0.9001 1553473 IFLab1_003619 CCc1cccc(CC)c1N(COC)C(=O)CSc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E12 compound treatment 0.054 -0.0138 -0.89 0.051 -0.0139 -0.97 -1.3156 -0.999 2067636 IFLab1_003620 O=C(Cn1nnc(n1)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E13 compound treatment 0.154 0.0862 5.55 0.153 0.0881 6.15 8.2743 0.9987 2067637 IFLab1_003621 O=C1C(CCc2ccccc12)Sc3nnc(o3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E14 compound treatment 0.041 -0.0268 -1.73 0.041 -0.0239 -1.67 -2.4012 -0.9999 2067638 IFLab1_003622 CC(C)c1ccc(/C=C/2\C(=O)Nc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E15 compound treatment 0.063 -0.00481 -0.31 0.061 -0.00391 -0.27 -0.412 -0.998 2067639 IFLab1_003623 C/C(=C(/C#N)\c1nnc2CCCCCn12)/O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E16 compound treatment 0.056 -0.0118 -0.76 0.055 -0.00991 -0.69 -1.027 -0.9989 2067640 IFLab1_003624 CC1CSC(=N1)Nc2cccc(c2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E17 compound treatment 0.062 -0.00581 -0.37 0.06 -0.00491 -0.34 -0.5069 -0.999 2067641 IFLab1_003625 Cc1n[n+](CC(=O)c2ccc(Br)cc2)c(N)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E18 compound treatment 0.041 -0.0268 -1.73 0.04 -0.0249 -1.74 -2.4506 -1.0 2067642 IFLab1_003626 O=C(Oc1ccccc1)Oc2cccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E19 compound treatment 0.061 -0.00681 -0.44 0.061 -0.00391 -0.27 -0.503 -0.974 1149978 IFLab1_003627 OC(=O)c1ccc(CNC2CCS(=O)(=O)C2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E20 compound treatment 0.111 0.0432 2.78 0.12 0.0551 3.85 4.6871 0.9872 2067643 IFLab1_003628 CN(C)S(=O)(=O)c1c(C)cc(C)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E21 compound treatment 0.072 0.00419 0.27 0.067 0.00209 0.15 0.294 0.9588 1420932 IFLab1_003629 NS(=O)(=O)c1ccc(NC(=O)COc2cccc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E22 compound treatment 0.551 0.483 31.1 0.426 0.361 25.23 39.8287 0.9946 1403291 IFLab1_003630 COC(=O)c1c(C)oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E23 mock treatment 0.059 -0.00881 -0.57 0.071 0.00609 0.43 -0.1001 -0.1411 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 E24 mock treatment 0.07 0.00219 0.14 0.075 0.0101 0.71 0.5982 0.8319 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F01 compound treatment 0.063 -0.00481 -0.31 0.062 -0.00291 -0.2 -0.3626 -0.979 2067644 IFLab1_003631 C1CN=C(Nc2ccccc2)S1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F02 compound treatment 0.068 1.88E-4 0.01 0.081 0.0161 1.12 0.8035 0.7147 1431348 IFLab1_003632 Oc1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F03 compound treatment 0.114 0.0462 2.97 0.117 0.0521 3.64 4.6755 0.995 1512484 IFLab1_003633 OC(=O)c1ccc(cc1)n2c(cc3C(=O)CCCc32)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F04 compound treatment 0.069 0.00119 0.08 0.067 0.00209 0.15 0.1575 0.9542 1486736 IFLab1_003634 Cc1ccc(NC(=O)CSc2nnc3CCCCCn23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F05 compound treatment 0.084 0.0162 1.04 0.092 0.0271 1.89 2.0751 0.9604 2067645 IFLab1_003635 O=C(Nc1ccc(cc1)c2nc3ccccc3o2)/C=C/c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F06 compound treatment 0.063 -0.00481 -0.31 0.061 -0.00391 -0.27 -0.412 -0.998 2067646 IFLab1_003636 Clc1ccc(cc1)C(=O)CSc2nnc3CCCCCn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F07 compound treatment 0.071 0.00319 0.21 0.07 0.00509 0.36 0.3967 0.9658 1637291 IFLab1_003637 O=C(CCc1ccccc1)Nc2ccc3sccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F08 compound treatment 0.09 0.0222 1.43 0.082 0.0171 1.19 1.8542 0.996 1502473 IFLab1_003638 NC(=O)c1oc2ccccc2c1NC(=O)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F09 compound treatment 0.312 0.244 15.72 0.289 0.224 15.66 22.1835 1.0 1560840 IFLab1_003639 O=S(=O)(N1CCc2ccccc2C1)c3cccc4cccnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F10 compound treatment 0.062 -0.00581 -0.37 0.057 -0.00791 -0.55 -0.6551 -0.982 1179572 IFLab1_003640 COc1cccc2sc(=NC(=O)C3CCCCC3)n(C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F11 compound treatment 0.071 0.00319 0.21 0.057 -0.00791 -0.55 -0.2455 -0.4166 2067647 IFLab1_003641 Nc1ccc(cc1)S(=O)(=O)/N=C/2\CCCCCN2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F12 compound treatment 0.064 -0.00381 -0.25 0.06 -0.00491 -0.34 -0.4159 -0.9866 1682798 IFLab1_003642 Cc1c(Cl)ccc(c1Cl)S(=O)(=O)Nc2ccncc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F13 compound treatment 0.071 0.00319 0.21 0.072 0.00709 0.5 0.4955 0.9238 1211371 IFLab1_003643 CCOC(=O)c1c(C)oc2cc(Br)c(O)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F14 compound treatment 0.058 -0.00981 -0.63 0.063 -0.00191 -0.13 -0.5408 -0.8378 1205440 IFLab1_003644 COc1cccc(OCC(O)CN2CCCCC2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F15 compound treatment 0.053 -0.0148 -0.95 0.053 -0.0119 -0.83 -1.2623 -0.9977 1298587 IFLab1_003645 CC(C)(C)c1ccc(cc1)C(=O)N2CCCCCC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F16 compound treatment 0.061 -0.00681 -0.44 0.06 -0.00491 -0.34 -0.5524 -0.9926 1699254 IFLab1_003646 OCCN1CCN(CC(O)COCc2ccc(Cl)cc2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F17 compound treatment 0.067 -8.12E-4 -0.05 0.067 0.00209 0.15 0.0664 0.4278 2067648 IFLab1_003647 O=C/1N(C(=S)S\C1=C/c2cccnc2)c3ccc4OCCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F18 compound treatment 0.063 -0.00481 -0.31 0.073 0.00809 0.57 0.1808 0.2804 1181961 IFLab1_003648 COc1cccc(OC)c1OCC(O)CN2CCN(C)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F19 compound treatment 0.047 -0.0208 -1.34 0.046 -0.0189 -1.32 -1.8812 -1.0 1705677 IFLab1_003649 CC(C)c1ccc(OCC(C)NC(=O)c2ccc(Br)o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F20 compound treatment 0.131 0.0632 4.07 0.125 0.0601 4.2 5.8444 0.9999 1667146 IFLab1_003650 Oc1c(ccc2cccnc12)C(Nc3ccc(F)cc3)c4ccncc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F21 compound treatment 0.059 -0.00881 -0.57 0.061 -0.00391 -0.27 -0.594 -0.9438 1613489 IFLab1_003651 CCC(=O)Oc1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F22 compound treatment 0.059 -0.00881 -0.57 0.065 9.38E-5 0.01 -0.3965 -0.6989 1705192 IFLab1_003652 Clc1ccc(cc1)C2CC(=O)n3c(S2)nc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F23 mock treatment 0.077 0.00919 0.59 0.061 -0.00391 -0.27 0.2252 0.3458 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 F24 mock treatment 0.074 0.00619 0.4 0.061 -0.00391 -0.27 0.0886 0.1836 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G01 compound treatment 0.065 -0.00281 -0.18 0.069 0.00409 0.29 0.0742 0.2193 2067649 IFLab1_003653 Cc1cc(C)c(C(=O)NCCCN2CCOCC2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G02 compound treatment 1.228 1.16 74.68 1.095 1.03 71.96 103.6884 0.9998 2067650 IFLab1_003654 CCn1c2ccccc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G03 compound treatment 0.074 0.00619 0.4 0.069 0.00409 0.29 0.4838 0.9868 1341016 IFLab1_003655 COc1ccc(I)cc1S(=O)(=O)NCc2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G04 compound treatment 0.039 -0.0288 -1.85 0.04 -0.0249 -1.74 -2.5417 -0.9995 1086344 IFLab1_003656 C=CS(=O)(=O)Cc1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G05 compound treatment 0.095 0.0272 1.75 0.08 0.0151 1.05 1.983 0.9706 1480776 IFLab1_003657 COc1ccc(C)cc1S(=O)(=O)n2nnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G06 compound treatment 0.06 -0.00781 -0.5 0.065 9.38E-5 0.01 -0.3509 -0.6978 2067651 IFLab1_003658 FC(F)(F)c1cccc(Nc2nnc(s2)c3cc4ccccc4oc3=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G07 compound treatment 0.063 -0.00481 -0.31 0.06 -0.00491 -0.34 -0.4614 -0.9987 1271620 IFLab1_003659 COC(=O)c1sc(cc1NC(=O)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G08 compound treatment 0.058 -0.00981 -0.63 0.053 -0.0119 -0.83 -1.0347 -0.9908 2067652 IFLab1_003660 Cc1nc(cs1)c2ccc(/N=C/c3cc(Br)ccc3O)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G09 compound treatment 0.05 -0.0178 -1.15 0.049 -0.0159 -1.11 -1.5964 -0.9999 2067653 IFLab1_003661 C=CCn1c(Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G10 compound treatment 0.111 0.0432 2.78 0.08 0.0151 1.05 2.7112 0.9119 1416878 IFLab1_003662 COC(=O)c1sc2ccccc2c1NC(=O)COc3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G11 compound treatment 0.067 -8.12E-4 -0.05 0.065 9.38E-5 0.01 -0.0323 -0.6138 1590989 IFLab1_003663 CCc1cccc(CC)c1N(COC)C(=O)Cn2c(nc3ccccc23)C(C)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G12 compound treatment 0.067 -8.12E-4 -0.05 0.058 -0.00691 -0.48 -0.3781 -0.7792 1503144 IFLab1_003664 CC(=O)n1c(N)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G13 compound treatment 0.086 0.0182 1.17 0.074 0.00909 0.64 1.277 0.9588 2067654 IFLab1_003665 CC(C)N(C(=O)CSc1nnc(o1)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G14 compound treatment 0.046 -0.0218 -1.4 0.044 -0.0209 -1.46 -2.0255 -0.9998 2067655 IFLab1_003666 Brc1cccc(c1)c2nnc(Nc3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G15 compound treatment 0.062 -0.00581 -0.37 0.065 9.38E-5 0.01 -0.2599 -0.6946 2067656 IFLab1_003667 Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccccc3F)/SC2=S)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G16 compound treatment 0.082 0.0142 0.91 0.081 0.0161 1.12 1.4407 0.9947 1547461 IFLab1_003668 CC(C)c1ccc(cc1)S(=O)(=O)Nc2ccc(O)c(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G17 compound treatment 0.125 0.0572 3.68 0.124 0.0591 4.13 5.5219 0.9984 2067657 IFLab1_003669 N#CCc1ncc(CSc2nnnn2c3ccccc3)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G18 compound treatment 0.087 0.0192 1.24 0.076 0.0111 0.78 1.4213 0.9748 1007899 IFLab1_003670 O=C(Oc1ccc2ccccc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G19 compound treatment 0.059 -0.00881 -0.57 0.059 -0.00591 -0.41 -0.6928 -0.9878 1476561 IFLab1_003671 CN1CCN(CC1)C(=O)COc2ccc(Oc3ccccc3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G20 compound treatment 0.063 -0.00481 -0.31 0.057 -0.00791 -0.55 -0.6096 -0.9626 1376608 IFLab1_003672 OCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G21 compound treatment 0.084 0.0162 1.04 0.105 0.0401 2.8 2.7173 0.9093 1532797 IFLab1_003673 CCOC(=O)Cc1csc(NC(=O)COc2cccc3ccccc23)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G22 compound treatment 0.043 -0.0248 -1.6 0.045 -0.0199 -1.39 -2.1126 -0.9976 1730280 IFLab1_003674 O=C(Oc1ccccc1)Oc2ccc3ccc(=O)oc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G23 mock treatment 0.057 -0.0108 -0.7 0.06 -0.00491 -0.34 -0.7345 -0.9468 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 G24 mock treatment 0.065 -0.00281 -0.18 0.062 -0.00291 -0.2 -0.2716 -0.9984 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H01 compound treatment 0.054 -0.0138 -0.89 0.059 -0.00591 -0.41 -0.9204 -0.9391 1666173 IFLab1_003675 O=C1C(CN2CCCCC2)CCCC1CN3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H02 compound treatment 0.069 0.00119 0.08 0.06 -0.00491 -0.34 -0.1883 -0.5362 1172015 IFLab1_003676 CC1=CCC2C(C1)C(=O)N(C2=O)c3ccc(O)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H03 compound treatment 0.083 0.0152 0.98 0.095 0.0301 2.1 2.1778 0.9393 2067658 IFLab1_003677 Clc1ccc(cc1)C2C=C(Nc3ncnn23)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H04 compound treatment 0.065 -0.00281 -0.18 0.07 0.00509 0.36 0.1236 0.3096 1328685 IFLab1_003678 COc1ccc(NC(=O)CSc2nnc3CCCCCn23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H05 compound treatment 0.476 0.408 26.27 0.104 0.0391 2.73 20.509 0.7764 2067659 IFLab1_003679 COC(=O)c1sc2ccccc2c1NC(=O)c3ccc(Br)s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H06 compound treatment 0.066 -0.00181 -0.12 0.067 0.00209 0.15 0.0209 0.1119 1111757 IFLab1_003680 Fc1ccc(cc1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H07 compound treatment 0.062 -0.00581 -0.37 0.066 0.00109 0.08 -0.2105 -0.5513 1734773 IFLab1_003681 O=C(CN1C(=O)CCC1=O)Nc2ccc3sccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H08 compound treatment 0.065 -0.00281 -0.18 0.068 0.00309 0.22 0.0248 0.088 1304791 IFLab1_003682 COc1cccc2sc(=NC(=O)c3cccc4ccccc34)n(C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H09 compound treatment 0.066 -0.00181 -0.12 0.064 -9.06E-4 -0.06 -0.1273 -0.9588 1621309 IFLab1_003683 Cc1ccccc1NC(=O)CSc2ccccc2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H10 compound treatment 0.3 0.232 14.94 0.308 0.243 16.98 22.576 0.998 1634225 IFLab1_003684 Cc1ccc(cc1C)C(=O)Nc2c(oc3ccccc23)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H11 compound treatment 0.064 -0.00381 -0.25 0.062 -0.00291 -0.2 -0.3171 -0.9956 2067660 IFLab1_003685 Cc1ccccc1NC(=O)CSC2=NCCN2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H12 compound treatment 0.16 0.0922 5.93 0.176 0.111 7.76 9.6836 0.9912 1650383 IFLab1_003686 CCC1CCCCN1S(=O)(=O)c2ccc3cc(OC)ccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H13 compound treatment 1.205 1.14 73.2 1.162 1.1 76.64 105.9513 0.9997 1536420 IFLab1_003687 CCOC(=O)c1c(C)oc2cc(Br)c(OCC#N)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H14 compound treatment 0.055 -0.0128 -0.82 0.06 -0.00491 -0.34 -0.8255 -0.9243 1634405 IFLab1_003688 COc1cccc(OCC(O)CN2CC(C)CC(C)C2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H15 compound treatment 0.058 -0.00981 -0.63 0.058 -0.00691 -0.48 -0.7878 -0.9912 2067661 IFLab1_003689 COC(=O)c1c(NC(=O)CCNCc2ccco2)sc3CCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H16 compound treatment 0.053 -0.0148 -0.95 0.054 -0.0109 -0.76 -1.2129 -0.9938 1404662 IFLab1_003690 CCOC(=O)C1CCN(CC(O)COCc2ccc(Cl)cc2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H17 compound treatment 0.062 -0.00581 -0.37 0.07 0.00509 0.36 -0.0129 -0.025 2067662 IFLab1_003691 Cc1sc2ncnc(SCC(=O)c3ccc4OCCOc4c3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H18 compound treatment 0.056 -0.0118 -0.76 0.052 -0.0129 -0.9 -1.1752 -0.9964 1544274 IFLab1_003692 CC1CCCCN1CC(O)COc2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H19 compound treatment 0.107 0.0392 2.52 0.126 0.0611 4.27 4.8015 0.9685 1291788 IFLab1_003693 CC(C)(C)c1csc(NC(=O)c2ccc(Br)o2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H20 compound treatment 0.053 -0.0148 -0.95 0.05 -0.0149 -1.04 -1.4105 -0.999 1455013 IFLab1_003694 CC1(C)CC(CC(C)(C)N1)NC(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H21 compound treatment 0.062 -0.00581 -0.37 0.063 -0.00191 -0.13 -0.3587 -0.9033 2067663 IFLab1_003695 COC(=O)c1ccc(cc1)N2C(=O)CCC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H22 compound treatment 0.07 0.00219 0.14 0.074 0.00909 0.64 0.5488 0.8434 1158912 IFLab1_003696 COc1ccc(cc1)C2CC(=O)n3c(S2)nc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H23 mock treatment 0.068 1.88E-4 0.01 0.068 0.00309 0.22 0.1614 0.7454 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 H24 mock treatment 0.06 -0.00781 -0.5 0.065 9.38E-5 0.01 -0.3509 -0.6978 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I01 compound treatment 0.078 0.0102 0.66 0.069 0.00409 0.29 0.6659 0.9308 2067664 IFLab1_003697 CC(C)c1cc(C(C)C)c(S(=O)NCCCN2CCOCC2)c(c1)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I02 compound treatment 1.153 1.09 69.85 1.07 1.01 70.22 99.04 1.0 2067665 IFLab1_003698 CC(C)n1c2ccccc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I03 compound treatment 0.06 -0.00781 -0.5 0.056 -0.00891 -0.62 -0.7955 -0.9944 1218592 IFLab1_003699 COc1ccc2cc(ccc2c1)S(=O)(=O)N3CCN(Cc4ccccc4)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I04 compound treatment 0.038 -0.0298 -1.92 0.038 -0.0269 -1.88 -2.686 -0.9999 2067666 IFLab1_003700 Brc1cccc(c1)S(=O)(=O)C=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I05 compound treatment 0.082 0.0142 0.91 0.081 0.0161 1.12 1.4407 0.9947 1119800 IFLab1_003701 CCC(=O)Nc1c2CSCc2nn1c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I06 compound treatment 0.066 -0.00181 -0.12 0.063 -0.00191 -0.13 -0.1767 -0.9978 1216791 IFLab1_003702 C1CSC(N1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I07 compound treatment 0.298 0.23 14.82 0.277 0.212 14.82 20.9536 1.0 1129857 IFLab1_003703 COC(=O)c1sc(cc1NC(=O)C2CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I08 compound treatment 0.058 -0.00981 -0.63 0.058 -0.00691 -0.48 -0.7878 -0.9912 1217935 IFLab1_003704 Cc1nc(cs1)c2cccc(N)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I09 compound treatment 0.049 -0.0188 -1.21 0.049 -0.0159 -1.11 -1.642 -0.9991 2067667 IFLab1_003705 CCn1c(Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I10 compound treatment 0.453 0.385 24.79 0.487 0.422 29.49 38.3817 0.9963 1464364 IFLab1_003706 COC(=O)c1sc2ccccc2c1NC(=O)Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I11 compound treatment 0.055 -0.0128 -0.82 0.059 -0.00591 -0.41 -0.8749 -0.9488 1535035 IFLab1_003707 CC(C)N(C(=O)Cn1c(C)nc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I12 compound treatment 0.057 -0.0108 -0.7 0.058 -0.00691 -0.48 -0.8333 -0.984 1073760 IFLab1_003708 COc1ccc(NC2=NCCS2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I13 compound treatment 0.242 0.174 11.21 0.064 -9.06E-4 -0.06 7.883 0.7031 2067668 IFLab1_003709 Cc1nnc(SCC(=O)Nc2ccccc2)n1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I14 compound treatment 0.073 0.00519 0.33 0.059 -0.00591 -0.41 -0.0557 -0.1049 1344074 IFLab1_003710 CC(C)N(C(=O)Cn1c(=N)sc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I15 compound treatment 0.932 0.864 55.62 0.769 0.704 49.19 74.1128 0.9981 1379574 IFLab1_003711 CCOC(=O)CSc1nc2ccccc2c(=O)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I16 compound treatment 0.547 0.479 30.84 0.542 0.477 33.33 45.3769 0.9992 2067669 IFLab1_003712 Clc1ccccc1C(=O)Oc2cccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I17 compound treatment 0.07 0.00219 0.14 0.073 0.00809 0.57 0.4994 0.857 1735150 IFLab1_003713 N#CCc1ncc(CSc2nc3ccccc3[nH]2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I18 compound treatment 0.063 -0.00481 -0.31 0.06 -0.00491 -0.34 -0.4614 -0.9987 1013810 IFLab1_003714 O=C1OC2(CCCCC2)OC1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I19 compound treatment 0.13 0.0622 4.0 0.14 0.0751 5.25 6.5398 0.9911 1228915 IFLab1_003715 COc1cccc(OCC(=O)Nc2ccc(F)cc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I20 compound treatment 0.072 0.00419 0.27 0.068 0.00309 0.22 0.3434 0.994 1248295 IFLab1_003716 CN(C)S(=O)(=O)c1ccc2NC(=O)c3cccc1c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I21 compound treatment 0.061 -0.00681 -0.44 0.064 -9.06E-4 -0.06 -0.3548 -0.8009 1296632 IFLab1_003717 OC(=O)CNC(=O)COc1cccc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I22 compound treatment 0.062 -0.00581 -0.37 0.067 0.00209 0.15 -0.1611 -0.4011 2067670 IFLab1_003718 CN1CCN(CC1)c2cc(C)ncn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I23 mock treatment 0.071 0.00319 0.21 0.061 -0.00391 -0.27 -0.0479 -0.1403 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 I24 mock treatment 0.071 0.00319 0.21 0.065 9.38E-5 0.01 0.1497 0.7293 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J01 compound treatment 0.063 -0.00481 -0.31 0.065 9.38E-5 0.01 -0.2144 -0.692 1357445 IFLab1_003719 CC1(C)COC(=O)C1OC(=O)c2ccccc2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J02 compound treatment 0.08 0.0122 0.78 0.082 0.0171 1.19 1.3991 0.9792 2067671 IFLab1_003720 CC(=C)C(=O)Oc1ccc(cc1)N2Cc3ccccc3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J03 compound treatment 0.096 0.0282 1.81 0.091 0.0261 1.82 2.5719 1.0 1673475 IFLab1_003721 CCc1nc(c2ccccc2)c3ccccn13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J04 compound treatment 0.094 0.0262 1.69 0.08 0.0151 1.05 1.9375 0.9745 2067672 IFLab1_003722 CCc1nnc2SCC(=Nn12)c3ccc4OCCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J05 compound treatment 0.868 0.8 51.5 0.664 0.599 41.85 66.0131 0.9947 2067673 IFLab1_003723 COC(=O)c1sc2ccccc2c1NC(=O)c3cc(Cl)sc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J06 compound treatment 0.088 0.0202 1.3 0.086 0.0211 1.47 1.9608 0.998 2067674 IFLab1_003724 Fc1ccc(NC2=NC(=O)/C(=C\c3ccc4OCOc4c3)/S2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J07 compound treatment 0.068 1.88E-4 0.01 0.063 -0.00191 -0.13 -0.0856 -0.6404 1605554 IFLab1_003725 O=C(Nc1ccc2sccc2c1)c3cccc(c3)N4C(=O)CCC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J08 compound treatment 0.066 -0.00181 -0.12 0.068 0.00309 0.22 0.0703 0.2864 1647947 IFLab1_003726 COc1cccc2sc(=NC(=O)c3ccc(C#N)cc3)n(C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J09 compound treatment 0.061 -0.00681 -0.44 0.077 0.0121 0.84 0.2874 0.3019 2067675 IFLab1_003727 OC(=O)c1ccccc1SCC(=O)Nc2cccc(c2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J10 compound treatment 0.062 -0.00581 -0.37 0.071 0.00609 0.43 0.0365 0.0644 1316524 IFLab1_003728 COC(=O)c1ccc(cc1)C(=O)N=c2sc3cc(F)ccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J11 compound treatment 0.062 -0.00581 -0.37 0.06 -0.00491 -0.34 -0.5069 -0.999 2067676 IFLab1_003729 COc1ccc(NC(=O)CSC2=NCCN2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J12 compound treatment 0.185 0.117 7.54 0.19 0.125 8.74 11.513 0.9973 1447150 IFLab1_003730 COc1cc(C)c(cc1S(=O)(=O)N2CCCC(C)C2)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J13 compound treatment 0.224 0.156 10.05 0.244 0.179 12.51 15.9555 0.9941 2067677 IFLab1_003731 COc1ccc(/C=C/C(=O)Nc2sc3CCCCc3c2C(=O)N)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J14 compound treatment 0.058 -0.00981 -0.63 0.058 -0.00691 -0.48 -0.7878 -0.9912 1637379 IFLab1_003732 CCN1CCN(CC(O)COc2cccc(OC)c2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J15 compound treatment 0.072 0.00419 0.27 0.072 0.00709 0.5 0.541 0.959 2067678 IFLab1_003733 Cc1ccc(/C=C\2/SC(=S)N(C2=O)c3ccc(cc3)S(=O)(=O)N)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J16 compound treatment 0.072 0.00419 0.27 0.072 0.00709 0.5 0.541 0.959 1303213 IFLab1_003734 CN1CCN(CC(O)COc2ccc(cc2)C3CCCCC3)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J17 compound treatment 0.058 -0.00981 -0.63 0.055 -0.00991 -0.69 -0.9359 -0.999 1246133 IFLab1_003735 CCC(CO)Nc1nc(C)nc2sc3CCCc3c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J18 compound treatment 0.053 -0.0148 -0.95 0.053 -0.0119 -0.83 -1.2623 -0.9977 1283409 IFLab1_003736 CC1CCCCN1CC(O)COc2c(F)cc(Br)cc2F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J19 compound treatment 0.06 -0.00781 -0.5 0.062 -0.00291 -0.2 -0.4991 -0.9204 1562712 IFLab1_003737 O=C1C2C3CC(C=C3)C2C(=O)N1c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J20 compound treatment 0.068 1.88E-4 0.01 0.075 0.0101 0.71 0.5071 0.7191 2067679 IFLab1_003738 O=C/1Oc2ccccc2C(=O)\C1=C\NN3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J21 compound treatment 0.061 -0.00681 -0.44 0.057 -0.00791 -0.55 -0.7006 -0.9935 1327796 IFLab1_003739 OC(=O)CCCN1C(=O)C2C3CC(C=C3)C2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J22 compound treatment 0.064 -0.00381 -0.25 0.061 -0.00391 -0.27 -0.3665 -0.9986 1421681 IFLab1_003740 OC(=O)C1CCN(CC1)S(=O)(=O)c2cccc3cccnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J23 mock treatment 0.068 1.88E-4 0.01 0.063 -0.00191 -0.13 -0.0856 -0.6404 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 J24 mock treatment 0.075 0.00719 0.46 0.068 0.00309 0.22 0.48 0.9399 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K01 compound treatment 0.222 0.154 9.92 0.233 0.168 11.74 15.3211 0.9965 1597075 IFLab1_003741 Cc1ccc(c(C)c1)S(=O)(=O)n2cnc3cc(C)c(C)cc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K02 compound treatment 1.337 1.27 81.69 1.229 1.16 81.32 115.2687 1.0 2067680 IFLab1_003742 CCCn1c2ccccc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K03 compound treatment 0.045 -0.0228 -1.47 0.045 -0.0199 -1.39 -2.0216 -0.9996 2067681 IFLab1_003743 Clc1ccc2n(nnc2c1)C(=O)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K04 compound treatment 0.081 0.0132 0.85 0.082 0.0171 1.19 1.4446 0.986 1643138 IFLab1_003744 O=S1(=O)CCC(C1)NC(=S)SCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K05 compound treatment 0.093 0.0252 1.62 0.103 0.0381 2.66 3.0281 0.9718 1547490 IFLab1_003745 Cc1ccc(cc1)n2nc3CSCc3c2NC(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K06 compound treatment 0.164 0.0962 6.19 0.156 0.0911 6.36 8.8777 0.9999 1294431 IFLab1_003746 COc1ccc(cc1)C2SCCN2S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K07 compound treatment 0.075 0.00719 0.46 0.076 0.0111 0.78 0.8751 0.9696 1655407 IFLab1_003747 COC(=O)c1sc(cc1NC(=O)C2CCCCC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K08 compound treatment 0.881 0.813 52.34 0.819 0.754 52.68 74.2615 1.0 1583005 IFLab1_003748 COc1ccccc1C(=O)Nc2ccc(cc2)c3csc(C)n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K09 compound treatment 0.06 -0.00781 -0.5 0.053 -0.0119 -0.83 -0.9437 -0.9709 2067682 IFLab1_003749 CCCCn1c(nc2ccccc12)C(C)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K10 compound treatment 0.07 0.00219 0.14 0.072 0.00709 0.5 0.45 0.8734 1479098 IFLab1_003750 O=C(Nc1ncc(s1)c2ccccc2)c3cccc(c3)N4C(=O)CCC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K11 compound treatment 0.072 0.00419 0.27 0.07 0.00509 0.36 0.4422 0.9906 1157513 IFLab1_003751 CC(C)N(C(=O)Cn1c(CO)nc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K12 compound treatment 0.347 0.279 17.97 0.277 0.212 14.82 23.1837 0.9954 2067683 IFLab1_003752 CCOc1ccc(cc1)n2nnnc2SCC(=O)c3c(C)cc(C)cc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K13 compound treatment 0.071 0.00319 0.21 0.068 0.00309 0.22 0.2979 0.9997 1467007 IFLab1_003753 Cc1cc(=O)[nH]c(SCC(=O)Nc2ccccc2C)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K14 compound treatment 0.077 0.00919 0.59 0.066 0.00109 0.08 0.4722 0.7919 2067684 IFLab1_003754 COc1ccc(NC(=O)CSc2nnc(C)n2c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K15 compound treatment 0.076 0.00819 0.53 0.085 0.0201 1.4 1.3652 0.9105 1301130 IFLab1_003755 O=C(CSc1nc2ccccc2c(=O)n1c3ccccc3)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K16 compound treatment 0.074 0.00619 0.4 0.072 0.00709 0.5 0.632 0.9941 1621327 IFLab1_003756 OC(=O)CC(NS(=O)(=O)c1ccc(Br)cc1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K17 compound treatment 0.061 -0.00681 -0.44 0.059 -0.00591 -0.41 -0.6018 -0.9995 1550526 IFLab1_003757 O=C(N1CCCC1)c2ccc(cc2)S(=O)(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K18 compound treatment 0.079 0.0112 0.72 0.076 0.0111 0.78 1.0572 0.9993 1036303 IFLab1_003758 COc1ccc(NS(=O)(=O)c2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K19 compound treatment 0.482 0.414 26.66 0.434 0.369 25.78 37.0835 0.9999 1138357 IFLab1_003759 Cc1ccc(Oc2ccc(OCC(=O)NCC3CCCO3)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K20 compound treatment 0.074 0.00619 0.4 0.077 0.0121 0.84 0.879 0.9411 1260052 IFLab1_003760 CC1CCN(CC1)S(=O)(=O)c2ccc3NC(=O)c4cccc2c34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K21 compound treatment 0.259 0.191 12.31 0.306 0.241 16.84 20.6111 0.9881 1661854 IFLab1_003761 OCCSc1nc2sc3CCCCc3c2c(=O)n1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K22 compound treatment 0.063 -0.00481 -0.31 0.065 9.38E-5 0.01 -0.2144 -0.692 1442345 IFLab1_003762 CCn1c(SCc2nc3ccccc3[nH]2)nnc1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K23 mock treatment 0.068 1.88E-4 0.01 0.061 -0.00391 -0.27 -0.1844 -0.6752 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 K24 mock treatment 0.069 0.00119 0.08 0.069 0.00409 0.29 0.2563 0.8657 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L01 compound treatment 0.061 -0.00681 -0.44 0.062 -0.00291 -0.2 -0.4536 -0.9388 1421062 IFLab1_003763 CCN1CCN(Cc2oc(CO)cc(=O)c2O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L02 compound treatment 0.167 0.0992 6.38 0.176 0.111 7.76 10.0022 0.9953 1742285 IFLab1_003764 CC(=O)Oc1cccc(c1)N2Cc3ccccc3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L03 compound treatment 0.128 0.0602 3.87 0.127 0.0621 4.34 5.8066 0.9984 1590090 IFLab1_003765 COc1cccc2cc(c3nc4ccccc4s3)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L04 compound treatment 0.323 0.255 16.43 0.416 0.351 24.53 28.9578 0.981 2067685 IFLab1_003766 FC(F)(F)c1nnc2SCC(=Nn12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L05 compound treatment 0.07 0.00219 0.14 0.066 0.00109 0.08 0.1536 0.9588 1623297 IFLab1_003767 O=C(Nc1ccc2sccc2c1)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L06 compound treatment 0.075 0.00719 0.46 0.069 0.00409 0.29 0.5293 0.9733 2067686 IFLab1_003768 Oc1ccc(/C=C\2/SC(=NC2=O)Nc3cccnc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L07 compound treatment 0.077 0.00919 0.59 0.069 0.00409 0.29 0.6204 0.9444 2067687 IFLab1_003769 COC(=O)c1ccc(cc1)C(=O)Nc2ccc3sccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L08 compound treatment 0.059 -0.00881 -0.57 0.067 0.00209 0.15 -0.2977 -0.5081 1691783 IFLab1_003770 NC(=O)c1oc2ccccc2c1NC(=O)Cc3cccc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L09 compound treatment 0.074 0.00619 0.4 0.062 -0.00291 -0.2 0.138 0.3088 1429998 IFLab1_003771 Cc1ccc(cc1)C(=O)Nc2ccc(cc2)c3nnc4CCCCCn34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L10 compound treatment 0.049 -0.0188 -1.21 0.049 -0.0159 -1.11 -1.642 -0.9991 1920805 IFLab1_003772 CCOC(=O)CSc1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L11 compound treatment 0.058 -0.00981 -0.63 0.062 -0.00291 -0.2 -0.5902 -0.8896 1481544 IFLab1_003773 Brc1ccc(OCc2nnc3CCCCCn23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L12 compound treatment 0.059 -0.00881 -0.57 0.065 9.38E-5 0.01 -0.3965 -0.6989 1230624 IFLab1_003774 CC1CN(CCN1C(=O)c2cccs2)C(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L13 compound treatment 0.718 0.65 41.85 0.758 0.693 48.42 63.8296 0.9974 2067688 IFLab1_003775 Cc1noc(C)c1CSc2ncnc3sc4CCCCc4c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L14 compound treatment 0.061 -0.00681 -0.44 0.064 -9.06E-4 -0.06 -0.3548 -0.8009 1568403 IFLab1_003776 COc1cccc(OCC(O)CN2CCN(CC2)c3ccc(F)cc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L15 compound treatment 0.06 -0.00781 -0.5 0.065 9.38E-5 0.01 -0.3509 -0.6978 2067689 IFLab1_003777 NS(=O)(=O)c1ccc(cc1)N2C(=O)/C(=C\C=C\c3ccccc3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L16 compound treatment 0.074 0.00619 0.4 0.072 0.00709 0.5 0.632 0.9941 1585215 IFLab1_003778 CCN1CCN(CC(O)COc2ccc(cc2)C3CCCCC3)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L17 compound treatment 0.153 0.0852 5.48 0.1 0.0351 2.45 5.6107 0.9341 2067690 IFLab1_003779 Cc1sc2ncnc(Sc3ccccc3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L18 compound treatment 0.05 -0.0178 -1.15 0.054 -0.0109 -0.76 -1.3494 -0.9803 1457194 IFLab1_003780 CC1CCCCN1CC(O)COc2cc(C)c(Cl)c(C)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L19 compound treatment 0.061 -0.00681 -0.44 0.066 0.00109 0.08 -0.256 -0.5752 1396726 IFLab1_003781 CC(C)CC(N1C(=O)C2C3CC(C=C3)C2C1=O)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L20 compound treatment 0.054 -0.0138 -0.89 0.06 -0.00491 -0.34 -0.871 -0.9141 2067691 IFLab1_003782 COc1ccc(N/C=C/2\C(=O)OC(=CC2=O)C)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L21 compound treatment 0.062 -0.00581 -0.37 0.07 0.00509 0.36 -0.0129 -0.025 1156241 IFLab1_003783 CC(N1C(=O)C2C3CC(C=C3)C2C1=O)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L22 compound treatment 0.062 -0.00581 -0.37 0.063 -0.00191 -0.13 -0.3587 -0.9033 1271483 IFLab1_003784 Fc1ccc(cc1)N2CCN(CC2)S(=O)(=O)c3ccc4ccccc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L23 mock treatment 0.074 0.00619 0.4 0.067 0.00209 0.15 0.385 0.9075 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 L24 mock treatment 0.063 -0.00481 -0.31 0.064 -9.06E-4 -0.06 -0.2638 -0.8344 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M01 compound treatment 0.068 1.88E-4 0.01 0.074 0.00909 0.64 0.4578 0.7204 1722879 IFLab1_003785 O=C(NCc1ccc2OCOc2c1)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M02 compound treatment 1.002 0.934 60.13 0.946 0.881 61.55 86.0422 0.9999 2067692 IFLab1_003786 CC(C)Cn1c2ccccc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M03 compound treatment 0.116 0.0482 3.1 0.106 0.0411 2.87 4.2231 0.9993 1334268 IFLab1_003787 COc1ccc(OC)c(c1)S(=O)(=O)N2C(C)CCCC2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M04 compound treatment 0.066 -0.00181 -0.12 0.063 -0.00191 -0.13 -0.1767 -0.9978 1337692 IFLab1_003788 O=C(NC1CS(=O)(=O)C=C1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M05 compound treatment 0.163 0.0952 6.13 0.141 0.0761 5.32 8.0912 0.9975 1555709 IFLab1_003789 Cc1cc(C)cc(c1)n2nc3CSCc3c2NC(=O)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M06 compound treatment 0.057 -0.0108 -0.7 0.058 -0.00691 -0.48 -0.8333 -0.984 1577333 IFLab1_003790 OCCNC(=O)c1cc2cc(Br)ccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M07 compound treatment 0.1 0.0322 2.07 0.085 0.0201 1.4 2.4575 0.982 1552568 IFLab1_003791 O=C(Cc1ccccc1)Nc2nc(cs2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M08 compound treatment 0.451 0.383 24.66 0.417 0.352 24.6 34.8328 1.0 1670918 IFLab1_003792 Cc1nc(sc1C(=O)Nc2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M09 compound treatment 0.06 -0.00781 -0.5 0.055 -0.00991 -0.69 -0.8449 -0.9877 1030469 IFLab1_003793 CC(O)c1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M10 compound treatment 0.066 -0.00181 -0.12 0.054 -0.0109 -0.76 -0.6212 -0.806 1299003 IFLab1_003794 CCC(=O)Nc1cccc(c1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M11 compound treatment 0.07 0.00219 0.14 0.063 -0.00191 -0.13 0.0054 0.0278 1699317 IFLab1_003795 CC(C)N(C(=O)Cn1c(nc2ccccc12)C(C)O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M12 compound treatment 0.049 -0.0188 -1.21 0.051 -0.0139 -0.97 -1.5432 -0.994 1504395 IFLab1_003796 CC(C)N(C(=O)CSc1nc2ccccc2[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M13 compound treatment 0.321 0.253 16.3 0.331 0.266 18.59 24.6679 0.9978 2067693 IFLab1_003797 CCOc1ccc(cc1)C(=O)CSc2nnc(CC)n2N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M14 compound treatment 0.071 0.00319 0.21 0.059 -0.00591 -0.41 -0.1467 -0.3183 2067694 IFLab1_003798 c1csc(c1)c2cn3ccsc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M15 compound treatment 0.085 0.0172 1.11 0.083 0.0181 1.26 1.6761 0.9978 1406732 IFLab1_003799 OC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M16 compound treatment 0.103 0.0352 2.26 0.103 0.0381 2.66 3.4833 0.9968 1032066 IFLab1_003800 Cc1ccccc1NS(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M17 compound treatment 0.059 -0.00881 -0.57 0.057 -0.00791 -0.55 -0.7916 -0.9999 2067695 IFLab1_003801 Cc1ccc(cc1)C(=O)CSc2nnnn2c3cccc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M18 compound treatment 0.088 0.0202 1.3 0.084 0.0191 1.33 1.862 0.9999 1463364 IFLab1_003802 CCOc1ccc(cc1)S(=O)(=O)N2CCC(C)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M19 compound treatment 0.13 0.0622 4.0 0.135 0.0701 4.9 6.2928 0.995 1369379 IFLab1_003803 CC1CCCC(C)N1C(=O)COc2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M20 compound treatment 0.12 0.0522 3.36 0.12 0.0551 3.85 5.0967 0.9977 1641505 IFLab1_003804 CCOc1ccc(cc1)S(=O)(=O)Nc2cc(Cl)c(O)c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M21 compound treatment 0.261 0.193 12.43 0.196 0.131 9.16 15.2683 0.9887 2067696 IFLab1_003805 CN(C)c1nc(c2ccccc2)c3cc(Cl)ccc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M22 compound treatment 0.059 -0.00881 -0.57 0.056 -0.00891 -0.62 -0.841 -0.9989 2067697 IFLab1_003806 COC(=O)CN1CCN(CC1)S(=O)(=O)c2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M23 mock treatment 0.063 -0.00481 -0.31 0.064 -9.06E-4 -0.06 -0.2638 -0.8344 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 M24 mock treatment 0.069 0.00119 0.08 0.067 0.00209 0.15 0.1575 0.9542 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N01 compound treatment 0.06 -0.00781 -0.5 0.062 -0.00291 -0.2 -0.4991 -0.9204 1262773 IFLab1_003807 OC(c1ccc2OCOc2c1)c3nccc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N02 compound treatment 0.061 -0.00681 -0.44 0.054 -0.0109 -0.76 -0.8488 -0.9656 2067698 IFLab1_003808 COC(=O)c1ccc(NC(=O)CSC2=NCCN2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N03 compound treatment 0.061 -0.00681 -0.44 0.067 0.00209 0.15 -0.2066 -0.447 1162882 IFLab1_003809 Cc1[nH]c2ccccc2c1C(N3CCOCC3)c4ccncc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N04 compound treatment 0.062 -0.00581 -0.37 0.061 -0.00391 -0.27 -0.4575 -0.988 1283766 IFLab1_003810 Cc1n[nH]c(O)c1C2=NCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N05 compound treatment 0.05 -0.0178 -1.15 0.051 -0.0139 -0.97 -1.4976 -0.9966 2067699 IFLab1_003811 O=C(Nc1ccc2sccc2c1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N06 compound treatment 0.064 -0.00381 -0.25 0.067 0.00209 0.15 -0.0701 -0.2453 2067700 IFLab1_003812 COC(=O)c1ccc(/C=C\2/SC(=NC2=O)Nc3cccnc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N07 compound treatment 0.426 0.358 23.05 0.328 0.263 18.38 29.2986 0.9937 1237264 IFLab1_003813 CSc1nc2ccc3nc(N)sc3c2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N08 compound treatment 0.089 0.0212 1.36 0.078 0.0131 0.91 1.6111 0.9811 1137905 IFLab1_003814 Cc1ccc2n(C)c(=NC(=O)Cc3cccc4ccccc34)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N09 compound treatment 0.067 -8.12E-4 -0.05 0.064 -9.06E-4 -0.06 -0.0817 -0.9955 1632673 IFLab1_003815 CC(=O)Nc1ccc(cc1)c2nnc3CCCCCn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N10 compound treatment 0.065 -0.00281 -0.18 0.071 0.00609 0.43 0.173 0.374 2067701 IFLab1_003816 Cc1ccc(N/C=C(\C#N)/c2nc(cs2)c3cc4ccccc4oc3=O)cc1F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N11 compound treatment 0.06 -0.00781 -0.5 0.055 -0.00991 -0.69 -0.8449 -0.9877 1475279 IFLab1_003817 CCc1ccc(cc1)C(=O)CSc2ccccc2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N12 compound treatment 0.075 0.00719 0.46 0.07 0.00509 0.36 0.5787 0.9916 1242387 IFLab1_003818 Cc1cccc(c1)C(=O)N2CCCN(CC2)C(=O)c3cccc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N13 compound treatment 0.059 -0.00881 -0.57 0.059 -0.00591 -0.41 -0.6928 -0.9878 2067702 IFLab1_003819 Cc1sc2ncnc(Sc3nnnn3c4ccccc4)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N14 compound treatment 0.065 -0.00281 -0.18 0.057 -0.00791 -0.55 -0.5186 -0.8922 1370244 IFLab1_003820 COc1cccc(OCC(O)CN2CCc3ccccc3C2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N15 compound treatment 0.077 0.00919 0.59 0.074 0.00909 0.64 0.8674 0.9994 2067703 IFLab1_003821 OC(=O)COc1ccccc1/C=C\2/SC(=S)N(C2=O)c3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N16 compound treatment 0.059 -0.00881 -0.57 0.063 -0.00191 -0.13 -0.4952 -0.85 1541183 IFLab1_003822 CC1CN(CC(O)COc2ccc(cc2)C3CCCCC3)CC(C)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N17 compound treatment 0.057 -0.0108 -0.7 0.056 -0.00891 -0.62 -0.9321 -0.9984 1214816 IFLab1_003823 NC(=O)CCS(=O)(=O)CCN1CCCCC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N18 compound treatment 0.062 -0.00581 -0.37 0.065 9.38E-5 0.01 -0.2599 -0.6946 1663477 IFLab1_003824 Oc1ccccc1C(Nc2nccs2)c3ccc4cccnc4c3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N19 compound treatment 0.069 0.00119 0.08 0.061 -0.00391 -0.27 -0.1389 -0.4902 2067704 IFLab1_003825 O=C1C2C3CC(C=C3)C2C(=O)N1c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N20 compound treatment 0.077 0.00919 0.59 0.08 0.0151 1.05 1.1638 0.9626 2067705 IFLab1_003826 Clc1ccc(SCc2cn3cccnc3n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N21 compound treatment 0.062 -0.00581 -0.37 0.062 -0.00291 -0.2 -0.4081 -0.9588 1043174 IFLab1_003827 O=C1C2C3CC(C=C3)C2C(=O)N1c4nccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N22 compound treatment 0.071 0.00319 0.21 0.063 -0.00191 -0.13 0.0509 0.2081 2067706 IFLab1_003828 CC1CCN(CC1)S(=O)(=O)c2ccc(/C=C/C(=O)O)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N23 mock treatment 0.076 0.00819 0.53 0.069 0.00409 0.29 0.5749 0.9588 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 N24 mock treatment 0.065 -0.00281 -0.18 0.061 -0.00391 -0.27 -0.321 -0.9801 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O01 compound treatment 0.098 0.0302 1.94 0.083 0.0181 1.26 2.2677 0.9783 1377919 IFLab1_003829 COc1ccc(Cl)cc1S(=O)(=O)N2CCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O02 compound treatment 0.084 0.0162 1.04 0.084 0.0191 1.33 1.6799 0.9925 2899 IFLab1_003830 COc1ccc(cc1)c2noc(CC(=O)O)c2c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O03 compound treatment 0.075 0.00719 0.46 0.073 0.00809 0.57 0.7269 0.995 1434813 IFLab1_003831 CC1CN(CCN1S(=O)(=O)c2ccc(Cl)cc2)S(=O)(=O)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O04 compound treatment 0.071 0.00319 0.21 0.07 0.00509 0.36 0.3967 0.9658 1487527 IFLab1_003832 Cc1ccc(Nc2nnc(s2)c3cc4cc(Cl)ccc4oc3=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O05 compound treatment 0.066 -0.00181 -0.12 0.062 -0.00291 -0.2 -0.2261 -0.9654 1266519 IFLab1_003833 CC(=O)Nc1ccncc1NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O06 compound treatment 0.088 0.0202 1.3 0.089 0.0241 1.68 2.109 0.9918 1565108 IFLab1_003834 COc1ccccc1C2SCCN2S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O07 compound treatment 0.082 0.0142 0.91 0.07 0.00509 0.36 0.8973 0.9156 1321850 IFLab1_003835 CCc1cccc(CC)c1N(COC)C(=O)Cn2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O08 compound treatment 0.049 -0.0188 -1.21 0.045 -0.0199 -1.39 -1.8395 -0.9976 2067707 IFLab1_003836 Cc1nc(cs1)c2cccc(NC(=O)/C=C\C(=O)O)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O09 compound treatment 0.06 -0.00781 -0.5 0.061 -0.00391 -0.27 -0.5485 -0.9588 1033879 IFLab1_003837 C(Oc1ccccc1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O10 compound treatment 0.147 0.0792 5.1 0.084 0.0191 1.33 4.5473 0.8631 1381079 IFLab1_003838 CCC(=O)Nc1sc2CCCCCc2c1C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O11 compound treatment 0.064 -0.00381 -0.25 0.06 -0.00491 -0.34 -0.4159 -0.9866 1281502 IFLab1_003839 CC(C)C(=O)Nc1ccc(cc1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O12 compound treatment 0.058 -0.00981 -0.63 0.054 -0.0109 -0.76 -0.9853 -0.9957 2067708 IFLab1_003840 C1CN=C(C1)NC2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O13 compound treatment 0.062 -0.00581 -0.37 0.06 -0.00491 -0.34 -0.5069 -0.999 1232395 IFLab1_003841 C=CCn1nnnc1SCC(=O)Nc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O14 compound treatment 0.071 0.00319 0.21 0.07 0.00509 0.36 0.3967 0.9658 1684284 IFLab1_003842 OC(=O)CN1C(=O)c2cccc3cccc1c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O15 compound treatment 0.078 0.0102 0.66 0.069 0.00409 0.29 0.6659 0.9308 2067709 IFLab1_003843 CN(C1=CC(=O)c2ccccc2C1=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O16 compound treatment 0.091 0.0232 1.49 0.076 0.0111 0.78 1.6033 0.9534 1232143 IFLab1_003844 Cc1ccc(C)c(c1)S(=O)(=O)Nc2ccc(O)c(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O17 compound treatment 0.058 -0.00981 -0.63 0.057 -0.00791 -0.55 -0.8372 -0.9978 1556147 IFLab1_003845 CCc1ccc(cc1)c2csc(N)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O18 compound treatment 0.089 0.0212 1.36 0.074 0.00909 0.64 1.4135 0.9396 2067710 IFLab1_003846 CCOc1ccc(cc1)S(=O)(=O)NC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O19 compound treatment 0.062 -0.00581 -0.37 0.061 -0.00391 -0.27 -0.4575 -0.988 1143616 IFLab1_003847 CN(C1CCS(=O)(=O)C1)C(=O)COc2cccc(Br)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O20 compound treatment 0.065 -0.00281 -0.18 0.062 -0.00291 -0.2 -0.2716 -0.9984 1687160 IFLab1_003848 NS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O21 compound treatment 0.067 -8.12E-4 -0.05 0.075 0.0101 0.71 0.4616 0.6529 1208892 IFLab1_003849 CCC(Sc1ccc(Cl)cc1)C(=O)Nc2nnc(s2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O22 compound treatment 0.075 0.00719 0.46 0.072 0.00709 0.5 0.6775 0.9994 2067711 IFLab1_003850 COC(=O)CSc1nnc(SCc2ccc(Cl)cc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O23 mock treatment 0.062 -0.00581 -0.37 0.069 0.00409 0.29 -0.0623 -0.1323 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 O24 mock treatment 0.068 1.88E-4 0.01 0.059 -0.00591 -0.41 -0.2832 -0.6861 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P01 compound treatment 0.164 0.0962 6.19 0.161 0.0961 6.71 9.1246 0.9992 1460909 IFLab1_003851 OCCN1CCN(CC1)C(c2ccccc2)c3ccc4cccnc4c3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P02 compound treatment 0.065 -0.00281 -0.18 0.063 -0.00191 -0.13 -0.2222 -0.9886 2067712 IFLab1_003852 Cc1ccc(NC(=O)CSC2=NCCN2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P03 compound treatment 0.078 0.0102 0.66 0.074 0.00909 0.64 0.9129 0.9999 1584511 IFLab1_003853 Cc1ccc(o1)c2csc(NC(=O)c3nc4ccccc4s3)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P04 compound treatment 0.067 -8.12E-4 -0.05 0.065 9.38E-5 0.01 -0.0323 -0.6138 2067713 IFLab1_003854 Cc1n[nH]c(O)c1C2=NCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P05 compound treatment 0.081 0.0132 0.85 0.089 0.0241 1.68 1.7904 0.9498 2067714 IFLab1_003855 O=C(Nc1ccc2sccc2c1)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P06 compound treatment 0.065 -0.00281 -0.18 0.067 0.00209 0.15 -0.0246 -0.1056 2067715 IFLab1_003856 O=C/1N=C(Nc2cccnc2)S\C1=C\c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P07 compound treatment 0.092 0.0242 1.56 0.082 0.0171 1.19 1.9452 0.9914 1685961 IFLab1_003857 CCC(=O)Nc1nc2ccc3nc(SC)sc3c2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P08 compound treatment 0.073 0.00519 0.33 0.087 0.0221 1.54 1.3275 0.8406 1504525 IFLab1_003858 NC(=O)c1oc2ccccc2c1NC(=O)C(c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P09 compound treatment 0.066 -0.00181 -0.12 0.067 0.00209 0.15 0.0209 0.1119 2067716 IFLab1_003859 CCCc1nnc(SCC(=O)O)n1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P10 compound treatment 0.066 -0.00181 -0.12 0.07 0.00509 0.36 0.1691 0.4516 2067717 IFLab1_003860 NC(=O)c1ccc(N/C=C(\C#N)/c2nc(cs2)c3cccc(Br)c3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P11 compound treatment 0.086 0.0182 1.17 0.083 0.0181 1.26 1.7216 0.9993 1312456 IFLab1_003861 COC(=O)c1ccc(NCC(=O)c2ccc(OC)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P12 compound treatment 0.047 -0.0208 -1.34 0.046 -0.0189 -1.32 -1.8812 -1.0 1298903 IFLab1_003862 Cc1ccc2nc(NC(=O)c3ccco3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P13 compound treatment 0.052 -0.0158 -1.02 0.05 -0.0149 -1.04 -1.456 -0.9999 1591687 IFLab1_003863 CC1CCc2c(C(=O)O)c(NC(=O)c3cccs3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P14 compound treatment 0.053 -0.0148 -0.95 0.052 -0.0129 -0.9 -1.3117 -0.9996 1199813 IFLab1_003864 COc1cccc(OCC(O)CNC(C)c2ccccc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P15 compound treatment 0.147 0.0792 5.1 0.118 0.0531 3.71 6.2268 0.9878 2067718 IFLab1_003865 OC(=O)COc1ccccc1/C=C\2/SC(=S)N(Cc3ccco3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P16 compound treatment 0.06 -0.00781 -0.5 0.06 -0.00491 -0.34 -0.5979 -0.9825 1241600 IFLab1_003866 OC(COc1ccc(cc1)C2CCCCC2)CN3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P17 compound treatment 0.051 -0.0168 -1.08 0.051 -0.0139 -0.97 -1.4521 -0.9986 2067719 IFLab1_003867 Cc1ccc(cc1)N(Sc2ccc(Cl)cc2)C3CS(=O)(=O)C=C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P18 compound treatment 0.052 -0.0158 -1.02 0.049 -0.0159 -1.11 -1.5054 -0.999 1368925 IFLab1_003868 Oc1c(ccc2cccnc12)C(Nc3nccs3)c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P19 compound treatment 0.063 -0.00481 -0.31 0.058 -0.00691 -0.48 -0.5602 -0.9771 1589801 IFLab1_003869 CCOc1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P20 compound treatment 0.236 0.168 10.83 0.18 0.115 8.04 13.3401 0.9893 1522937 IFLab1_003870 O=C1CC(Sc2nc3ccccc3n12)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P21 compound treatment 0.054 -0.0138 -0.89 0.058 -0.00691 -0.48 -0.9698 -0.9588 2067720 IFLab1_003871 CC(=C)C(=O)Oc1cccc(c1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P22 compound treatment 0.075 0.00719 0.46 0.071 0.00609 0.43 0.6281 0.9991 1429354 IFLab1_003872 COc1ccc(cc1C(=O)O)S(=O)(=O)N2CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P23 mock treatment 0.077 0.00919 0.59 0.064 -9.06E-4 -0.06 0.3734 0.6278 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1422 P24 mock treatment 0.066 -0.00181 -0.12 0.064 -9.06E-4 -0.06 -0.1273 -0.9588 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A01 compound treatment 0.076 0.0175 1.13 0.081 0.0204 1.42 1.8037 0.9933 2067721 IFLab1_003873 O=S(=O)(/C=C/c1ccccc1)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A02 compound treatment 0.064 0.00552 0.36 0.071 0.0104 0.72 0.7636 0.9461 1694079 IFLab1_003874 OC(CC(=O)O)c1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A03 compound treatment 0.411 0.353 22.69 0.487 0.426 29.79 37.1063 0.991 2067722 IFLab1_003875 CCOC(=O)c1oc2ccccc2c1NC(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A04 compound treatment 0.063 0.00452 0.29 0.063 0.00237 0.17 0.3229 0.9646 2067723 IFLab1_003876 CC(C)c1nc2ccccc2n1Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A05 compound treatment 0.06 0.00152 0.1 0.066 0.00537 0.38 0.3345 0.8622 2067724 IFLab1_003877 Cc1ccc2cc(/N=C/c3ccc(O)cc3)ccc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A06 compound treatment 0.066 0.00752 0.48 0.068 0.00738 0.52 0.7064 0.9995 1310560 IFLab1_003878 COc1ccc(cc1OC)c2nc3ccccc3n2C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A07 compound treatment 0.058 -4.84E-4 -0.03 0.061 3.75E-4 0.03 -0.0035 -0.086 1559622 IFLab1_003879 CC1(C)C2(C)CCC1(CC2=O)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A08 compound treatment 0.066 0.00752 0.48 0.072 0.0114 0.79 0.904 0.9717 1249669 IFLab1_003880 CCN(CC)Cc1cc(C(C)C)c(O)c(c1)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A09 compound treatment 0.064 0.00552 0.36 0.062 0.00137 0.1 0.319 0.8672 1210566 IFLab1_003881 CC1(C)C2CCC1(C)C(C2)NC(=O)CCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A10 compound treatment 0.039 -0.0195 -1.25 0.039 -0.0216 -1.51 -1.955 -0.9957 2067725 IFLab1_003882 CC(=O)Nc1ccc(/N=C/c2ccc(OC(=O)c3ccccc3Br)cc2O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A11 compound treatment 0.06 0.00152 0.1 0.065 0.00438 0.31 0.2851 0.8887 2067726 IFLab1_003883 NC(=O)/C(=N\O)/c1nc(cs1)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A12 compound treatment 0.094 0.0355 2.29 0.106 0.0454 3.17 3.8579 0.9871 2067727 IFLab1_003884 COc1ccc(cc1)n2ccsc2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A13 compound treatment 0.079 0.0205 1.32 0.079 0.0184 1.28 1.8414 0.9999 2067728 IFLab1_003885 COc1ccc2nc(sc2c1)/C(=N/O)/C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A14 compound treatment 0.071 0.0125 0.81 0.073 0.0124 0.86 1.181 0.9994 1451497 IFLab1_003886 CC(=O)Nc1ccc(cc1)n2c(C)csc2=NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A15 compound treatment 0.048 -0.0105 -0.67 0.051 -0.00962 -0.67 -0.9526 -1.0 2067729 IFLab1_003887 COc1ccc2cc(Br)ccc2c1CCl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A16 compound treatment 0.059 5.16E-4 0.03 0.061 3.75E-4 0.03 0.042 0.9931 2067730 IFLab1_003888 Cc1sc(N2C(=O)C3C4CC(C=C4)C3C2=O)c(C#N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A17 compound treatment 0.074 0.0155 1.0 0.066 0.00537 0.38 0.9717 0.9107 1009444 IFLab1_003889 CCn1c2ccccc2c3cc(N)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A18 compound treatment 0.081 0.0225 1.45 0.083 0.0224 1.56 2.1301 0.9993 2067731 IFLab1_003890 CC1(C)COC(=O)C1OC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A19 compound treatment 0.054 -0.00448 -0.29 0.064 0.00338 0.24 -0.0374 -0.1002 1774948 IFLab1_003891 NC(=O)c1cc(Cl)c([nH]c1=O)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A20 compound treatment 0.058 -4.84E-4 -0.03 0.061 3.75E-4 0.03 -0.0035 -0.086 2067732 IFLab1_003892 Cc1ccc(cc1)C(=O)CC(c2ccco2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A21 compound treatment 0.052 -0.00648 -0.42 0.056 -0.00462 -0.32 -0.5236 -0.992 2067733 IFLab1_003893 C(c1ccccc1)n2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A22 compound treatment 0.056 -0.00248 -0.16 0.064 0.00338 0.24 0.0537 0.1884 2067734 IFLab1_003894 O=c1[nH]c(nc2ccccc12)c3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A23 mock treatment 0.061 0.00252 0.16 0.069 0.00838 0.59 0.5282 0.8701 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 A24 mock treatment 0.066 0.00752 0.48 0.068 0.00738 0.52 0.7064 0.9995 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B01 compound treatment 0.081 0.0225 1.45 0.081 0.0204 1.42 2.0313 1.0 2067735 IFLab1_003895 COc1ccccc1Oc2ncnc3scc(c4ccc(F)cc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B02 compound treatment 0.064 0.00552 0.36 0.069 0.00838 0.59 0.6648 0.9713 1464339 IFLab1_003896 Cc1sc2nc(SCC(=O)NC3CCCCC3)nc(N)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B03 compound treatment 0.07 0.0115 0.74 0.068 0.00738 0.52 0.8884 0.9842 1493334 IFLab1_003897 CC1CN(CCC(=O)Nc2sc3CCCc3c2C#N)CC(C)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B04 compound treatment 0.052 -0.00648 -0.42 0.059 -0.00162 -0.11 -0.3754 -0.8679 1584044 IFLab1_003898 Cc1ccc(o1)c2csc(NC(=O)c3coc4ccccc4c3=O)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B05 compound treatment 0.078 0.0195 1.26 0.075 0.0144 1.0 1.5983 0.9938 1391072 IFLab1_003899 COC(=O)c1ccc(OCc2c(C)noc2C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B06 compound treatment 0.039 -0.0195 -1.25 0.039 -0.0216 -1.51 -1.955 -0.9957 2067736 IFLab1_003900 O=C(OCc1nc2ccccc2s1)c3coc4ccccc4c3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B07 compound treatment 0.073 0.0145 0.93 0.075 0.0144 1.0 1.3708 0.9994 1327211 IFLab1_003901 Fc1ccc2nc(NC(=O)CCc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B08 compound treatment 0.067 0.00852 0.55 0.067 0.00638 0.45 0.7025 0.9947 1687858 IFLab1_003902 COc1ccc(cc1C(=O)O)S(=O)(=O)N2CCc3ccccc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B09 compound treatment 0.074 0.0155 1.0 0.062 0.00137 0.1 0.7741 0.7716 1645978 IFLab1_003903 CCC(=O)Nc1nc(cs1)c2ccc3OCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B10 compound treatment 0.069 0.0105 0.68 0.07 0.00938 0.65 0.9417 0.9999 1246329 IFLab1_003904 COc1ccc(cc1C(=O)O)S(=O)(=O)N2CCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B11 compound treatment 0.056 -0.00248 -0.16 0.067 0.00638 0.45 0.2019 0.4266 2067737 IFLab1_003905 FC(F)(F)c1ccc(nc1)N2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B12 compound treatment 0.052 -0.00648 -0.42 0.055 -0.00562 -0.39 -0.573 -0.9995 1702041 IFLab1_003906 CC(=C)CSC1=C(C#N)C2(CCCCC2)C(C#N)C(=O)N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B13 compound treatment 0.069 0.0105 0.68 0.069 0.00838 0.59 0.8923 0.9974 1416302 IFLab1_003907 O=C1CCCc2c1cc(c3ccccc3)n2c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B14 compound treatment 0.053 -0.00548 -0.35 0.059 -0.00162 -0.11 -0.3299 -0.8896 2067738 IFLab1_003908 CC(C)CC1C(=C(N)OC2=C1C(=O)CCC2)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B15 compound treatment 0.075 0.0165 1.06 0.078 0.0174 1.21 1.61 0.9978 1565528 IFLab1_003909 Oc1c(CN2CCCC2)cc(Cl)c3cccnc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B16 compound treatment 0.057 -0.00148 -0.1 0.063 0.00237 0.17 0.0498 0.2601 2067739 IFLab1_003910 Cc1cc(C)c(C#N)c(SCC(=O)Nc2nccs2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B17 compound treatment 0.061 0.00252 0.16 0.058 -0.00263 -0.18 -0.0152 -0.0619 1411855 IFLab1_003911 OC(COc1ccc(F)cc1)CN2CCN(CC2)c3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B18 compound treatment 0.154 0.0955 6.15 0.134 0.0734 5.13 7.9718 0.9959 2067740 IFLab1_003912 CCOC(=O)Cc1nc(cs1)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B19 compound treatment 0.068 0.00952 0.61 0.067 0.00638 0.45 0.748 0.9877 1234418 IFLab1_003913 CC(C)(C)c1ccccc1OCC(O)CN2CCN(CC2)c3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B20 compound treatment 0.057 -0.00148 -0.1 0.059 -0.00162 -0.11 -0.1478 -0.9963 1017621 IFLab1_003914 N#CC(CCN1CCOCC1)(c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B21 compound treatment 0.058 -4.84E-4 -0.03 0.061 3.75E-4 0.03 -0.0035 -0.086 1985493 IFLab1_003915 CCOC(=O)CSc1nc(N)c2c3CCCCc3sc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B22 compound treatment 0.053 -0.00548 -0.35 0.057 -0.00363 -0.25 -0.4287 -0.9867 1638899 IFLab1_003916 N#CC(N1CCOCC1)c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B23 mock treatment 0.06 0.00152 0.1 0.073 0.0124 0.86 0.6803 0.782 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 B24 mock treatment 0.059 5.16E-4 0.03 0.062 0.00137 0.1 0.0914 0.8994 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C01 compound treatment 0.062 0.00352 0.23 0.06 -6.25E-4 -0.04 0.1292 0.5604 2067741 IFLab1_003917 O=S(=O)(/C=C/c1ccccc1)N2CCc3ccccc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C02 compound treatment 0.064 0.00552 0.36 0.066 0.00537 0.38 0.5166 0.9996 1197757 IFLab1_003918 OC(C(O)c1nc2ccccc2[nH]1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C03 compound treatment 0.079 0.0205 1.32 0.093 0.0324 2.26 2.533 0.9672 1475911 IFLab1_003919 O=C(Nc1ccccc1c2nc3ccccc3o2)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C04 compound treatment 0.055 -0.00348 -0.22 0.061 3.75E-4 0.03 -0.14 -0.6203 2067742 IFLab1_003920 CCCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C05 compound treatment 0.063 0.00452 0.29 0.06 -6.25E-4 -0.04 0.1747 0.5942 2067743 IFLab1_003921 CCOC(=O)c1ccc(/N=C/c2ccc(OC(=O)c3ccco3)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C06 compound treatment 0.069 0.0105 0.68 0.07 0.00938 0.65 0.9417 0.9999 1064752 IFLab1_003922 Brc1cccc(c1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C07 compound treatment 0.06 0.00152 0.1 0.065 0.00438 0.31 0.2851 0.8887 2067744 IFLab1_003923 CN(C)C(=O)C1(CCC2(C)C(=O)C1)C2(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C08 compound treatment 0.058 -4.84E-4 -0.03 0.064 0.00338 0.24 0.1447 0.6084 1126912 IFLab1_003924 Cc1ccccc1NC(=O)Cn2nnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C09 compound treatment 0.058 -4.84E-4 -0.03 0.063 0.00237 0.17 0.0953 0.5645 1549344 IFLab1_003925 CC12COC3(CN)CC2CCC13C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C10 compound treatment 0.078 0.0195 1.26 0.079 0.0184 1.28 1.7959 0.9999 1736585 IFLab1_003926 NC(=O)CCSc1nnc(SCC(=O)c2ccccc2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C11 compound treatment 0.125 0.0665 4.28 0.075 0.0144 1.0 3.7374 0.8499 2067745 IFLab1_003927 O/N=C(\C#N)/c1nc(cs1)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C12 compound treatment 0.106 0.0475 3.06 0.099 0.0384 2.68 4.0583 0.9978 1533408 IFLab1_003928 CCOC(=O)c1sc(=S)n(c1C)c2ccc(OC)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C13 compound treatment 0.835 0.777 49.98 0.696 0.635 44.39 66.728 0.9982 2067746 IFLab1_003929 CNc1ccc2ccccc2c1SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C14 compound treatment 0.055 -0.00348 -0.22 0.05 -0.0106 -0.74 -0.6834 -0.8814 1580665 IFLab1_003930 COc1ccccc1N=c2[nH]c(C)cs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C15 compound treatment 0.055 -0.00348 -0.22 0.055 -0.00562 -0.39 -0.4364 -0.9646 1219130 IFLab1_003931 CCNC(=O)Cc1c(OC)ccc2cc(Br)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C16 compound treatment 0.06 0.00152 0.1 0.067 0.00638 0.45 0.3839 0.8421 2067747 IFLab1_003932 COc1cccc(/N=C/2\NC(=O)\C(=C/3\C(=O)Nc4ccccc34)\S2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C17 compound treatment 0.067 0.00852 0.55 0.061 3.75E-4 0.03 0.4061 0.7401 2067748 IFLab1_003933 CC(C)NC(=O)c1cc(Br)c(C)c(C)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C18 compound treatment 0.056 -0.00248 -0.16 0.052 -0.00863 -0.6 -0.5391 -0.8648 2067749 IFLab1_003934 Oc1ccccc1/C=N/c2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C19 compound treatment 0.063 0.00452 0.29 0.057 -0.00363 -0.25 0.0265 0.0687 1599486 IFLab1_003935 Cc1ccc(cc1NC(=O)c2cccc(Cl)c2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C20 compound treatment 0.084 0.0255 1.64 0.088 0.0274 1.91 2.5136 0.9971 2067750 IFLab1_003936 O=C(N/C(=C\c1ccc(o1)c2ccccc2)/C(=O)N3CCOCC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C21 compound treatment 0.051 -0.00748 -0.48 0.053 -0.00762 -0.53 -0.7173 -0.9987 2067751 IFLab1_003937 CC(c1ccccc1)n2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C22 compound treatment 0.058 -4.84E-4 -0.03 0.06 -6.25E-4 -0.04 -0.0529 -0.9863 1700925 IFLab1_003938 O=C(CSc1nnnn1c2ccccc2)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C23 mock treatment 0.056 -0.00248 -0.16 0.062 0.00137 0.1 -0.0451 -0.2419 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 C24 mock treatment 0.119 0.0605 3.9 0.063 0.00237 0.17 2.8716 0.7366 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D01 compound treatment 0.065 0.00652 0.42 0.068 0.00738 0.52 0.6609 0.9948 2067752 IFLab1_003939 Cc1sc2ncnc(SC3CCCCN(C(=O)c4ccccc4)C3=O)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D02 compound treatment 0.106 0.0475 3.06 0.102 0.0414 2.89 4.2065 0.9996 2067753 IFLab1_003940 CCOC(=O)CSc1nnc(CSc2nc3ccccc3s2)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D03 compound treatment 0.103 0.0445 2.87 0.098 0.0374 2.61 3.8723 0.9989 1652678 IFLab1_003941 Cc1sc2ncnc(n3nnc4ccccc34)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D04 compound treatment 0.06 0.00152 0.1 0.059 -0.00162 -0.11 -0.0113 -0.0753 1306053 IFLab1_003942 CSc1nc2ccc(NC(=O)c3coc4ccccc4c3=O)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D05 compound treatment 0.075 0.0165 1.06 0.062 0.00137 0.1 0.8196 0.7679 2067754 IFLab1_003943 CCN1CCN(CC1)S(=O)(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D06 compound treatment 0.119 0.0605 3.9 0.102 0.0414 2.89 4.7981 0.9892 2067755 IFLab1_003944 O=C(OCc1nc2ccccc2s1)c3ccc4OCCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D07 compound treatment 0.073 0.0145 0.93 0.061 3.75E-4 0.03 0.6792 0.7266 1271140 IFLab1_003945 Cc1cc(NC(=O)c2cc(=O)c3ccccc3o2)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D08 compound treatment 0.065 0.00652 0.42 0.065 0.00438 0.31 0.5127 0.9879 1192376 IFLab1_003946 COc1ccc(cc1C(=O)O)S(=O)(=O)N2CCC(C)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D09 compound treatment 0.307 0.249 16.0 0.269 0.208 14.56 21.6041 0.9989 1722692 IFLab1_003947 O=C(Nc1nc(cs1)c2ccc3OCOc3c2)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D10 compound treatment 0.063 0.00452 0.29 0.067 0.00638 0.45 0.5205 0.9786 2067756 IFLab1_003948 FC(F)(F)c1ccccc1NC(=O)CN2C(=O)/C(=C/c3cccc(Br)c3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D11 compound treatment 0.059 5.16E-4 0.03 0.056 -0.00462 -0.32 -0.205 -0.6311 2067757 IFLab1_003949 FC(F)(F)c1ccc(nc1)N2CCN(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D12 compound treatment 0.07 0.0115 0.74 0.072 0.0114 0.79 1.086 0.9994 2067758 IFLab1_003950 Cc1ccccc1NC(=O)CSc2[nH]c(=O)cc(C)c2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D13 compound treatment 0.058 -4.84E-4 -0.03 0.064 0.00338 0.24 0.1447 0.6084 1190709 IFLab1_003951 CCN(CC)Cc1oc(CO)cc(=O)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D14 compound treatment 0.063 0.00452 0.29 0.063 0.00237 0.17 0.3229 0.9646 1130052 IFLab1_003952 NC1=C(C#N)C(Cc2ccccc2)C3=C(CCCC3=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D15 compound treatment 0.12 0.0615 3.96 0.097 0.0364 2.54 4.5966 0.977 1636340 IFLab1_003953 Oc1c(ccc2cccnc12)C(N3CCOCC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D16 compound treatment 0.117 0.0585 3.77 0.12 0.0594 4.15 5.5963 0.9988 2067759 IFLab1_003954 COC(=O)CSC1=C(C#N)C2(CCCCC2)C(C(=N)N1)c3nc(cs3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D17 compound treatment 0.055 -0.00348 -0.22 0.054 -0.00662 -0.46 -0.4858 -0.9447 1688285 IFLab1_003955 CCOC(=O)N1CCN(CC(O)COCc2ccccc2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D18 compound treatment 0.066 0.00752 0.48 0.064 0.00338 0.24 0.5088 0.9454 1205429 IFLab1_003956 OC(=O)c1ccccc1c2ccccc2C(=O)Nc3ccccc3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D19 compound treatment 0.056 -0.00248 -0.16 0.056 -0.00462 -0.32 -0.3415 -0.9474 1250232 IFLab1_003957 CCOC(=O)N1CCN(CC(O)COc2cc(C)c(Cl)c(C)c2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D20 compound treatment 0.068 0.00952 0.61 0.064 0.00338 0.24 0.5998 0.9139 1228488 IFLab1_003958 O=S(=O)(N=C1SCCS1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D21 compound treatment 0.061 0.00252 0.16 0.059 -0.00162 -0.11 0.0342 0.1731 2067760 IFLab1_003959 Nc1nc(SCC(=O)NCCO)nc2sc3CCCCc3c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D22 compound treatment 0.05 -0.00848 -0.55 0.05 -0.0106 -0.74 -0.911 -0.9886 1500854 IFLab1_003960 N#CC(N1CCCCCC1)c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D23 mock treatment 0.057 -0.00148 -0.1 0.056 -0.00462 -0.32 -0.296 -0.8785 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 D24 mock treatment 0.062 0.00352 0.23 0.057 -0.00363 -0.25 -0.019 -0.0561 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E01 compound treatment 0.073 0.0145 0.93 0.075 0.0144 1.0 1.3708 0.9994 1506747 IFLab1_003961 COc1ccc(cc1C(=O)O)S(=O)(=O)N2CCCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E02 compound treatment 0.058 -4.84E-4 -0.03 0.065 0.00438 0.31 0.1941 0.6318 1025087 IFLab1_003962 OC(=O)CCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E03 compound treatment 0.359 0.301 19.34 0.447 0.386 26.99 32.7637 0.9866 2067761 IFLab1_003963 CCOC(=O)c1oc2ccccc2c1NC(=O)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E04 compound treatment 0.052 -0.00648 -0.42 0.053 -0.00762 -0.53 -0.6718 -0.9927 2067762 IFLab1_003964 CC(=C)Cn1c(CCCO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E05 compound treatment 0.058 -4.84E-4 -0.03 0.06 -6.25E-4 -0.04 -0.0529 -0.9863 1710571 IFLab1_003965 CC12COC3(CC2CCC13C)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E06 compound treatment 0.054 -0.00448 -0.29 0.051 -0.00962 -0.67 -0.6795 -0.9287 2067763 IFLab1_003966 CCn1c(nc2ccccc12)c3cccc(Br)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E07 compound treatment 0.049 -0.00948 -0.61 0.061 3.75E-4 0.03 -0.4131 -0.6761 2067764 IFLab1_003967 CCN(CC)C(=O)C1(CCC2(C)C(=O)C1)C2(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E08 compound treatment 0.063 0.00452 0.29 0.064 0.00338 0.24 0.3723 0.9946 1178687 IFLab1_003968 Cc1cccc(NC(=O)Cn2nnc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E09 compound treatment 0.052 -0.00648 -0.42 0.055 -0.00562 -0.39 -0.573 -0.9995 1103732 IFLab1_003969 CC1(C)C2CCC(C2)(C(=O)O)C1=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E10 compound treatment 0.051 -0.00748 -0.48 0.054 -0.00662 -0.46 -0.6679 -0.9998 2067765 IFLab1_003970 OC(=O)/C=C\C(=O)Nc1ccccc1C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E11 compound treatment 0.072 0.0135 0.87 0.066 0.00537 0.38 0.8807 0.9294 1470009 IFLab1_003971 Oc1ccc(O)c(Cc2nc3ccccc3s2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E12 compound treatment 0.064 0.00552 0.36 0.064 0.00338 0.24 0.4178 0.9802 2067766 IFLab1_003972 CC(=O)/N=C/1\NC(=O)C(CC(=O)O)S1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E13 compound treatment 0.057 -0.00148 -0.1 0.058 -0.00263 -0.18 -0.1972 -0.9538 2067767 IFLab1_003973 Cn1c(nc2ccccc12)/C(=N/O)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E14 compound treatment 0.083 0.0245 1.58 0.09 0.0294 2.05 2.5669 0.9916 2067768 IFLab1_003974 CC(C)C(=O)N=c1scc(c2ccc(C)cc2)n1c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E15 compound treatment 0.056 -0.00248 -0.16 0.06 -6.25E-4 -0.04 -0.1439 -0.8684 1643271 IFLab1_003975 COc1ccc2cc(Br)ccc2c1CC(=O)NC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E16 compound treatment 0.058 -4.84E-4 -0.03 0.058 -0.00263 -0.18 -0.1517 -0.8155 2067769 IFLab1_003976 OCc1csc2nc(=O)c3c4CCCCc4sc3n12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E17 compound treatment 0.066 0.00752 0.48 0.066 0.00537 0.38 0.6076 0.9922 2067770 IFLab1_003977 CNC(=O)c1cc(Br)c(C)c(C)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E18 compound treatment 0.056 -0.00248 -0.16 0.059 -0.00162 -0.11 -0.1933 -0.9859 1057181 IFLab1_003978 C(Cc1ccccn1)N2CCN(CCc3ccccn3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E19 compound treatment 0.054 -0.00448 -0.29 0.058 -0.00263 -0.18 -0.3337 -0.976 1409934 IFLab1_003979 Cc1ccc2cccc(OC(=O)N3CCOCC3)c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E20 compound treatment 0.056 -0.00248 -0.16 0.063 0.00237 0.17 0.0043 0.0185 2067771 IFLab1_003980 Cc1ccc(cc1)C(=O)CC(c2ccccc2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E21 compound treatment 0.057 -0.00148 -0.1 0.058 -0.00263 -0.18 -0.1972 -0.9538 2067772 IFLab1_003981 Cc1nc2ccccc2n1C(=O)/C=C\C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E22 compound treatment 0.051 -0.00748 -0.48 0.056 -0.00462 -0.32 -0.5691 -0.9811 1518257 IFLab1_003982 CCN1CCN(CC1)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E23 mock treatment 0.056 -0.00248 -0.16 0.059 -0.00162 -0.11 -0.1933 -0.9859 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 E24 mock treatment 0.06 0.00152 0.1 0.062 0.00137 0.1 0.1369 1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F01 compound treatment 0.106 0.0475 3.06 0.102 0.0414 2.89 4.2065 0.9996 1681080 IFLab1_003983 COc1ccc(CCNc2ncnc3sc(C)c(C)c23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F02 compound treatment 0.262 0.204 13.1 0.243 0.182 12.74 18.2716 0.9999 1118702 IFLab1_003984 O=C(c1ccccc1)c2ccccc2NS(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F03 compound treatment 0.069 0.0105 0.68 0.064 0.00338 0.24 0.6453 0.9004 1181804 IFLab1_003985 COC(=O)c1ccc(Oc2ncnc3sc4CCCCc4c23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F04 compound treatment 0.826 0.768 49.4 0.721 0.66 46.13 67.5533 0.9994 1164174 IFLab1_003986 Cc1nc2cc(NC(=O)c3ccc4OCCOc4c3)ccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F05 compound treatment 0.108 0.0495 3.19 0.093 0.0324 2.26 3.8529 0.9859 1603298 IFLab1_003987 C1CCCN(CC1)c2ncnc3n(ncc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F06 compound treatment 0.094 0.0355 2.29 0.088 0.0274 1.91 2.9687 0.9961 1691025 IFLab1_003988 CCOC(=O)c1sc(NC(=O)Cc2cccc3ccccc23)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F07 compound treatment 0.066 0.00752 0.48 0.062 0.00137 0.1 0.41 0.8313 1347874 IFLab1_003989 O=C(N1CCN(CC1)c2ccccc2)c3cc(=O)c4ccccc4o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F08 compound treatment 0.346 0.288 18.51 0.314 0.253 17.7 25.602 0.9998 1596702 IFLab1_003990 Fc1ccc(cc1)S(=O)(=O)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F09 compound treatment 0.057 -0.00148 -0.1 0.058 -0.00263 -0.18 -0.1972 -0.9538 2067773 IFLab1_003991 CC(C)(CSc1ccccn1)NS(=O)(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F10 compound treatment 0.067 0.00852 0.55 0.07 0.00938 0.65 0.8507 0.9961 2067774 IFLab1_003992 COC(=O)c1ccc(/C=C\2/SC(=S)N(CCC(=O)N(Cc3ccccc3)C(C)(C)C)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F11 compound treatment 0.097 0.0385 2.48 0.122 0.0614 4.29 4.7848 0.9661 2067775 IFLab1_003993 CCOC(=O)N1CCN(CC1)c2ccc(cn2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F12 compound treatment 0.085 0.0265 1.71 0.084 0.0234 1.63 2.3615 0.9998 2067776 IFLab1_003994 CCOc1ccc(cc1)c2c(C#N)c(N)nc(SCC#N)c2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F13 compound treatment 0.084 0.0255 1.64 0.088 0.0274 1.91 2.5136 0.9971 1447178 IFLab1_003995 CCOC(=O)N1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F14 compound treatment 0.049 -0.00948 -0.61 0.055 -0.00562 -0.39 -0.7095 -0.9773 2067777 IFLab1_003996 CCCC(C)C1C(=C(N)OC2=C1C(=O)CC(C)(C)C2)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F15 compound treatment 0.07 0.0115 0.74 0.067 0.00638 0.45 0.839 0.9703 1371058 IFLab1_003997 CCN(CC)Cc1cc(Cl)c2cccnc2c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F16 compound treatment 0.096 0.0375 2.41 0.077 0.0164 1.14 2.5164 0.9418 2067778 IFLab1_003998 CSC1=C(C#N)C2(CCCCC2)C(C(=N)N1)c3nc(cs3)c4ccc(C)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F17 compound treatment 0.06 0.00152 0.1 0.056 -0.00462 -0.32 -0.1595 -0.4725 1443895 IFLab1_003999 CCOC(=O)N1CCN(CC(O)COC2CC(C)CCC2C(C)C)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F18 compound treatment 0.058 -4.84E-4 -0.03 0.057 -0.00363 -0.25 -0.2011 -0.7881 1367941 IFLab1_004000 CC(NC(=O)c1ccccc1c2ccccc2C(=O)O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F19 compound treatment 0.06 0.00152 0.1 0.06 -6.25E-4 -0.04 0.0381 0.3567 1574885 IFLab1_004001 CCOC(=O)N1CCN(CC(O)COc2ccc3ccccc3c2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F20 compound treatment 0.061 0.00252 0.16 0.064 0.00338 0.24 0.2812 0.9832 1576686 IFLab1_004002 CCOC(=O)C1=C(C)NC2=C(C1c3ccccc3)C(=O)CC(C)(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F21 compound treatment 0.1 0.0415 2.67 0.09 0.0294 2.05 3.3406 0.9915 1358709 IFLab1_004003 Nc1nc(SCc2ccc(cc2)C(=O)NCCO)nc3sc4CCCCc4c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F22 compound treatment 0.069 0.0105 0.68 0.072 0.0114 0.79 1.0405 0.9968 1290396 IFLab1_004004 Clc1cccc(c1)C(=O)Oc2ccc3oc(=O)sc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F23 mock treatment 0.058 -4.84E-4 -0.03 0.063 0.00237 0.17 0.0953 0.5645 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 F24 mock treatment 0.059 5.16E-4 0.03 0.059 -0.00162 -0.11 -0.0568 -0.48 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G01 compound treatment 0.072 0.0135 0.87 0.066 0.00537 0.38 0.8807 0.9294 2067779 IFLab1_004005 O=C(CSc1nc2ccccc2s1)NCCCN3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G02 compound treatment 0.061 0.00252 0.16 0.062 0.00137 0.1 0.1824 0.9689 1042426 IFLab1_004006 OC(C(O)c1nc2ccccc2[nH]1)c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G03 compound treatment 0.118 0.0595 3.83 0.169 0.108 7.57 8.0623 0.9502 1232473 IFLab1_004007 O=C(Nc1ccccc1c2nc3ccccc3o2)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G04 compound treatment 0.058 -4.84E-4 -0.03 0.059 -0.00162 -0.11 -0.1023 -0.869 1605646 IFLab1_004008 CC(c1ccccc1)n2c(CCCO)nc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G05 compound treatment 0.064 0.00552 0.36 0.067 0.00638 0.45 0.566 0.9937 1140709 IFLab1_004009 CC1(C)C2(C)CCC1(OC2=O)C(=O)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G06 compound treatment 0.055 -0.00348 -0.22 0.053 -0.00762 -0.53 -0.5352 -0.9261 2067780 IFLab1_004010 C=CCn1c(COc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G07 compound treatment 0.061 0.00252 0.16 0.067 0.00638 0.45 0.4294 0.9062 1314249 IFLab1_004011 CC1(C)C2(C)CCC1(CC2=O)C(=O)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G08 compound treatment 0.062 0.00352 0.23 0.072 0.0114 0.79 0.7219 0.8737 1499128 IFLab1_004012 Cc1ccc(NC(=O)Cn2nnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G09 compound treatment 0.056 -0.00248 -0.16 0.057 -0.00363 -0.25 -0.2921 -0.9754 2067781 IFLab1_004013 CC1(C)C2CCC(C2)(C(=O)N)C1=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G10 compound treatment 0.055 -0.00348 -0.22 0.066 0.00537 0.38 0.107 0.2445 2067782 IFLab1_004014 COC(=O)/C=C\C(=O)Nc1ccc(NC(=O)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G11 compound treatment 0.06 0.00152 0.1 0.06 -6.25E-4 -0.04 0.0381 0.3567 1218937 IFLab1_004015 Oc1ccc(O)c(Cc2nc3ccccc3[nH]2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G12 compound treatment 0.062 0.00352 0.23 0.067 0.00638 0.45 0.4749 0.9507 1874778 IFLab1_004016 OC(=O)CCC(=O)N=c1[nH]c(cs1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G13 compound treatment 0.056 -0.00248 -0.16 0.065 0.00438 0.31 0.1031 0.2988 1532898 IFLab1_004017 COC(Cc1nc2ccccc2s1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G14 compound treatment 0.773 0.715 45.99 0.769 0.708 49.49 67.5123 0.9993 2067783 IFLab1_004018 COC(=O)c1sc(=Nc2ccccc2)n(c1C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G15 compound treatment 0.053 -0.00548 -0.35 0.056 -0.00462 -0.32 -0.4781 -0.999 2067784 IFLab1_004019 O[C@@H]1CCCC[C@@H]1c2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G16 compound treatment 0.057 -0.00148 -0.1 0.065 0.00438 0.31 0.1486 0.464 1661218 IFLab1_004020 OCCNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G17 compound treatment 0.055 -0.00348 -0.22 0.063 0.00237 0.17 -0.0412 -0.1478 1276443 IFLab1_004021 Cc1ccc2cccc(OCc3ccccc3)c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G18 compound treatment 0.06 0.00152 0.1 0.065 0.00438 0.31 0.2851 0.8887 1580956 IFLab1_004022 Nc1ncc(Cc2ccc(Cl)cc2Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G19 compound treatment 0.057 -0.00148 -0.1 0.063 0.00237 0.17 0.0498 0.2601 1499659 IFLab1_004023 COc1ccc(CN2CCN(Cc3c[nH]c4ccccc34)CC2)c(OC)c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G20 compound treatment 0.059 5.16E-4 0.03 0.069 0.00838 0.59 0.4372 0.7461 2067785 IFLab1_004024 CC(=O)Nc1nc(Br)sc1Cc2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G21 compound treatment 0.047 -0.0115 -0.74 0.051 -0.00962 -0.67 -0.9981 -0.9989 2067786 IFLab1_004025 Cn1c(Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G22 compound treatment 0.055 -0.00348 -0.22 0.061 3.75E-4 0.03 -0.14 -0.6203 1271881 IFLab1_004026 COc1ccc2c(C)cc(nc2c1)N3CC(C)OC(C)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G23 mock treatment 0.055 -0.00348 -0.22 0.056 -0.00462 -0.32 -0.387 -0.9841 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 G24 mock treatment 0.055 -0.00348 -0.22 0.062 0.00137 0.1 -0.0906 -0.3715 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H01 compound treatment 0.064 0.00552 0.36 0.073 0.0124 0.86 0.8624 0.9227 1218095 IFLab1_004027 C(Nc1nc(nc2ccccc12)c3ccccc3)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H02 compound treatment 0.059 5.16E-4 0.03 0.07 0.00938 0.65 0.4866 0.742 2067787 IFLab1_004028 O=C(NC1CCS(=O)(=O)C1)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H03 compound treatment 0.104 0.0455 2.93 0.095 0.0344 2.4 3.7696 0.9951 1125766 IFLab1_004029 CCOC(=O)C1=C(C)NC2=C(C1c3ccc4OCCOc4c3)C(=O)CC(C)(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H04 compound treatment 0.048 -0.0105 -0.67 0.048 -0.0126 -0.88 -1.1008 -0.9913 1502661 IFLab1_004030 Cc1cccc(NC(=O)c2coc3ccccc3c2=O)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H05 compound treatment 0.06 0.00152 0.1 0.064 0.00338 0.24 0.2357 0.9238 1624933 IFLab1_004031 CC1CCN(CCC(=O)Nc2sc3CCCCc3c2C#N)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H06 compound treatment 0.078 0.0195 1.26 0.089 0.0284 1.98 2.2899 0.9758 1562302 IFLab1_004032 CCOC(=O)c1sc(NC(=O)CCOc2ccccc2)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H07 compound treatment 0.074 0.0155 1.0 0.076 0.0154 1.07 1.4657 0.9993 1721633 IFLab1_004033 O=C(Nc1nccs1)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H08 compound treatment 0.059 5.16E-4 0.03 0.06 -6.25E-4 -0.04 -0.0074 -0.1346 2067788 IFLab1_004034 OC(=O)CSc1nnc(c2ccncc2)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H09 compound treatment 0.072 0.0135 0.87 0.082 0.0214 1.49 1.671 0.9669 1728558 IFLab1_004035 Cc1ccc(cc1)S(=O)(=O)NC(C)(C)CSc2ncccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H10 compound treatment 0.048 -0.0105 -0.67 0.048 -0.0126 -0.88 -1.1008 -0.9913 1030654 IFLab1_004036 ONC(=O)COc1ccc(Cl)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H11 compound treatment 0.06 0.00152 0.1 0.062 0.00137 0.1 0.1369 1.0 1158237 IFLab1_004037 CCN1CCN(CC1)S(=O)(=O)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H12 compound treatment 0.173 0.115 7.37 0.128 0.0674 4.71 8.5402 0.9765 2067789 IFLab1_004038 NC1=C(C#N)C(C2CCCCC2)C3=C(CC(CC3=O)c4ccccc4)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H13 compound treatment 0.055 -0.00348 -0.22 0.055 -0.00562 -0.39 -0.4364 -0.9646 1593651 IFLab1_004039 Clc1ccc(c2ncc3ccccn23)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H14 compound treatment 0.063 0.00452 0.29 0.063 0.00237 0.17 0.3229 0.9646 2067790 IFLab1_004040 CC1(C)CC(=O)C2=C(C1)OC(=C(C#N)C2CCc3ccccc3)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H15 compound treatment 0.089 0.0305 1.96 0.084 0.0234 1.63 2.5436 0.9958 1352508 IFLab1_004041 COc1ccc(OC)c(c1)C2SCCN2C(=O)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H16 compound treatment 0.089 0.0305 1.96 0.109 0.0484 3.38 3.7785 0.9667 1502136 IFLab1_004042 Cc1cc(C)c(C(=O)N)c(SCC(=O)c2ccc(Cl)cc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H17 compound treatment 0.062 0.00352 0.23 0.072 0.0114 0.79 0.7219 0.8737 1287574 IFLab1_004043 CCOC(=O)N1CCN(CC(O)COC2C(C)(C)C3CCC2(C)C3)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H18 compound treatment 0.066 0.00752 0.48 0.067 0.00638 0.45 0.657 0.9991 1195797 IFLab1_004044 NC(=O)Cn1c2ccccc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H19 compound treatment 0.065 0.00652 0.42 0.069 0.00838 0.59 0.7103 0.9867 1130221 IFLab1_004045 OC(COc1ccccc1CC=C)CN2CCN(Cc3ccc4OCOc4c3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H20 compound treatment 0.047 -0.0115 -0.74 0.051 -0.00962 -0.67 -0.9981 -0.9989 2067791 IFLab1_004046 Clc1cccc(c1)C(=O)Sc2nc3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H21 compound treatment 0.052 -0.00648 -0.42 0.055 -0.00562 -0.39 -0.573 -0.9995 1270665 IFLab1_004047 Nc1nc(SCC(=O)N2CCCCC2)nc3sc4CCCCc4c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H22 compound treatment 0.071 0.0125 0.81 0.069 0.00838 0.59 0.9834 0.9877 1305578 IFLab1_004048 COc1cccc(c1)C(=O)Oc2ccc3oc(=O)sc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H23 mock treatment 0.054 -0.00448 -0.29 0.06 -6.25E-4 -0.04 -0.2349 -0.8049 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 H24 mock treatment 0.056 -0.00248 -0.16 0.061 3.75E-4 0.03 -0.0945 -0.5835 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I01 compound treatment 0.481 0.423 27.2 0.461 0.4 27.97 39.0078 0.9999 2067792 IFLab1_004049 COC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I02 compound treatment 0.068 0.00952 0.61 0.072 0.0114 0.79 0.995 0.9917 1111780 IFLab1_004050 COc1ccc(cc1OC)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I03 compound treatment 0.076 0.0175 1.13 0.107 0.0464 3.24 3.0881 0.9002 1198571 IFLab1_004051 O=C(Nc1ccccc1c2nc3ccccc3o2)C4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I04 compound treatment 0.065 0.00652 0.42 0.052 -0.00863 -0.6 -0.1295 -0.1764 1466951 IFLab1_004052 CC(c1ccccc1)n2c(CO)nc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I05 compound treatment 0.077 0.0185 1.19 0.084 0.0234 1.63 1.9974 0.988 1187141 IFLab1_004053 CC1(C)C2(C)CCC1(OC2=O)C(=O)N3CCCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I06 compound treatment 0.088 0.0295 1.9 0.102 0.0414 2.89 3.3872 0.9793 1527969 IFLab1_004054 Clc1ccc(nn1)n2ccnc2C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I07 compound treatment 0.073 0.0145 0.93 0.071 0.0104 0.72 1.1732 0.9921 1510527 IFLab1_004055 CC1(C)C2(C)CCC1(CC2=O)C(=O)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I08 compound treatment 0.061 0.00252 0.16 0.064 0.00338 0.24 0.2812 0.9832 1718880 IFLab1_004056 COCn1ccnc1P(=O)(O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I09 compound treatment 0.057 -0.00148 -0.1 0.068 0.00738 0.52 0.2968 0.5664 1578960 IFLab1_004057 CC1(C)C2(C)CCC1(CC2O)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I10 compound treatment 0.053 -0.00548 -0.35 0.051 -0.00962 -0.67 -0.725 -0.9547 1241726 IFLab1_004058 NC(=O)CSc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I11 compound treatment 0.052 -0.00648 -0.42 0.067 0.00638 0.45 0.0198 0.0325 2067793 IFLab1_004059 CC(O)CCc1sc2ccccc2[n+]1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I12 compound treatment 0.205 0.147 9.43 0.24 0.179 12.53 15.5292 0.9902 1210609 IFLab1_004060 CCOC(=O)Cc1csc(Nc2ccc(Cl)cc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I13 compound treatment 0.06 0.00152 0.1 0.059 -0.00162 -0.11 -0.0113 -0.0753 1149957 IFLab1_004061 CC(=O)SC(CC(=O)O)c1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I14 compound treatment 1.156 1.1 70.64 0.99 0.929 64.93 95.8607 0.9991 1983767 IFLab1_004062 COC(=O)c1sc(=Nc2ccccc2)[nH]c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I15 compound treatment 0.064 0.00552 0.36 0.066 0.00537 0.38 0.5166 0.9996 2067794 IFLab1_004063 NC(=O)Cc1nc(cs1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I16 compound treatment 0.057 -0.00148 -0.1 0.058 -0.00263 -0.18 -0.1972 -0.9538 1011848 IFLab1_004064 CN(C)CCC(O)c1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I17 compound treatment 0.081 0.0225 1.45 0.063 0.00237 0.17 1.1421 0.7829 1922612 IFLab1_004065 Cc1nc(co1)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I18 compound treatment 0.068 0.00952 0.61 0.075 0.0144 1.0 1.1432 0.9719 1620515 IFLab1_004066 COc1ccc(Cc2cnc(N)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I19 compound treatment 0.068 0.00952 0.61 0.068 0.00738 0.52 0.7974 0.9963 1665570 IFLab1_004067 COc1cc(OC)c(OC)cc1CN2CCN(Cc3ccc(F)cc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I20 compound treatment 0.053 -0.00548 -0.35 0.054 -0.00662 -0.46 -0.5769 -0.9911 2067795 IFLab1_004068 COc1ccc(cc1)S(=O)(=O)CC(SC#N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I21 compound treatment 0.06 0.00152 0.1 0.061 3.75E-4 0.03 0.0875 0.8663 2067796 IFLab1_004069 CC(C)n1c(nc2ccccc12)C(C)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I22 compound treatment 0.068 0.00952 0.61 0.062 0.00137 0.1 0.501 0.8081 1153758 IFLab1_004070 C(Nc1ncnc2sc3CCCCc3c12)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I23 mock treatment 0.057 -0.00148 -0.1 0.056 -0.00462 -0.32 -0.296 -0.8785 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 I24 mock treatment 0.06 0.00152 0.1 0.065 0.00438 0.31 0.2851 0.8887 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J01 compound treatment 0.075 0.0165 1.06 0.066 0.00537 0.38 1.0172 0.9022 2067797 IFLab1_004071 COC(=O)c1cccc(c1)N2C(=O)/C(=C\c3cccnc3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J02 compound treatment 0.095 0.0365 2.35 0.09 0.0294 2.05 3.113 0.9977 2067798 IFLab1_004072 FC(F)(F)c1cccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)/SC2=S)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J03 compound treatment 0.072 0.0135 0.87 0.09 0.0294 2.05 2.0662 0.927 2067799 IFLab1_004073 Cc1sc2ncnc(SCc3ccccc3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J04 compound treatment 0.069 0.0105 0.68 0.078 0.0174 1.21 1.3369 0.962 1280766 IFLab1_004074 O=C(N1CCN(CC1)c2ccccc2)c3coc4ccccc4c3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J05 compound treatment 0.075 0.0165 1.06 0.077 0.0164 1.14 1.5606 0.9993 2067800 IFLab1_004075 O=C(CSc1ncnc2sc3CCCc3c12)NCCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J06 compound treatment 0.821 0.763 49.08 0.544 0.483 33.77 58.5822 0.9833 1251832 IFLab1_004076 CCC(=O)Nc1ccccc1c2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J07 compound treatment 0.063 0.00452 0.29 0.06 -6.25E-4 -0.04 0.1747 0.5942 1556547 IFLab1_004077 CC1(C)CC(=O)c2sc(NC(=O)c3cc(=O)c4ccccc4o3)nc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J08 compound treatment 0.059 5.16E-4 0.03 0.064 0.00338 0.24 0.1902 0.7988 1340014 IFLab1_004078 O=C(COC(=O)C1CCN(CC1)S(=O)(=O)c2ccc3ccccc3c2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J09 compound treatment 0.073 0.0145 0.93 0.073 0.0124 0.86 1.272 0.9992 1983663 IFLab1_004079 Cc1ccc(cc1)S(=O)(=O)NCCSc2ncccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J10 compound treatment 0.059 5.16E-4 0.03 0.068 0.00738 0.52 0.3878 0.7511 2067801 IFLab1_004080 ONC(=O)CCCOc1ccc(Cl)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J11 compound treatment 0.471 0.413 26.55 0.427 0.366 25.59 36.8731 0.9998 1662497 IFLab1_004081 Fc1ccc(cc1)S(=O)(=O)N2CCCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J12 compound treatment 0.064 0.00552 0.36 0.069 0.00838 0.59 0.6648 0.9713 1247646 IFLab1_004082 CCOC(=O)C1=C(OC(=C(C#N)C1C(C)C)N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J13 compound treatment 0.053 -0.00548 -0.35 0.054 -0.00662 -0.46 -0.5769 -0.9911 1193394 IFLab1_004083 Clc1ccccc1c2ncc3ccccn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J14 compound treatment 0.061 0.00252 0.16 0.059 -0.00162 -0.11 0.0342 0.1731 2067802 IFLab1_004084 CCOC(=O)/C(=C(\C)/O)/C1(CCCCC1)C(C#N)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J15 compound treatment 0.069 0.0105 0.68 0.071 0.0104 0.72 0.9911 0.9994 1285402 IFLab1_004085 Fc1ccc(cc1)S(=O)(=O)N2CCSC2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J16 compound treatment 0.06 0.00152 0.1 0.063 0.00237 0.17 0.1863 0.968 1535652 IFLab1_004086 CCCSc1nc(C)cc(C)c1C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J17 compound treatment 0.056 -0.00248 -0.16 0.056 -0.00462 -0.32 -0.3415 -0.9474 1180294 IFLab1_004087 CCOC(=O)N1CCN(CC(O)COc2cc(C)ccc2C(C)C)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J18 compound treatment 0.063 0.00452 0.29 0.069 0.00838 0.59 0.6193 0.9479 1280339 IFLab1_004088 Cc1cc(C)c(NC(=O)Cn2cnc3ccccc23)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J19 compound treatment 0.06 0.00152 0.1 0.07 0.00938 0.65 0.5321 0.8036 1370921 IFLab1_004089 Cc1cc(OCC(O)CN2CCN(Cc3ccc4OCOc4c3)CC2)cc(C)c1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J20 compound treatment 0.062 0.00352 0.23 0.057 -0.00363 -0.25 -0.019 -0.0561 1913413 IFLab1_004090 OC(=O)CSc1nnnn1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J21 compound treatment 0.234 0.176 11.3 0.177 0.116 8.13 13.737 0.987 2067803 IFLab1_004091 Cc1sc2nc(SCC=C)nc(N)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J22 compound treatment 0.061 0.00252 0.16 0.063 0.00237 0.17 0.2318 0.9999 1458176 IFLab1_004092 COc1ccc(cc1OC)C(C#N)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J23 mock treatment 0.065 0.00652 0.42 0.057 -0.00363 -0.25 0.1175 0.2398 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 J24 mock treatment 0.057 -0.00148 -0.1 0.058 -0.00263 -0.18 -0.1972 -0.9538 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K01 compound treatment 0.059 5.16E-4 0.03 0.061 3.75E-4 0.03 0.042 0.9931 2067804 IFLab1_004093 ICC1COC[N+]21CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K02 compound treatment 0.067 0.00852 0.55 0.068 0.00738 0.52 0.7519 0.9995 1721556 IFLab1_004094 O=C(CSc1nc2ccccc2[nH]1)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K03 compound treatment 0.061 0.00252 0.16 0.067 0.00638 0.45 0.4294 0.9062 1244153 IFLab1_004095 O=C(COc1ccccc1)Nc2ccccc2c3nc4ccccc4o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K04 compound treatment 0.055 -0.00348 -0.22 0.059 -0.00162 -0.11 -0.2388 -0.9502 2067805 IFLab1_004096 CC(O)c1nc2ccccc2n1CC(=C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K05 compound treatment 0.069 0.0105 0.68 0.068 0.00738 0.52 0.8429 0.9909 1490821 IFLab1_004097 CC1(C)C2(C)CCC1(OC2=O)C(=O)N3CCc4ccccc4C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K06 compound treatment 0.063 0.00452 0.29 0.069 0.00838 0.59 0.6193 0.9479 1120666 IFLab1_004098 OP(=O)(c1nccn1c2ccc(NC(=O)c3ccccc3Cl)cc2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K07 compound treatment 0.059 5.16E-4 0.03 0.068 0.00738 0.52 0.3878 0.7511 1262122 IFLab1_004099 CC1(C)C2(C)CCC1(CC2=O)C(=O)N3CCCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K08 compound treatment 0.052 -0.00648 -0.42 0.054 -0.00662 -0.46 -0.6224 -0.9987 1717379 IFLab1_004100 O=P(N1CCCCCC1)(c2nc3ccccc3s2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K09 compound treatment 0.046 -0.0125 -0.8 0.048 -0.0126 -0.88 -1.1918 -0.9989 2067806 IFLab1_004101 CC12C=C(Br)C2CCC1(C)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K10 compound treatment 0.054 -0.00448 -0.29 0.061 3.75E-4 0.03 -0.1855 -0.6403 2067807 IFLab1_004102 CCS/C(=N/c1ccccc1)/Nc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K11 compound treatment 0.05 -0.00848 -0.55 0.055 -0.00562 -0.39 -0.664 -0.987 2067808 IFLab1_004103 C[n+]1ccsc1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K12 compound treatment 0.059 5.16E-4 0.03 0.064 0.00338 0.24 0.1902 0.7988 1689552 IFLab1_004104 OC(=O)CCC(=O)Nc1nc(cs1)c2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K13 compound treatment 0.052 -0.00648 -0.42 0.06 -6.25E-4 -0.04 -0.326 -0.7768 1613969 IFLab1_004105 Cc1ccc(cc1)C(O)C(C)(C)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K14 compound treatment 0.058 -4.84E-4 -0.03 0.065 0.00438 0.31 0.1941 0.6318 1362321 IFLab1_004106 COC(=O)c1sc(N)nc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K15 compound treatment 0.052 -0.00648 -0.42 0.056 -0.00462 -0.32 -0.5236 -0.992 1263917 IFLab1_004107 OC(=O)CCc1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K16 compound treatment 0.068 0.00952 0.61 0.068 0.00738 0.52 0.7974 0.9963 2067809 IFLab1_004108 COC(=O)c1ccc(CSc2nccc(O)n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K17 compound treatment 0.062 0.00352 0.23 0.061 3.75E-4 0.03 0.1786 0.7837 1330843 IFLab1_004109 Clc1ccc(NC(=O)c2cc3ccccc3oc2=N)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K18 compound treatment 0.088 0.0295 1.9 0.087 0.0264 1.84 2.6462 0.9999 2067810 IFLab1_004110 NS(=O)(=O)c1ccc(cc1)c2ccc(/C=C(\C#N)/c3ccc(Cl)cc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K19 compound treatment 0.229 0.171 10.98 0.208 0.147 10.3 15.0408 0.9995 1609689 IFLab1_004111 CC(C)Cc1cc2c3ccccc3oc(=O)c2c(N)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K20 compound treatment 0.054 -0.00448 -0.29 0.052 -0.00863 -0.6 -0.6301 -0.9432 2067811 IFLab1_004112 Cc1ccc(cc1)S(=O)(=O)CC(SC#N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K21 compound treatment 0.053 -0.00548 -0.35 0.058 -0.00263 -0.18 -0.3793 -0.9535 1038915 IFLab1_004113 OCCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K22 compound treatment 0.055 -0.00348 -0.22 0.064 0.00338 0.24 0.0082 0.0251 2067812 IFLab1_004114 Cc1sc2ncnc(Sc3nnc4ccccn34)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K23 mock treatment 0.06 0.00152 0.1 0.053 -0.00762 -0.53 -0.3077 -0.5681 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 K24 mock treatment 0.057 -0.00148 -0.1 0.058 -0.00263 -0.18 -0.1972 -0.9538 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L01 compound treatment 0.043 -0.0155 -1.0 0.043 -0.0176 -1.23 -1.5754 -0.9945 2067813 IFLab1_004115 OC(=O)c1c(NC(=O)/C=C/c2ccco2)sc3CCCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L02 compound treatment 0.061 0.00252 0.16 0.065 0.00438 0.31 0.3306 0.9559 2067814 IFLab1_004116 CCc1ccc(/C=C/2\SC(=S)N(CCC(=O)N3CCCc4ccccc34)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L03 compound treatment 0.068 0.00952 0.61 0.069 0.00838 0.59 0.8468 0.9997 2067815 IFLab1_004117 O=C(CSc1nnc2sc3ccccc3n12)NCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L04 compound treatment 0.134 0.0755 4.86 0.134 0.0734 5.13 7.0616 0.9996 1721996 IFLab1_004118 Cc1cc(NC(=O)c2coc3ccccc3c2=O)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L05 compound treatment 0.06 0.00152 0.1 0.067 0.00638 0.45 0.3839 0.8421 2067816 IFLab1_004119 Fc1ccc(cc1)C(=O)CSc2ncnc3sc4CCCc4c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L06 compound treatment 0.073 0.0145 0.93 0.074 0.0134 0.93 1.3214 1.0 1437264 IFLab1_004120 COC(=O)c1c(NC(=O)c2ccc(Cl)s2)sc3CCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L07 compound treatment 0.071 0.0125 0.81 0.07 0.00938 0.65 1.0328 0.9947 1590309 IFLab1_004121 O=C(N1CCN(CC1)c2ccccc2)c3ccc(C#N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L08 compound treatment 0.077 0.0185 1.19 0.076 0.0154 1.07 1.6022 0.9987 1865398 IFLab1_004122 OC(=O)C1CCN(CC1)S(=O)(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L09 compound treatment 0.076 0.0175 1.13 0.064 0.00338 0.24 0.9639 0.8369 2067817 IFLab1_004123 Cc1ccc(cc1)S(=O)(=O)NCCSc2nncn2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L10 compound treatment 0.044 -0.0145 -0.93 0.047 -0.0136 -0.95 -1.3323 -0.9999 1004471 IFLab1_004124 NC(=O)COc1ccc(Cl)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L11 compound treatment 0.571 0.513 32.99 0.51 0.449 31.39 45.5245 0.9997 1310812 IFLab1_004125 CCOC(=O)N1CCN(CC1)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L12 compound treatment 0.058 -4.84E-4 -0.03 0.06 -6.25E-4 -0.04 -0.0529 -0.9863 1199043 IFLab1_004126 CCCc1n[nH]c2OC(=C(C#N)C(C(C)C)c12)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L13 compound treatment 0.064 0.00552 0.36 0.055 -0.00562 -0.39 -0.0268 -0.0506 2067818 IFLab1_004127 Fc1ccccc1c2ncc3ccccn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L14 compound treatment 0.054 -0.00448 -0.29 0.061 3.75E-4 0.03 -0.1855 -0.6403 2067819 IFLab1_004128 C/C(=C(\C(=O)Nc1ccccc1)/C2(CCCC2)C(C#N)C(=O)N)/O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L15 compound treatment 0.053 -0.00548 -0.35 0.058 -0.00263 -0.18 -0.3793 -0.9535 1706740 IFLab1_004129 CC1CC(CC(C)(C)C1)OCC(O)CN2CCN(CC2)c3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L16 compound treatment 0.062 0.00352 0.23 0.062 0.00137 0.1 0.228 0.9272 1547286 IFLab1_004130 Cc1cc(C)c(C(=O)N)c(SCC(=O)Nc2nccs2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L17 compound treatment 0.069 0.0105 0.68 0.065 0.00438 0.31 0.6947 0.9355 2067820 IFLab1_004131 CCOC(=O)N1CCN(CC(O)COCCC2(CC3CC4CC(C3)C2)C4)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L18 compound treatment 0.065 0.00652 0.42 0.073 0.0124 0.86 0.9079 0.9448 1687920 IFLab1_004132 C(Cn1cnc2ccccc12)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L19 compound treatment 0.065 0.00652 0.42 0.062 0.00137 0.1 0.3645 0.8471 1147315 IFLab1_004133 CC(C)(C)c1ccccc1OCC(O)CN2CCN(Cc3ccc4OCOc4c3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L20 compound treatment 0.069 0.0105 0.68 0.071 0.0104 0.72 0.9911 0.9994 1160809 IFLab1_004134 COc1ccc(cc1)C(=O)Sc2nnnn2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L21 compound treatment 0.077 0.0185 1.19 0.086 0.0254 1.77 2.0962 0.9813 2067821 IFLab1_004135 CCOC(=O)CSc1nc(N)c2c(C)c(C)sc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L22 compound treatment 0.056 -0.00248 -0.16 0.062 0.00137 0.1 -0.0451 -0.2419 1409803 IFLab1_004136 CCOC(=O)c1c(C)n(C)c2ccc(OC(=O)c3ccc(OC)cc3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L23 mock treatment 0.056 -0.00248 -0.16 0.055 -0.00562 -0.39 -0.3909 -0.9214 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 L24 mock treatment 0.064 0.00552 0.36 0.057 -0.00363 -0.25 0.072 0.1651 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M01 compound treatment 0.438 0.38 24.43 0.471 0.41 28.67 37.5447 0.9968 1262449 IFLab1_004137 CC(=O)Nc1ccccc1c2nc3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M02 compound treatment 0.056 -0.00248 -0.16 0.058 -0.00263 -0.18 -0.2427 -0.9977 1522274 IFLab1_004138 Cc1nc2ccccc2n1C(=O)CCCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M03 compound treatment 0.061 0.00252 0.16 0.069 0.00838 0.59 0.5282 0.8701 2067822 IFLab1_004139 O=C(Nc1ccccc1c2nc3ccccc3o2)/C=C/c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M04 compound treatment 0.071 0.0125 0.81 0.079 0.0184 1.28 1.4773 0.9748 1419243 IFLab1_004140 CC(O)c1nc2ccccc2n1Cc3cccc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M05 compound treatment 0.084 0.0255 1.64 0.083 0.0224 1.56 2.2666 0.9997 1412759 IFLab1_004141 CC1Cc2ccccc2N1C(=O)C3(CCC4(C)C(=O)O3)C4(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M06 compound treatment 0.056 -0.00248 -0.16 0.059 -0.00162 -0.11 -0.1933 -0.9859 1612011 IFLab1_004142 OP(=O)(c1nccn1c2ccc(Cl)nn2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M07 compound treatment 0.087 0.0285 1.84 0.094 0.0334 2.33 2.9465 0.993 1562590 IFLab1_004143 CC1Cc2ccccc2N1C(=O)C3(CCC4(C)C(=O)C3)C4(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M08 compound treatment 0.054 -0.00448 -0.29 0.063 0.00237 0.17 -0.0868 -0.2606 1556156 IFLab1_004144 Cn1c(nc2ccccc12)P(=O)(O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M09 compound treatment 0.056 -0.00248 -0.16 0.055 -0.00562 -0.39 -0.3909 -0.9214 2067823 IFLab1_004145 CC1(CBr)C2CCC1(C)/C(=N\O)/C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M10 compound treatment 0.066 0.00752 0.48 0.059 -0.00162 -0.11 0.2618 0.5269 1737929 IFLab1_004146 OC1(CSC(=S)N1Cc2ccco2)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M11 compound treatment 0.058 -4.84E-4 -0.03 0.058 -0.00263 -0.18 -0.1517 -0.8155 1411978 IFLab1_004147 COC(CC(=O)O)c1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M12 compound treatment 0.069 0.0105 0.68 0.08 0.0194 1.35 1.4357 0.9487 1673424 IFLab1_004148 CCOc1ccc(cc1)n2c(csc2=NC(=O)C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M13 compound treatment 0.107 0.0485 3.12 0.128 0.0674 4.71 5.5363 0.9801 2067824 IFLab1_004149 COc1ccc2cc(Br)ccc2c1CC#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M14 compound treatment 0.06 0.00152 0.1 0.064 0.00338 0.24 0.2357 0.9238 1495820 IFLab1_004150 O=C(CSc1nc2ccccc2c(=O)[nH]1)NCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M15 compound treatment 0.053 -0.00548 -0.35 0.055 -0.00562 -0.39 -0.5275 -0.9986 1053080 IFLab1_004151 OC(C(O)c1ccccc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M16 compound treatment 0.083 0.0245 1.58 0.082 0.0214 1.49 2.1717 0.9996 2067825 IFLab1_004152 COC(=O)c1ccc(CSC(=S)N(C)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M17 compound treatment 0.083 0.0245 1.58 0.084 0.0234 1.63 2.2705 0.9999 1189581 IFLab1_004153 CC(=O)Nc1ccc(c(c1)C(=O)O)n2c(C)ccc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M18 compound treatment 0.067 0.00852 0.55 0.066 0.00537 0.38 0.6531 0.983 2067826 IFLab1_004154 Fc1ccc(cc1)C(=O)CC(c2cccs2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M19 compound treatment 0.046 -0.0125 -0.8 0.055 -0.00562 -0.39 -0.846 -0.9459 1393870 IFLab1_004155 Oc1c(C(=O)Nc2nccs2)c(=O)[nH]c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M20 compound treatment 0.054 -0.00448 -0.29 0.051 -0.00962 -0.67 -0.6795 -0.9287 2067827 IFLab1_004156 CNC(=O)/C=C/c1cccc(c1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M21 compound treatment 0.054 -0.00448 -0.29 0.059 -0.00162 -0.11 -0.2843 -0.9169 2067828 IFLab1_004157 CC(C)n1c(CCCO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M22 compound treatment 0.053 -0.00548 -0.35 0.059 -0.00162 -0.11 -0.3299 -0.8896 2067829 IFLab1_004158 COC(=O)c1ccc(cc1)N2C(=O)/C(=C\c3cccnc3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M23 mock treatment 0.054 -0.00448 -0.29 0.057 -0.00363 -0.25 -0.3831 -0.9979 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 M24 mock treatment 0.059 5.16E-4 0.03 0.056 -0.00462 -0.32 -0.205 -0.6311 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N01 compound treatment 0.214 0.156 10.01 0.471 0.41 28.67 27.3498 0.9007 2067830 IFLab1_004159 Clc1ccc(cc1)C(=O)N2CCCCCC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N02 compound treatment 0.071 0.0125 0.81 0.072 0.0114 0.79 1.1316 1.0 2067831 IFLab1_004160 CCc1ccc(/C=C/2\SC(=S)N(CCC(=O)NCCCN3CCOCC3)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N03 compound treatment 0.074 0.0155 1.0 0.072 0.0114 0.79 1.2681 0.9936 2067832 IFLab1_004161 COc1ccc(/C=C/2\CN(C)C/C(=C/c3ccc(OC)c(OC)c3)/C2=O)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N04 compound treatment 0.703 0.645 41.48 0.664 0.603 42.15 59.1395 1.0 1742089 IFLab1_004162 COC(=O)c1sc2ccccc2c1NC(=O)c3ccc4OCCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N05 compound treatment 0.138 0.0795 5.12 0.132 0.0714 4.99 7.1448 0.9999 2067833 IFLab1_004163 O=C(CSc1ncnc2sc3CCCCc3c12)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N06 compound treatment 0.066 0.00752 0.48 0.073 0.0124 0.86 0.9534 0.9624 1592722 IFLab1_004164 CCOc1ccc2n3C(=O)CC(Sc3nc2c1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N07 compound treatment 0.067 0.00852 0.55 0.067 0.00638 0.45 0.7025 0.9947 1324779 IFLab1_004165 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)N2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N08 compound treatment 0.067 0.00852 0.55 0.065 0.00438 0.31 0.6037 0.9619 1404106 IFLab1_004166 O=C1CC(Sc2nc(nn12)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N09 compound treatment 0.073 0.0145 0.93 0.077 0.0164 1.14 1.4696 0.995 1330345 IFLab1_004167 CC(C)(C)NC1C(NS(=O)(=O)c2ccccc2)c3cccc4cccc1c34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N10 compound treatment 0.071 0.0125 0.81 0.065 0.00438 0.31 0.7858 0.912 1362202 IFLab1_004168 Cc1cc(C)n(n1)C(=O)CCNC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N11 compound treatment 0.059 5.16E-4 0.03 0.067 0.00638 0.45 0.3384 0.7577 1475361 IFLab1_004169 C(Sc1nc2ccccc2o1)c3cn4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N12 compound treatment 0.063 0.00452 0.29 0.074 0.0134 0.93 0.8662 0.8852 1562660 IFLab1_004170 CCCc1n[nH]c2OC(=C(C#N)C(C3CCC=CC3)c12)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N13 compound treatment 0.094 0.0355 2.29 0.078 0.0174 1.21 2.4747 0.9561 1272545 IFLab1_004171 COc1ccc(cc1OC)c2ncc3ccccn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N14 compound treatment 0.069 0.0105 0.68 0.059 -0.00162 -0.11 0.3983 0.5804 1158072 IFLab1_004172 CC1=C(C(C(=C(N1)SCC(=O)N)C#N)c2cccs2)C(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N15 compound treatment 0.059 5.16E-4 0.03 0.056 -0.00462 -0.32 -0.205 -0.6311 1297657 IFLab1_004173 CC1(C)C(OCC(O)CN2CCN(CC2)c3ccccc3F)C4(C)CCC1C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N16 compound treatment 0.062 0.00352 0.23 0.064 0.00338 0.24 0.3267 0.9998 1609604 IFLab1_004174 Nc1nc(SC2CCCCC2=O)c(C#N)c(c1C#N)c3ccc(O)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N17 compound treatment 0.054 -0.00448 -0.29 0.054 -0.00662 -0.46 -0.5313 -0.9742 1361801 IFLab1_004175 CCOC(=O)N1CCN(CC(O)COc2ccccc2CC=C)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N18 compound treatment 0.056 -0.00248 -0.16 0.063 0.00237 0.17 0.0043 0.0185 1452225 IFLab1_004176 CCOc1ccc(cc1)c2nc3ccc(C)cc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N19 compound treatment 0.058 -4.84E-4 -0.03 0.062 0.00137 0.1 0.0459 0.4545 1481685 IFLab1_004177 CCc1ccc(OCC(O)CN2CCN(Cc3ccc4OCOc4c3)CC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N20 compound treatment 0.061 0.00252 0.16 0.06 -6.25E-4 -0.04 0.0836 0.4987 2067834 IFLab1_004178 Clc1cccc(c1)C(=O)Sc2nnnn2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N21 compound treatment 0.074 0.0155 1.0 0.073 0.0124 0.86 1.3175 0.9974 1166709 IFLab1_004179 COc1ccc(CCNC(=O)CSc2nc(N)c3c(C)c(C)sc3n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N22 compound treatment 0.567 0.509 32.73 0.499 0.438 30.62 44.799 0.9994 2067835 IFLab1_004180 CCSc1nnc2sc3ccccc3n12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N23 mock treatment 0.052 -0.00648 -0.42 0.06 -6.25E-4 -0.04 -0.326 -0.7768 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 N24 mock treatment 0.055 -0.00348 -0.22 0.062 0.00137 0.1 -0.0906 -0.3715 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O01 compound treatment 0.548 0.49 31.51 0.747 0.686 47.95 56.1851 0.9793 1589629 IFLab1_004181 CCOC(=O)c1oc2ccccc2c1NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O02 compound treatment 0.063 0.00452 0.29 0.067 0.00638 0.45 0.5205 0.9786 1289953 IFLab1_004182 CCc1nc2ccccc2n1C(=O)c3ccccc3C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O03 compound treatment 0.16 0.102 6.53 0.233 0.172 12.04 13.1353 0.9587 2067836 IFLab1_004183 CCOC(=O)c1oc2ccccc2c1NC(=O)CCSc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O04 compound treatment 0.062 0.00352 0.23 0.063 0.00237 0.17 0.2774 0.9884 2067837 IFLab1_004184 CCCn1c(nc2ccccc12)c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O05 compound treatment 0.06 0.00152 0.1 0.06 -6.25E-4 -0.04 0.0381 0.3567 1731872 IFLab1_004185 COc1ccc(NC(=O)C2(CCC3(C)C(=O)O2)C3(C)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O06 compound treatment 0.069 0.0105 0.68 0.064 0.00338 0.24 0.6453 0.9004 1148178 IFLab1_004186 OP(=O)(c1nc2CCCCc2s1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O07 compound treatment 0.063 0.00452 0.29 0.069 0.00838 0.59 0.6193 0.9479 1428100 IFLab1_004187 CC1(C)C2(C)CCC1(CC2=O)C(=O)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O08 compound treatment 0.052 -0.00648 -0.42 0.05 -0.0106 -0.74 -0.82 -0.9629 2067838 IFLab1_004188 CC(=O)Nc1ccc(/N=C/c2ccc(OC(=O)c3cccnc3)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O09 compound treatment 0.067 0.00852 0.55 0.074 0.0134 0.93 1.0483 0.9677 1699037 IFLab1_004189 O=C(c1ccco1)c2ncc[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O10 compound treatment 0.061 0.00252 0.16 0.059 -0.00162 -0.11 0.0342 0.1731 1168461 IFLab1_004190 OC1CSC(=S)N1Cc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O11 compound treatment 0.057 -0.00148 -0.1 0.058 -0.00263 -0.18 -0.1972 -0.9538 1285740 IFLab1_004191 C(Cc1nc2ccccc2s1)c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O12 compound treatment 1.329 1.27 81.78 1.206 1.15 80.02 114.4045 0.9999 1593851 IFLab1_004192 CCOC(=O)c1sc(Nc2ccccc2)nc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O13 compound treatment 0.053 -0.00548 -0.35 0.058 -0.00263 -0.18 -0.3793 -0.9535 1231987 IFLab1_004193 COc1ccc2cc(Br)ccc2c1CC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O14 compound treatment 0.059 5.16E-4 0.03 0.062 0.00137 0.1 0.0914 0.8994 1572467 IFLab1_004194 COC(=O)c1ccc(CSc2nc3ccccc3c(=O)[nH]2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O15 compound treatment 0.056 -0.00248 -0.16 0.057 -0.00363 -0.25 -0.2921 -0.9754 2067839 IFLab1_004195 COC(=O)CC1SCCNC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O16 compound treatment 0.053 -0.00548 -0.35 0.056 -0.00462 -0.32 -0.4781 -0.999 2067840 IFLab1_004196 COC(=O)c1ccc(CSC(=N)N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O17 compound treatment 0.054 -0.00448 -0.29 0.058 -0.00263 -0.18 -0.3337 -0.976 1621447 IFLab1_004197 Nc1ccc(cc1)C2(CC3CC4CC(C3)C2)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O18 compound treatment 0.05 -0.00848 -0.55 0.054 -0.00662 -0.46 -0.7134 -0.9966 2067841 IFLab1_004198 Clc1ccc(cc1)C(=O)CC(c2ccco2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O19 compound treatment 0.057 -0.00148 -0.1 0.054 -0.00662 -0.46 -0.3948 -0.8354 2067842 IFLab1_004199 C(Sc1nc2ccccc2[nH]1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O20 compound treatment 0.06 0.00152 0.1 0.066 0.00537 0.38 0.3345 0.8622 2067843 IFLab1_004200 O=C(/N=C/1\SCC(=O)N1c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O21 compound treatment 0.056 -0.00248 -0.16 0.066 0.00537 0.38 0.1525 0.3736 1090872 IFLab1_004201 OC(=O)c1ccccc1c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O22 compound treatment 0.402 0.344 22.11 0.347 0.286 20.01 29.7809 0.9988 2067844 IFLab1_004202 Cc1ccc(cc1)c2csc3ncnc(SCCC(=O)O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O23 mock treatment 0.057 -0.00148 -0.1 0.064 0.00338 0.24 0.0992 0.3899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 O24 mock treatment 0.06 0.00152 0.1 0.067 0.00638 0.45 0.3839 0.8421 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P01 compound treatment 0.068 0.00952 0.61 0.065 0.00438 0.31 0.6492 0.9484 1639547 IFLab1_004203 CC1CN(CCC(=O)Nc2ccc3OCCOc3c2)CC(C)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P02 compound treatment 0.094 0.0355 2.29 0.112 0.0514 3.59 4.1543 0.9763 1517519 IFLab1_004204 CC(C)(C)c1csc(NC(=O)c2ccc3OCCOc3c2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P03 compound treatment 0.074 0.0155 1.0 0.082 0.0214 1.49 1.7621 0.9809 1499175 IFLab1_004205 CCN(CC)C(=S)SC1CCCCN(C(=O)c2ccc(F)cc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P04 compound treatment 0.07 0.0115 0.74 0.077 0.0164 1.14 1.333 0.9779 1662741 IFLab1_004206 CCOC(=O)c1sc2ccccc2c1NC(=O)c3coc4ccccc4c3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P05 compound treatment 0.074 0.0155 1.0 0.075 0.0144 1.0 1.4163 1.0 1611338 IFLab1_004207 COc1ccc(cc1NC(=O)C)S(=O)(=O)Cc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P06 compound treatment 0.072 0.0135 0.87 0.069 0.00838 0.59 1.0289 0.9814 1678592 IFLab1_004208 COc1ccc(cc1C(=O)O)S(=O)(=O)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P07 compound treatment 0.075 0.0165 1.06 0.078 0.0174 1.21 1.61 0.9978 1717784 IFLab1_004209 Cc1cc(NC(=O)c2ccc(cc2)C(=O)c3ccccc3)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P08 compound treatment 0.065 0.00652 0.42 0.061 3.75E-4 0.03 0.3151 0.7498 1170257 IFLab1_004210 O=C(NCc1ccc2OCOc2c1)C3(CC3)S(=O)(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P09 compound treatment 0.087 0.0285 1.84 0.09 0.0294 2.05 2.7489 0.9985 1480904 IFLab1_004211 CC(C)(C)c1ccc(NC(=O)C2CCCCN2S(=O)(=O)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P10 compound treatment 0.058 -4.84E-4 -0.03 0.06 -6.25E-4 -0.04 -0.0529 -0.9863 1608487 IFLab1_004212 CCOC(=O)C1=C(OC(=C(C#N)C1CC(C)C)N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P11 compound treatment 0.065 0.00652 0.42 0.058 -0.00263 -0.18 0.1669 0.3646 1518616 IFLab1_004213 Clc1cccc(NCc2cn3ccccc3n2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P12 compound treatment 0.063 0.00452 0.29 0.064 0.00338 0.24 0.3723 0.9946 2067845 IFLab1_004214 CCC(C)C1C(=C(N)Oc2[nH]nc(C)c12)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P13 compound treatment 0.073 0.0145 0.93 0.076 0.0154 1.07 1.4202 0.9976 1065279 IFLab1_004215 CN1CCN(Cc2cc(Cl)c3cccnc3c2O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P14 compound treatment 0.068 0.00952 0.61 0.065 0.00438 0.31 0.6492 0.9484 1599312 IFLab1_004216 CC1=C(C(C(=C(N1)SCC(=O)O)C#N)c2cccs2)C(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P15 compound treatment 0.057 -0.00148 -0.1 0.063 0.00237 0.17 0.0498 0.2601 1350007 IFLab1_004217 OC(COc1ccccc1CC=C)CN2CCN(CC2)c3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P16 compound treatment 0.068 0.00952 0.61 0.065 0.00438 0.31 0.6492 0.9484 1151769 IFLab1_004218 N#CC(=C1CCCC1)c2nc(cs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P17 compound treatment 0.059 5.16E-4 0.03 0.058 -0.00263 -0.18 -0.1062 -0.5697 1573234 IFLab1_004219 CCOC(=O)N1CCN(CC(O)COc2ccc(cc2)C3CCCCC3)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P18 compound treatment 0.059 5.16E-4 0.03 0.06 -6.25E-4 -0.04 -0.0074 -0.1346 2067846 IFLab1_004220 Cc1ccc2nc(NC(=O)c3ccccc3C(=O)O)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P19 compound treatment 0.061 0.00252 0.16 0.067 0.00638 0.45 0.4294 0.9062 1192690 IFLab1_004221 OC(=O)c1cccc(c1)c2ccc(O)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P20 compound treatment 0.048 -0.0105 -0.67 0.051 -0.00962 -0.67 -0.9526 -1.0 1585548 IFLab1_004222 COc1cccc(c1)C(=O)SC2=NCCS2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P21 compound treatment 0.062 0.00352 0.23 0.059 -0.00162 -0.11 0.0798 0.315 2067847 IFLab1_004223 Cc1sc2nc(SCC(=O)NCCO)nc(N)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P22 compound treatment 0.069 0.0105 0.68 0.069 0.00838 0.59 0.8923 0.9974 1284329 IFLab1_004224 O=C(Oc1ccc2c3CCCCc3c(=O)oc2c1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P23 mock treatment 0.064 0.00552 0.36 0.066 0.00537 0.38 0.5166 0.9996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1423 P24 mock treatment 0.062 0.00352 0.23 0.057 -0.00363 -0.25 -0.019 -0.0561 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A01 compound treatment 0.092 -0.00194 -0.12 0.076 -0.00172 -0.12 -0.1731 -0.9998 1612472 IFLab1_004225 Cc1ccc(cc1)C(=O)Oc2ccc3c4CCCCc4c(=O)oc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A02 compound treatment 0.123 0.0291 1.87 0.089 0.0113 0.79 1.88 0.9262 1493512 IFLab1_004226 Cc1ccccc1CN2C(=O)C(O)(CC(=O)c3ccc(N)cc3)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A03 compound treatment 0.09 -0.00394 -0.25 0.08 0.00228 0.16 -0.0665 -0.2222 1393816 IFLab1_004227 COc1ccc(cc1OC)C(=O)Oc2ccc3oc(=O)sc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A04 compound treatment 0.116 0.0221 1.42 0.107 0.0293 2.05 2.4506 0.9841 2067848 IFLab1_004228 NS(=O)(=O)c1cc(ccc1F)C(=O)Nc2cccc(c2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A05 compound treatment 0.099 0.00506 0.33 0.085 0.00728 0.51 0.5901 0.9768 2067849 IFLab1_004229 Cc1ccc(cc1)S(=O)(=O)/N=C(/N)\c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A06 compound treatment 0.098 0.00406 0.26 0.081 0.00328 0.23 0.347 0.9978 1141228 IFLab1_004230 Cc1cccc(c1)n2cnc3cc(ccc23)C(=O)NCCN4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A07 compound treatment 0.091 -0.00294 -0.19 0.088 0.0103 0.72 0.3742 0.5038 1004437 IFLab1_004231 Nc1ccc(cc1)c2ccc(N)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A08 compound treatment 0.241 0.147 9.47 0.187 0.109 7.63 12.0916 0.9943 2067850 IFLab1_004232 Fc1ccccc1CSCCC(=O)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A09 compound treatment 0.079 -0.0149 -0.96 0.081 0.00328 0.23 -0.5178 -0.5238 2067851 IFLab1_004233 CCCn1c(CCCNC(=O)c2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A10 compound treatment 0.087 -0.00694 -0.45 0.079 0.00128 0.09 -0.2525 -0.5543 1320853 IFLab1_004234 CN(C)c1ccc(cc1)C2C(=C(C)NC3=C2C(=O)CC(C)(C)C3)C(=O)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A11 compound treatment 0.05 -0.0439 -2.83 0.049 -0.0287 -2.01 -3.4184 -0.9859 2067852 IFLab1_004235 CC(C)Cc1nc2ccccc2n1CC(=C)Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A12 compound treatment 0.056 -0.0379 -2.44 0.054 -0.0237 -1.66 -2.8983 -0.9822 1356380 IFLab1_004236 CC1CCN(CC1)c2nc(C)nc3sc(C(=O)N4CCOCC4)c(C)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A13 compound treatment 0.043 -0.0509 -3.28 0.044 -0.0337 -2.36 -3.984 -0.9868 1777377 IFLab1_004237 OC(=O)C1CCCN1S(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A14 compound treatment 0.053 -0.0409 -2.63 0.052 -0.0257 -1.8 -3.1336 -0.9826 1213553 IFLab1_004238 CN(C)c1ccc(cc1)C(O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A15 compound treatment 0.178 0.0841 5.41 0.12 0.0423 2.95 5.9146 0.9595 2067853 IFLab1_004239 CCOC(=O)CSc1nc(C)c2ccc(C)cc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A16 compound treatment 0.083 -0.0109 -0.7 0.069 -0.00872 -0.61 -0.9285 -0.9974 2067854 IFLab1_004240 Cc1cccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)/SC2=S)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A17 compound treatment 0.16 0.0661 4.25 0.07 -0.00772 -0.54 2.6254 0.6125 1585819 IFLab1_004241 Cc1ccccc1NC(=O)CSc2nc3ccc(N)cc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A18 compound treatment 0.078 -0.0159 -1.03 0.061 -0.0167 -1.17 -1.5512 -0.9979 2067855 IFLab1_004242 Brc1cccc(/N=C/c2ccc(OC(=O)c3ccccn3)cc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A19 compound treatment 0.108 0.0141 0.91 0.088 0.0103 0.72 1.1479 0.9934 1213026 IFLab1_004243 CCC(C)NS(=O)(=O)c1cccc2nsnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A20 compound treatment 0.099 0.00506 0.33 0.092 0.0143 1.0 0.9359 0.8917 1179632 IFLab1_004244 Cc1sc2nc(SC3CCOC3=O)[nH]c(=O)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A21 compound treatment 0.105 0.0111 0.71 0.087 0.00928 0.65 0.962 0.9989 1582509 IFLab1_004245 CCCOc1ccc(cc1OC)C(=O)NCC2COc3ccccc3O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A22 compound treatment 0.079 -0.0149 -0.96 0.07 -0.00772 -0.54 -1.0611 -0.9626 1015772 IFLab1_004246 OCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A23 mock treatment 0.089 -0.00494 -0.32 0.068 -0.00972 -0.68 -0.7048 -0.9402 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 A24 mock treatment 0.085 -0.00894 -0.58 0.08 0.00228 0.16 -0.2941 -0.4927 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B01 compound treatment 0.115 0.0211 1.36 0.099 0.0213 1.49 2.0099 0.9989 2067856 IFLab1_004247 COc1ccc(cc1)c2nnc(SCC(=O)c3ccc(Cl)cc3)[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B02 compound treatment 0.165 0.0711 4.57 0.126 0.0483 3.37 5.6193 0.9888 1595456 IFLab1_004248 CCC(CO)NCC(O)CN1c2ccccc2Sc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B03 compound treatment 0.14 0.0461 2.96 0.103 0.0253 1.77 3.3453 0.9694 2067857 IFLab1_004249 Cc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)N2CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B04 compound treatment 0.086 -0.00794 -0.51 0.07 -0.00772 -0.54 -0.7426 -0.9996 1435499 IFLab1_004250 Cc1nc2ccccc2n1CC(O)COc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B05 compound treatment 0.18 0.0861 5.54 0.143 0.0653 4.56 7.1417 0.9953 2067858 IFLab1_004251 Cc1ccc(SCC(=O)N2CCCCC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B06 compound treatment 0.101 0.00706 0.45 0.095 0.0173 1.21 1.1751 0.9109 1629445 IFLab1_004252 OCc1nc2ccccc2n1CC(O)COc3ccc(OCc4ccccc4)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B07 compound treatment 0.216 0.122 7.86 0.125 0.0473 3.3 7.891 0.9259 1490604 IFLab1_004253 CCOC(=O)N1CCN(CC1)C(=O)CSc2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B08 compound treatment 0.093 -9.37E-4 -0.06 0.083 0.00528 0.37 0.2182 0.5837 1513930 IFLab1_004254 Clc1ccc(OC(=O)N2CCCCC2)c3ncccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B09 compound treatment 0.198 0.104 6.7 0.125 0.0473 3.3 7.0718 0.9469 1565645 IFLab1_004255 Fc1ccc(NC(=O)CSC2CCCCC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B10 compound treatment 0.089 -0.00494 -0.32 0.072 -0.00572 -0.4 -0.5072 -0.9936 2067859 IFLab1_004256 CCOC(=O)N=c1oc2ccccc2o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B11 compound treatment 0.068 -0.0259 -1.67 0.066 -0.0117 -0.82 -1.7594 -0.9462 1329469 IFLab1_004257 O=C(CSCc1ccco1)Nc2nccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B12 compound treatment 0.093 -9.37E-4 -0.06 0.042 -0.0357 -2.5 -1.8071 -0.724 2067860 IFLab1_004258 CCOC(=O)Cc1nc(O)cs1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B13 compound treatment 0.043 -0.0509 -3.28 0.038 -0.0397 -2.77 -4.2804 -0.9966 2067861 IFLab1_004259 Oc1c(Br)cc(Br)cc1/C=N/c2ccccc2F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B14 compound treatment 0.044 -0.0499 -3.21 0.045 -0.0327 -2.29 -3.8891 -0.986 1601596 IFLab1_004260 Clc1cc2CN(COc2c3ncccc13)C4CCS(=O)(=O)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B15 compound treatment 0.093 -9.37E-4 -0.06 0.066 -0.0117 -0.82 -0.6216 -0.7572 1602324 IFLab1_004261 COc1ccc2oc(=O)c(cc2c1)C(=O)NC3=C(CCC3)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B16 compound treatment 0.068 -0.0259 -1.67 0.06 -0.0177 -1.24 -2.0558 -0.9892 1586226 IFLab1_004262 COc1ccc(OCC(O)CN2CCc3ccccc3C2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B17 compound treatment 0.115 0.0211 1.36 0.087 0.00928 0.65 1.4171 0.943 1918439 IFLab1_004263 CCOc1ccc(/N=C/c2ccc(cc2O)N(CC)CC)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B18 compound treatment 0.077 -0.0169 -1.09 0.069 -0.00872 -0.61 -1.2016 -0.9622 1291626 IFLab1_004264 O=S(=O)(NC1CCCCC1NCc2ccco2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B19 compound treatment 0.09 -0.00394 -0.25 0.08 0.00228 0.16 -0.0665 -0.2222 1722803 IFLab1_004265 COc1ccc(c2ccccc12)S(=O)(=O)NCc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B20 compound treatment 0.107 0.0131 0.84 0.087 0.00928 0.65 1.053 0.9918 1200025 IFLab1_004266 Brc1ccc(cc1)C2C3=C(CCCC3=O)Nc4ncnn24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B21 compound treatment 0.096 0.00206 0.13 0.079 0.00128 0.09 0.1572 0.9816 1376706 IFLab1_004267 COc1ccc(OC)c(c1)S(=O)(=O)NC(C)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B22 compound treatment 0.075 -0.0189 -1.22 0.073 -0.00472 -0.33 -1.095 -0.8672 1417127 IFLab1_004268 COc1ccccc1NC(=O)c2c(C)nc3ccccc3c2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B23 mock treatment 0.104 0.0101 0.65 0.085 0.00728 0.51 0.8177 0.9929 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 B24 mock treatment 0.093 -9.37E-4 -0.06 0.075 -0.00272 -0.19 -0.177 -0.888 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C01 compound treatment 0.086 -0.00794 -0.51 0.077 -7.19E-4 -0.05 -0.3968 -0.7729 2067862 IFLab1_004269 CN(C)C(C#N)c1c[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C02 compound treatment 0.118 0.0241 1.55 0.089 0.0113 0.79 1.6524 0.9509 1399619 IFLab1_004270 Cc1ccc(cc1NC(=O)c2ccc(F)cc2)c3nc4ncccc4o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C03 compound treatment 0.162 0.0681 4.38 0.11 0.0323 2.26 4.6924 0.9523 1145310 IFLab1_004271 COC(=O)c1c(C)n2CCCc2c1C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C04 compound treatment 0.201 0.107 6.89 0.179 0.101 7.08 9.8759 0.9999 1401068 IFLab1_004272 Cc1ccc(NC(=O)c2ccc(F)c(c2)S(=O)(=O)N3CCCC3)cc1F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C05 compound treatment 0.092 -0.00194 -0.12 0.085 0.00728 0.51 0.2715 0.5184 1244776 IFLab1_004273 CC(C)(C)C(=O)NS(=O)(=O)c1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C06 compound treatment 0.066 -0.0279 -1.8 0.057 -0.0207 -1.45 -2.295 -0.9942 1257119 IFLab1_004274 Cc1cccc(c1)n2cnc3cc(ccc23)C(=O)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C07 compound treatment 0.17 0.0761 4.9 0.122 0.0443 3.09 5.6492 0.9755 1221558 IFLab1_004275 COc1ccccc1N2CCN(Cc3cc(Cl)c(O)c4ncccc34)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C08 compound treatment 0.259 0.165 10.62 0.169 0.0913 6.38 12.0216 0.9702 1215843 IFLab1_004276 COc1ccc(CNC(=O)CSCc2ccccc2F)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C09 compound treatment 0.153 0.0591 3.8 0.105 0.0273 1.91 4.0358 0.949 2067863 IFLab1_004277 C1COc2cc(ccc2O1)C3=Nn4cnnc4SC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C10 compound treatment 0.091 -0.00294 -0.19 0.072 -0.00572 -0.4 -0.4162 -0.9416 1311268 IFLab1_004278 CC1=C(C(C2=C(CCCC2=O)N1)c3c(F)cccc3Cl)C(=O)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C11 compound treatment 0.065 -0.0289 -1.86 0.054 -0.0237 -1.66 -2.4887 -0.9983 2067864 IFLab1_004279 CC(C)c1nc2ccccc2n1CC(=C)Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C12 compound treatment 0.067 -0.0269 -1.73 0.062 -0.0157 -1.1 -2.0025 -0.9757 1436807 IFLab1_004280 CCCNC(=O)c1ccc2n(cnc2c1)c3ccccc3OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C13 compound treatment 0.045 -0.0489 -3.15 0.042 -0.0357 -2.5 -3.9917 -0.9933 1247600 IFLab1_004281 O=c1oc(nc2ccccc12)c3ccc(cc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C14 compound treatment 0.063 -0.0309 -1.99 0.056 -0.0217 -1.52 -2.4809 -0.991 1851046 IFLab1_004282 OCc1ccc(O)c2ncccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C15 compound treatment 0.071 -0.0229 -1.48 0.068 -0.00972 -0.68 -1.524 -0.9379 1133645 IFLab1_004283 COC(=O)CC1(O)N(Cc2ccccc2)C(=O)c3ccccc31 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C16 compound treatment 0.137 0.0431 2.77 0.098 0.0203 1.42 2.9618 0.9515 2067865 IFLab1_004284 COc1ccc(/C=C/2\SC(=S)N(CCC(=O)N(Cc3ccccc3)C(C)(C)C)C2=O)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C17 compound treatment 0.173 0.0791 5.09 0.157 0.0793 5.54 7.5147 0.9991 1667144 IFLab1_004285 O=C(c1ccco1)c2nnn(Cc3ccccc3)c2c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C18 compound treatment 0.08 -0.0139 -0.9 0.058 -0.0197 -1.38 -1.6084 -0.9784 2067866 IFLab1_004286 Brc1cccc(/N=C/c2ccc(OC(=O)c3ccncc3)cc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C19 compound treatment 0.264 0.17 10.95 0.215 0.137 9.59 14.5215 0.9978 1580942 IFLab1_004287 COc1ccccc1CNC(=O)c2cc(ccc2F)S(=O)(=O)N3CCCC(C)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C20 compound treatment 0.11 0.0161 1.03 0.076 -0.00172 -0.12 0.6461 0.6208 1053978 IFLab1_004288 OC(=O)CCNc1ccccc1C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C21 compound treatment 0.145 0.0511 3.29 0.135 0.0573 4.0 5.1536 0.9952 1151524 IFLab1_004289 Brc1ccccc1C(=O)NCC2OCCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C22 compound treatment 0.126 0.0321 2.06 0.1 0.0223 1.56 2.5599 0.9903 1377098 IFLab1_004290 Oc1nc2ccccc2nc1Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C23 mock treatment 0.089 -0.00494 -0.32 0.074 -0.00372 -0.26 -0.4084 -0.995 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 C24 mock treatment 0.077 -0.0169 -1.09 0.073 -0.00472 -0.33 -1.004 -0.8815 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D01 compound treatment 0.122 0.0281 1.81 0.086 0.00828 0.58 1.6863 0.8891 1642800 IFLab1_004291 O=S(=O)(NC1CCS(=O)(=O)C1)c2cccc3cccnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D02 compound treatment 0.075 -0.0189 -1.22 0.067 -0.0107 -0.75 -1.3914 -0.9726 1578807 IFLab1_004292 OCCN1CCN(CC1)C(=O)CSc2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D03 compound treatment 0.067 -0.0269 -1.73 0.057 -0.0207 -1.45 -2.2495 -0.996 1428593 IFLab1_004293 Cc1cc(=O)cc(C)n1c2ccc(O)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D04 compound treatment 0.105 0.0111 0.71 0.09 0.0123 0.86 1.1102 0.9957 2067867 IFLab1_004294 CC(C)c1cc(C(C)C)c(cc1NC(=O)C)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D05 compound treatment 0.344 0.25 16.1 0.227 0.149 10.43 18.7553 0.9779 2067868 IFLab1_004295 O=C(CSC1CCCCC1)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D06 compound treatment 0.107 0.0131 0.84 0.081 0.00328 0.23 0.7566 0.8682 1118201 IFLab1_004296 CC(=O)N1CCN(CC(O)COc2ccc(OCc3ccccc3)cc2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D07 compound treatment 0.094 6.25E-5 0.0 0.074 -0.00372 -0.26 -0.1809 -0.6961 1708765 IFLab1_004297 O=C(CSC1=NCCS1)N2CCC(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D08 compound treatment 0.092 -0.00194 -0.12 0.069 -0.00872 -0.61 -0.5189 -0.8346 1204115 IFLab1_004298 CN(C)C(=O)Oc1ccc(Cl)c2cccnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D09 compound treatment 0.139 0.0451 2.9 0.098 0.0203 1.42 3.0528 0.9457 1712972 IFLab1_004299 COc1ccc(NC(=O)CSC2=NCCS2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D10 compound treatment 0.155 0.0611 3.93 0.084 0.00628 0.44 3.0894 0.7812 2067869 IFLab1_004300 C/C(=C\c1ccccc1)/C=C/2\SC(=S)N(CCC(=O)Nc3ccccc3O)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D11 compound treatment 0.093 -9.37E-4 -0.06 0.072 -0.00572 -0.4 -0.3252 -0.8048 2067870 IFLab1_004301 O=C(CSC1=NCCS1)Nc2nccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D12 compound treatment 0.17 0.0761 4.9 0.101 0.0233 1.63 4.6119 0.894 1198909 IFLab1_004302 Oc1c(ccc2cccnc12)C(N3CCCC3)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D13 compound treatment 0.097 0.00306 0.2 0.075 -0.00272 -0.19 0.0051 0.0186 2067871 IFLab1_004303 Oc1ccc(/C=N\c2sc3CCCCc3c2C#N)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D14 compound treatment 0.074 -0.0199 -1.28 0.058 -0.0197 -1.38 -1.8815 -0.9994 1184389 IFLab1_004304 OC(COc1ccc2CCCc2c1)CN3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D15 compound treatment 0.089 -0.00494 -0.32 0.078 2.81E-4 0.02 -0.2108 -0.6621 1344107 IFLab1_004305 Fc1ccc(NC(=O)c2cc3cc(Cl)cc(Cl)c3oc2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D16 compound treatment 0.094 6.25E-5 0.0 0.078 2.81E-4 0.02 0.0167 0.8346 1623111 IFLab1_004306 CC(C)n1c(NCCO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D17 compound treatment 0.097 0.00306 0.2 0.077 -7.19E-4 -0.05 0.1039 0.5107 1208439 IFLab1_004307 COc1cccc2cc(C(=O)N3CCCc4ccccc34)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D18 compound treatment 0.107 0.0131 0.84 0.081 0.00328 0.23 0.7566 0.8682 1445043 IFLab1_004308 CN(C)C1CCCCC1NS(=O)(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D19 compound treatment 0.096 0.00206 0.13 0.086 0.00828 0.58 0.503 0.8473 1647688 IFLab1_004309 COc1ccc(c2ccccc12)S(=O)(=O)Nc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D20 compound treatment 0.094 6.25E-5 0.0 0.076 -0.00172 -0.12 -0.0821 -0.683 1587839 IFLab1_004310 Fc1ccccc1C2C3=C(CCCC3=O)Nc4ncnn24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D21 compound treatment 0.096 0.00206 0.13 0.075 -0.00272 -0.19 -0.0404 -0.1745 1133679 IFLab1_004311 CCOc1ccc(cc1)S(=O)(=O)N2CCN(CC2)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D22 compound treatment 0.203 0.109 7.02 0.164 0.0863 6.03 9.2259 0.9971 1219904 IFLab1_004312 CCOc1cc2SCC(=O)Nc2cc1C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D23 mock treatment 0.103 0.00906 0.58 0.088 0.0103 0.72 0.9203 0.9947 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 D24 mock treatment 0.085 -0.00894 -0.58 0.067 -0.0107 -0.75 -0.9363 -0.9915 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E01 compound treatment 0.172 0.0781 5.02 0.097 0.0193 1.35 4.5053 0.8661 1512753 IFLab1_004313 COc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)N4CCCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E02 compound treatment 0.102 0.00806 0.52 0.078 2.81E-4 0.02 0.3808 0.7334 1169697 IFLab1_004314 Cc1nc2ccc(Cl)cc2c(O)c1CN3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E03 compound treatment 0.14 0.0461 2.96 0.119 0.0413 2.88 4.1357 0.9999 2067872 IFLab1_004315 COC(=O)/C=C/1\SC(=NC1=O)NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E04 compound treatment 0.137 0.0431 2.77 0.113 0.0353 2.46 3.7027 0.9983 1505449 IFLab1_004316 COc1ccccc1NC(=O)c2cc(ccc2F)S(=O)(=O)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E05 compound treatment 0.107 0.0131 0.84 0.087 0.00928 0.65 1.053 0.9918 1650517 IFLab1_004317 OCCNC(=O)c1ccc(CSc2nc3ccccc3c(=O)[nH]2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E06 compound treatment 0.06 -0.0339 -2.18 0.059 -0.0187 -1.31 -2.4693 -0.9699 1690222 IFLab1_004318 Cc1cccc(c1)n2cnc3cc(ccc23)C(=O)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E07 compound treatment 0.101 0.00706 0.45 0.091 0.0133 0.93 0.9775 0.9461 1251542 IFLab1_004319 NC(=O)C1(CC1)S(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E08 compound treatment 0.601 0.507 32.64 0.619 0.541 37.81 49.8163 0.9973 2067873 IFLab1_004320 Fc1cccc(CSCCC(=O)N2CCc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E09 compound treatment 0.267 0.173 11.14 0.139 0.0613 4.28 10.9038 0.9137 2067874 IFLab1_004321 CC(C)(C)c1nnc2SCC(=Nn12)c3ccc(Br)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E10 compound treatment 0.098 0.00406 0.26 0.071 -0.00672 -0.47 -0.147 -0.2736 2067875 IFLab1_004322 Clc1ccccc1CSc2ncccc2C(=O)NCCCN3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E11 compound treatment 0.096 0.00206 0.13 0.078 2.81E-4 0.02 0.1078 0.803 1330239 IFLab1_004323 COC(=O)c1ccc(OCC(O)CN2C(C)(C)CC(O)CC2(C)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E12 compound treatment 0.123 0.0291 1.87 0.082 0.00428 0.3 1.5342 0.8099 1169734 IFLab1_004324 COc1ccc(cc1)n2cnc3cc(ccc23)C(=O)NCc4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E13 compound treatment 0.084 -0.00994 -0.64 0.063 -0.0147 -1.03 -1.1794 -0.9739 1551497 IFLab1_004325 NC(=O)c1ccc(NC(=O)COc2cc(Cl)ccc2Cl)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E14 compound treatment 0.09 -0.00394 -0.25 0.068 -0.00972 -0.68 -0.6593 -0.9097 2067876 IFLab1_004326 CN(C)C(=O)Cc1c[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E15 compound treatment 0.039 -0.0549 -3.54 0.038 -0.0397 -2.77 -4.4624 -0.9928 2067877 IFLab1_004327 O=C1C=CC(=O)N1CC(c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E16 compound treatment 0.082 -0.0119 -0.77 0.066 -0.0117 -0.82 -1.1222 -0.9995 1555179 IFLab1_004328 COc1ccc(OCc2nc3ccccc3n2CC=C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E17 compound treatment 0.094 6.25E-5 0.0 0.078 2.81E-4 0.02 0.0167 0.8346 1719407 IFLab1_004329 NS(=O)(=O)c1cccc(c1)C(=O)N2CCCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E18 compound treatment 0.09 -0.00394 -0.25 0.074 -0.00372 -0.26 -0.3629 -0.9999 2067878 IFLab1_004330 COc1cc(/C=N/c2ccc(NC(=O)C)cc2)ccc1OC(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E19 compound treatment 0.194 0.1 6.44 0.167 0.0893 6.24 8.9645 0.9999 1656405 IFLab1_004331 COc1cccc(CSCC(=O)NCc2ccccc2Cl)c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E20 compound treatment 0.42 0.326 20.99 0.31 0.232 16.23 26.3144 0.9919 2067879 IFLab1_004332 O/N=C/1\C(=O)N(Cc2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E21 compound treatment 0.087 -0.00694 -0.45 0.071 -0.00672 -0.47 -0.6476 -0.9997 1985559 IFLab1_004333 Nc1nc(N)n(n1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E22 compound treatment 0.134 0.0401 2.58 0.11 0.0323 2.26 3.418 0.9978 2067880 IFLab1_004334 COC(=O)c1cccc2/C(=N/O)/C(=O)Nc21 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E23 mock treatment 0.082 -0.0119 -0.77 0.073 -0.00472 -0.33 -0.7764 -0.9286 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 E24 mock treatment 0.081 -0.0129 -0.83 0.075 -0.00272 -0.19 -0.7231 -0.8466 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F01 compound treatment 0.13 0.0361 2.32 0.116 0.0383 2.67 3.5323 0.9975 1326153 IFLab1_004335 COc1ccc(cc1)c2nc3SC(CC(=O)n3n2)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F02 compound treatment 0.134 0.0401 2.58 0.119 0.0413 2.88 3.8626 0.9984 1162856 IFLab1_004336 COc1ccc(cc1)c2cc3ccccc3n2CC(O)CNCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F03 compound treatment 0.087 -0.00694 -0.45 0.076 -0.00172 -0.12 -0.4006 -0.8665 1138912 IFLab1_004337 Cc1cc(=O)cc(C)n1c2ccccc2O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F04 compound treatment 0.088 -0.00594 -0.38 0.079 0.00128 0.09 -0.2069 -0.5272 1439026 IFLab1_004338 OC(COc1ccccc1CC=C)Cn2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F05 compound treatment 0.124 0.0301 1.93 0.077 -7.19E-4 -0.05 1.3327 0.6885 2067881 IFLab1_004339 Cn1cnnc1SCC(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F06 compound treatment 0.127 0.0331 2.13 0.094 0.0163 1.14 2.309 0.9569 1641305 IFLab1_004340 OC(CNCc1ccccc1)Cn2c3CCCCc3c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F07 compound treatment 0.717 0.623 40.1 0.656 0.578 40.4 56.9235 1.0 1306960 IFLab1_004341 O=C(CSC1CCCCC1)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F08 compound treatment 0.063 -0.0309 -1.99 0.07 -0.00772 -0.54 -1.7893 -0.8673 2067882 IFLab1_004342 CCN(CC)C(=O)Oc1ccc2ccccc2c1Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F09 compound treatment 0.305 0.211 13.59 0.175 0.0973 6.8 14.4116 0.9487 1441301 IFLab1_004343 CCOc1ccc(NC(=O)CSC2CCCCC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F10 compound treatment 0.105 0.0111 0.71 0.079 0.00128 0.09 0.5668 0.7898 1317691 IFLab1_004344 Nc1nc(SCC(=O)NCc2ccccn2)nc3sc4CCCCc4c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F11 compound treatment 0.175 0.0811 5.22 0.106 0.0283 1.98 5.0864 0.9117 2067883 IFLab1_004345 CCSc1nnc(NC(=O)CSc2ncccn2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F12 compound treatment 0.152 0.0581 3.74 0.13 0.0523 3.65 5.2252 0.9999 1124758 IFLab1_004346 CC1CCN(CC1)C(c2ccccc2)c3ccc4cccnc4c3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F13 compound treatment 0.051 -0.0429 -2.76 0.046 -0.0317 -2.22 -3.5211 -0.994 2067884 IFLab1_004347 COc1ccc(/N=C/c2cc(Br)ccc2O)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F14 compound treatment 0.088 -0.00594 -0.38 0.065 -0.0127 -0.89 -0.8985 -0.929 1176626 IFLab1_004348 CCN1CCN(CC(O)COc2ccc3CCCc3c2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F15 compound treatment 0.051 -0.0429 -2.76 0.046 -0.0317 -2.22 -3.5211 -0.994 2067885 IFLab1_004349 COc1ccc(O)c(/C=N/c2cc(C)ccn2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F16 compound treatment 0.073 -0.0209 -1.35 0.062 -0.0157 -1.1 -1.7294 -0.9948 1676471 IFLab1_004350 CCCc1nc2ccccc2n1C(=O)CCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F17 compound treatment 0.06 -0.0339 -2.18 0.045 -0.0327 -2.29 -3.1608 -0.9997 2067886 IFLab1_004351 COc1cccc(/C=N/CCN2CCOCC2)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F18 compound treatment 0.084 -0.00994 -0.64 0.076 -0.00172 -0.12 -0.5372 -0.8254 1442728 IFLab1_004352 O=S(=O)(NC1CCCCC1Nc2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F19 compound treatment 0.102 0.00806 0.52 0.082 0.00428 0.3 0.5784 0.9657 1347669 IFLab1_004353 CC(=O)Nc1ccc(NC(=O)C2CC(=CCC2C(=O)O)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F20 compound treatment 0.108 0.0141 0.91 0.08 0.00228 0.16 0.7527 0.819 1571146 IFLab1_004354 COc1ccc(cc1)C2C3=C(CCCC3=O)Nc4ncnn24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F21 compound treatment 0.193 0.0991 6.38 0.118 0.0403 2.81 6.4984 0.9324 1283413 IFLab1_004355 COc1c(Cl)c(Cl)ccc1S(=O)(=O)n2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F22 compound treatment 0.143 0.0491 3.16 0.101 0.0233 1.63 3.383 0.9524 2067887 IFLab1_004356 CCc1cc2c(SCC(=O)c3ccccc3)ncnc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F23 mock treatment 0.087 -0.00694 -0.45 0.078 2.81E-4 0.02 -0.3019 -0.6753 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 F24 mock treatment 0.086 -0.00794 -0.51 0.086 0.00828 0.58 0.0478 0.062 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G01 compound treatment 0.118 0.0241 1.55 0.082 0.00428 0.3 1.3066 0.8284 1263425 IFLab1_004357 COc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)NC(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G02 compound treatment 0.597 0.503 32.38 0.473 0.395 27.61 42.4221 0.9969 1188495 IFLab1_004358 COc1ccc2oc(=O)c(cc2c1)C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G03 compound treatment 0.1 0.00606 0.39 0.079 0.00128 0.09 0.3392 0.8473 1336676 IFLab1_004359 CC(C)(NC(=O)C1Cc2ccccc2CN1S(=O)(=O)c3ccc(F)cc3)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G04 compound treatment 0.373 0.279 17.96 0.123 0.0453 3.16 14.9378 0.819 1214090 IFLab1_004360 CCc1ccc(NC(=O)c2cc(ccc2F)S(=O)(=O)N3CCCCC3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G05 compound treatment 0.181 0.0871 5.6 0.12 0.0423 2.95 6.0511 0.9552 1718943 IFLab1_004361 CCCCn1c(=O)c(C(=O)NC(C)c2ccccc2)c(O)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G06 compound treatment 0.236 0.142 9.14 0.172 0.0943 6.59 11.123 0.987 1471839 IFLab1_004362 Cc1cccc(c1)n2cnc3cc(ccc23)C(=O)NCc4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G07 compound treatment 0.148 0.0541 3.48 0.1 0.0223 1.56 3.5612 0.9342 2067888 IFLab1_004363 CCN1C(=O)/C(=C\c2cc(C)n(c2C)c3ccccc3)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G08 compound treatment 0.608 0.514 33.09 0.52 0.442 30.9 45.2444 0.9994 2067889 IFLab1_004364 Fc1ccccc1CSCCC(=O)N2CCN(CC2)c3cccc(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G09 compound treatment 0.125 0.0311 2.0 0.09 0.0123 0.86 2.0204 0.9287 1246979 IFLab1_004365 C(Sc1nc2ccccc2o1)c3cn4ccsc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G10 compound treatment 0.145 0.0511 3.29 0.101 0.0233 1.63 3.4741 0.9474 1569276 IFLab1_004366 CCOc1ccc(NC(=O)c2sc3nc[nH]c(=O)c3c2C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G11 compound treatment 0.092 -0.00194 -0.12 0.086 0.00828 0.58 0.3209 0.5422 2067890 IFLab1_004367 CC(=O)Nc1ccc(OCC(O)CN2C(C)(C)CC(O)CC2(C)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G12 compound treatment 0.095 0.00106 0.07 0.087 0.00928 0.65 0.5068 0.7774 1123327 IFLab1_004368 CCC(C)NC(=O)c1ccc2n(cnc2c1)c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G13 compound treatment 0.932 0.838 53.94 0.887 0.809 56.54 78.1198 0.9997 2067891 IFLab1_004369 Clc1cc(NC(=O)c2ccc(Br)o2)ccc1N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G14 compound treatment 0.127 0.0331 2.13 0.08 0.00228 0.16 1.6175 0.7579 1520717 IFLab1_004370 O=C(Nc1ncccn1)C2c3ccccc3Oc4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G15 compound treatment 0.165 0.0711 4.57 0.119 0.0413 2.88 5.2735 0.9753 1488402 IFLab1_004371 On1c(=O)c(=O)n(OCc2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G16 compound treatment 0.089 -0.00494 -0.32 0.072 -0.00572 -0.4 -0.5072 -0.9936 1299945 IFLab1_004372 CC(O)c1nc2ccccc2n1Cc3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G17 compound treatment 0.518 0.424 27.29 0.446 0.368 25.73 37.4928 0.9996 1169121 IFLab1_004373 CCOC(=O)c1c(oc2ccc(OCC(=O)N)cc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G18 compound treatment 0.072 -0.0219 -1.41 0.066 -0.0117 -0.82 -1.5773 -0.9664 1361535 IFLab1_004374 CSc1nc(cn1c2ccc(NC(=O)C)cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G19 compound treatment 0.125 0.0311 2.0 0.109 0.0313 2.19 2.959 0.999 1490777 IFLab1_004375 Cc1ccc(cc1Cl)n2c(SCC(=O)c3ccccc3)nc4[nH]ncc4c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G20 compound treatment 0.093 -9.37E-4 -0.06 0.073 -0.00472 -0.33 -0.2758 -0.8229 2067892 IFLab1_004376 O/N=C\1/CCCc2oc(cc12)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G21 compound treatment 0.092 -0.00194 -0.12 0.076 -0.00172 -0.12 -0.1731 -0.9998 1501794 IFLab1_004377 COc1ccccc1N2CCN(CCC(=O)Nc3ccc4CCCc4c3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G22 compound treatment 0.065 -0.0289 -1.86 0.058 -0.0197 -1.38 -2.2911 -0.989 1914379 IFLab1_004378 CCSc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G23 mock treatment 0.092 -0.00194 -0.12 0.079 0.00128 0.09 -0.0249 -0.1621 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 G24 mock treatment 0.082 -0.0119 -0.77 0.068 -0.00972 -0.68 -1.0234 -0.9981 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H01 compound treatment 0.296 0.202 13.01 0.24 0.162 11.34 17.2129 0.9977 2067893 IFLab1_004379 COc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)N2CCc3ccccc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H02 compound treatment 0.14 0.0461 2.96 0.091 0.0133 0.93 2.7525 0.886 1601208 IFLab1_004380 CCN(CC)CC(O)Cn1c(cc2ccccc12)c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H03 compound treatment 0.187 0.0931 5.99 0.132 0.0543 3.79 6.9169 0.9757 1693007 IFLab1_004381 CCc1cc(nc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H04 compound treatment 0.082 -0.0119 -0.77 0.069 -0.00872 -0.61 -0.974 -0.9934 1684917 IFLab1_004382 Cc1ccc(OCC(O)Cn2cnc3ccccc23)c(CC=C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H05 compound treatment 0.154 0.0601 3.87 0.111 0.0333 2.33 4.3777 0.9704 1361158 IFLab1_004383 O=C(CSC1CCCCC1)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H06 compound treatment 0.125 0.0311 2.0 0.095 0.0173 1.21 2.2674 0.9708 1142337 IFLab1_004384 CCC(CO)NCC(O)Cn1c2ccccc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H07 compound treatment 1.092 0.998 64.24 0.94 0.862 60.24 88.02 0.9995 1686398 IFLab1_004385 O=C(CSCc1ccccc1)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H08 compound treatment 0.073 -0.0209 -1.35 0.066 -0.0117 -0.82 -1.5318 -0.9715 2067894 IFLab1_004386 CN(C)C(=O)Oc1ccc2cc(Br)ccc2c1Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H09 compound treatment 0.527 0.433 27.87 0.416 0.338 23.63 36.4205 0.9966 1519008 IFLab1_004387 CCOC(=O)c1ccc(NC(=O)CSc2ccc(Cl)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H10 compound treatment 0.205 0.111 7.15 0.131 0.0533 3.72 7.6868 0.9537 2067895 IFLab1_004388 Cc1sc2nc(SCc3cc(O)[nH]n3)nc(N)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H11 compound treatment 0.457 0.363 23.37 0.248 0.17 11.9 24.9356 0.9509 1503811 IFLab1_004389 Cc1nnc(NC(=O)CSC2CCCCC2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H12 compound treatment 0.17 0.0761 4.9 0.127 0.0493 3.44 5.8962 0.9852 1361283 IFLab1_004390 CN1CCN(CC1)C(c2ccccn2)c3cc(Cl)c4cccnc4c3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H13 compound treatment 0.102 0.00806 0.52 0.082 0.00428 0.3 0.5784 0.9657 2067896 IFLab1_004391 COc1cccc(/C=N/c2sc3CCCCc3c2C#N)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H14 compound treatment 0.087 -0.00694 -0.45 0.065 -0.0127 -0.89 -0.944 -0.9493 1472459 IFLab1_004392 CC(C)NCC(O)COc1ccc2CCCc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H15 compound treatment 0.1 0.00606 0.39 0.072 -0.00572 -0.4 -0.0066 -0.0118 1279406 IFLab1_004393 NC(=O)c1cc2ccccc2oc1=N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H16 compound treatment 0.088 -0.00594 -0.38 0.068 -0.00972 -0.68 -0.7503 -0.963 1033666 IFLab1_004394 CN(C)c1ccc(cc1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H17 compound treatment 0.124 0.0301 1.93 0.089 0.0113 0.79 1.9255 0.9216 2067897 IFLab1_004395 CCN(CC)c1ccc(/C=N/CCN2CCOCC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H18 compound treatment 0.158 0.0641 4.12 0.081 0.00328 0.23 3.0778 0.7453 1740945 IFLab1_004396 Cc1cc(C)nc(SC2CCCCC2NS(=O)(=O)c3ccccc3)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H19 compound treatment 0.133 0.0391 2.51 0.087 0.00928 0.65 2.2363 0.8613 1535475 IFLab1_004397 CC1CN(CCN1C(=O)c2ccc(C)c(C)c2)C(=O)c3ccc(C)c(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H20 compound treatment 0.087 -0.00694 -0.45 0.07 -0.00772 -0.54 -0.697 -0.9956 1466174 IFLab1_004398 CNC1CCS(=O)(=O)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H21 compound treatment 0.1 0.00606 0.39 0.076 -0.00172 -0.12 0.191 0.4679 1472099 IFLab1_004399 Cc1ccc2cccc(OC(=O)c3ccccc3F)c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H22 compound treatment 0.09 -0.00394 -0.25 0.071 -0.00672 -0.47 -0.5111 -0.9582 2067898 IFLab1_004400 CCc1cc2c(SCC(=O)c3ccc(Cl)s3)ncnc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H23 mock treatment 0.091 -0.00294 -0.19 0.089 0.0113 0.79 0.4236 0.5226 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 H24 mock treatment 0.082 -0.0119 -0.77 0.066 -0.0117 -0.82 -1.1222 -0.9995 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I01 compound treatment 0.203 0.109 7.02 0.139 0.0613 4.28 7.9909 0.9719 2067899 IFLab1_004401 Fc1ccc(cc1)S(=O)(=O)NCc2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I02 compound treatment 0.126 0.0321 2.06 0.09 0.0123 0.86 2.0659 0.9244 1173402 IFLab1_004402 NS(=O)(=O)c1ccccc1N2C(=O)CCC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I03 compound treatment 0.246 0.152 9.79 0.156 0.0783 5.47 10.7878 0.9622 1318426 IFLab1_004403 Fc1ccc(cc1)S(=O)(=O)N2Cc3ccccc3CC2C(=O)Nc4nccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I04 compound treatment 0.17 0.0761 4.9 0.11 0.0323 2.26 5.0565 0.9381 1258637 IFLab1_004404 OC(=O)c1ccc2NC(CSCc3ccccc3Cl)C(=O)Nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I05 compound treatment 0.05 -0.0439 -2.83 0.05 -0.0277 -1.94 -3.369 -0.9829 1002849 IFLab1_004405 c1ccc(cc1)c2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I06 compound treatment 0.4 0.306 19.7 0.287 0.209 14.62 24.2679 0.9892 1696315 IFLab1_004406 Cc1ccc(cc1Cl)n2cnc3cc(ccc23)C(=O)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I07 compound treatment 0.071 -0.0229 -1.48 0.063 -0.0147 -1.03 -1.771 -0.9844 2067900 IFLab1_004407 OC(=O)c1ccc(s1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I08 compound treatment 0.667 0.573 36.89 0.636 0.558 39.0 53.6599 0.9996 2067901 IFLab1_004408 COc1ccc(CNC(=O)CCSCc2ccccc2C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I09 compound treatment 0.123 0.0291 1.87 0.114 0.0363 2.53 3.115 0.9888 2067902 IFLab1_004409 O=S(=O)(Cc1ccccc1)n2ccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I10 compound treatment 0.155 0.0611 3.93 0.093 0.0153 1.07 3.534 0.8677 1659314 IFLab1_004410 COc1ccccc1CNC(=O)c2sc3nc[nH]c(=O)c3c2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I11 compound treatment 0.23 0.136 8.76 0.128 0.0503 3.51 8.6764 0.9195 1661541 IFLab1_004411 CC1(C)CC(O)CC(C)(C)N1CC(O)COc2ccc(cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I12 compound treatment 0.099 0.00506 0.33 0.073 -0.00472 -0.33 -0.0027 -0.0058 1286186 IFLab1_004412 Cc1nc2cc(ccc2n1c3ccc(F)cc3F)C(=O)NCCN4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I13 compound treatment 0.327 0.233 15.0 0.102 0.0243 1.7 11.8068 0.7821 1223709 IFLab1_004413 COc1cccc(c1)C(=O)N2CCN(Cc3cccc4ccccc34)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I14 compound treatment 0.111 0.0171 1.1 0.084 0.00628 0.44 1.0868 0.919 1647689 IFLab1_004414 O=C(Nc1nc[nH]n1)C2c3ccccc3Oc4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I15 compound treatment 0.43 0.336 21.63 0.323 0.245 17.14 27.4117 0.9933 1685824 IFLab1_004415 CCOC(=O)c1oc2cccc(O)c2c1CN(Cc3ccccc3)C(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I16 compound treatment 0.071 -0.0229 -1.48 0.065 -0.0127 -0.89 -1.6722 -0.9705 2067903 IFLab1_004416 Cc1ccc(Cn2cnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I17 compound treatment 0.126 0.0321 2.06 0.085 0.00728 0.51 1.8189 0.8558 1676733 IFLab1_004417 CC(=O)N1CCN(CC1)c2ccc(NC(=O)c3cc(Br)ccc3Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I18 compound treatment 0.111 0.0171 1.1 0.085 0.00728 0.51 1.1362 0.9388 1219407 IFLab1_004418 OC(=O)c1c(Nc2nnc(s2)c3ccncc3)sc4CCCCc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I19 compound treatment 0.094 6.25E-5 0.0 0.079 0.00128 0.09 0.0661 0.7381 1392974 IFLab1_004419 O=C1CCCc2c1[nH]c3ccc(cc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I20 compound treatment 0.13 0.0361 2.32 0.088 0.0103 0.72 2.1492 0.8845 1523614 IFLab1_004420 CC(=O)n1cc(c2c(O)c3ccccc3oc2=O)c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I21 compound treatment 0.072 -0.0219 -1.41 0.064 -0.0137 -0.96 -1.6761 -0.9822 1498479 IFLab1_004421 CCOC(=O)C1CCCN(CCC(=O)Nc2cc(C)ccc2C)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I22 compound treatment 0.211 0.117 7.53 0.136 0.0583 4.07 8.2069 0.9582 1865662 IFLab1_004422 CCOC(=O)N1CCN(CC1)S(=O)(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I23 mock treatment 0.1 0.00606 0.39 0.09 0.0123 0.86 0.8826 0.9364 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 I24 mock treatment 0.095 0.00106 0.07 0.074 -0.00372 -0.26 -0.1353 -0.5038 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J01 compound treatment 0.112 0.0181 1.16 0.102 0.0243 1.7 2.0215 0.983 2067904 IFLab1_004423 Cc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)NCCO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J02 compound treatment 0.101 0.00706 0.45 0.084 0.00628 0.44 0.6317 0.9998 1539414 IFLab1_004424 COc1ccc(cc1)c2cc3ccccc3n2CC(O)CN4CCCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J03 compound treatment 0.232 0.138 8.89 0.144 0.0663 4.63 9.5578 0.9538 2067905 IFLab1_004425 CCOC(=O)c1csc(NC(=O)/C=C/c2cccs2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J04 compound treatment 0.212 0.118 7.6 0.157 0.0793 5.54 9.2897 0.9879 1510071 IFLab1_004426 Cc1ccc(OCC(O)Cn2c(CO)nc3ccccc23)c(CC=C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J05 compound treatment 0.655 0.561 36.11 0.518 0.44 30.76 47.2848 0.9968 1152963 IFLab1_004427 O=C(CSC1CCCCC1)N2CCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J06 compound treatment 0.133 0.0391 2.51 0.087 0.00928 0.65 2.2363 0.8613 1153478 IFLab1_004428 CC(=O)Nc1ccc(NC2SC(=O)N(C2=O)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J07 compound treatment 0.074 -0.0199 -1.28 0.067 -0.0107 -0.75 -1.4369 -0.9671 1705520 IFLab1_004429 O=C(CSC1=NCCS1)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J08 compound treatment 0.089 -0.00494 -0.32 0.068 -0.00972 -0.68 -0.7048 -0.9402 1179186 IFLab1_004430 C(N1CCN(CC1)c2ncccn2)c3c[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J09 compound treatment 0.102 0.00806 0.52 0.08 0.00228 0.16 0.4796 0.8835 1167109 IFLab1_004431 Cc1ccc(NC(=O)CSC2=NCCS2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J10 compound treatment 0.194 0.1 6.44 0.133 0.0553 3.86 7.2849 0.9701 1287571 IFLab1_004432 O=C1OCCC1Sc2nc3sc4CCCCc4c3c(=O)[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J11 compound treatment 0.262 0.168 10.82 0.158 0.0803 5.61 11.6148 0.9532 1181391 IFLab1_004433 Cc1cc(NC(=O)CSCc2ccccc2)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J12 compound treatment 0.109 0.0151 0.97 0.086 0.00828 0.58 1.0946 0.9696 1684818 IFLab1_004434 OCc1cc(=O)c(O)c(CN2CCN(CC2)c3ccccc3F)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J13 compound treatment 0.254 0.16 10.3 0.148 0.0703 4.91 10.7567 0.9425 2067906 IFLab1_004435 CCN(CC)c1ccc(O)c(/C=N/c2ccc(cc2)S(=O)(=O)N)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J14 compound treatment 0.085 -0.00894 -0.58 0.072 -0.00572 -0.4 -0.6893 -0.9841 1702055 IFLab1_004436 CCOC(=O)N1CCN(CC(O)COc2ccc3CCCc3c2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J15 compound treatment 0.105 0.0111 0.71 0.09 0.0123 0.86 1.1102 0.9957 1138056 IFLab1_004437 COc1ccc(N=c2oc3ccccc3cc2C(=O)N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J16 compound treatment 0.104 0.0101 0.65 0.085 0.00728 0.51 0.8177 0.9929 1508530 IFLab1_004438 Cc1csc(n1)c2c[nH]nc2c3c(O)cc(C)cc3O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J17 compound treatment 0.201 0.107 6.89 0.152 0.0743 5.19 8.5421 0.9902 1032629 IFLab1_004439 COc1ccccc1NS(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J18 compound treatment 0.098 0.00406 0.26 0.094 0.0163 1.14 0.9892 0.8476 2067907 IFLab1_004440 COC1CCCCC1NS(=O)(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J19 compound treatment 0.077 -0.0169 -1.09 0.078 2.81E-4 0.02 -0.757 -0.6943 1616918 IFLab1_004441 Cc1ccc2cccc(OC(=O)c3ccc(C)c(C)c3)c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J20 compound treatment 0.071 -0.0229 -1.48 0.067 -0.0107 -0.75 -1.5734 -0.9505 1370608 IFLab1_004442 CN1CCN(CC1)C(=O)c2ccc(o2)c3ccc(Br)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J21 compound treatment 0.04 -0.0539 -3.47 0.039 -0.0387 -2.7 -4.3675 -0.9924 2067908 IFLab1_004443 CN(C)C(=S)SCN1CCCC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J22 compound treatment 0.102 0.00806 0.52 0.075 -0.00272 -0.19 0.2326 0.421 2067909 IFLab1_004444 Cc1sc2ncnc(SCC(=O)c3ccc(C)cc3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J23 mock treatment 0.111 0.0171 1.1 0.082 0.00428 0.3 0.9881 0.8681 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 J24 mock treatment 0.094 6.25E-5 0.0 0.081 0.00328 0.23 0.1649 0.7194 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K01 compound treatment 0.052 -0.0419 -2.7 0.046 -0.0317 -2.22 -3.4756 -0.9952 1277021 IFLab1_004445 CC(=C)CSc1nnc2c3ccccc3[nH]c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K02 compound treatment 0.123 0.0291 1.87 0.09 0.0123 0.86 1.9294 0.9375 2067910 IFLab1_004446 FC(F)(F)c1cccc(NC(=O)CSc2ncccc2C(=O)NCc3cccnc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K03 compound treatment 0.119 0.0251 1.61 0.079 0.00128 0.09 1.204 0.7452 2067911 IFLab1_004447 CS(=O)(=O)/N=C(\NC#N)/c1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K04 compound treatment 0.208 0.114 7.34 0.149 0.0713 4.98 8.7125 0.9821 1409951 IFLab1_004448 CCCNC(=O)c1ccc2n(cnc2c1)c3cccc(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K05 compound treatment 0.073 -0.0209 -1.35 0.057 -0.0207 -1.45 -1.9764 -0.9994 1371388 IFLab1_004449 CCN(CC)Cc1c[nH]c2c(cccc12)C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K06 compound treatment 0.086 -0.00794 -0.51 0.065 -0.0127 -0.89 -0.9895 -0.9655 1710118 IFLab1_004450 CCC(C)NC(=O)c1ccc2n(cnc2c1)c3cc(C)cc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K07 compound treatment 0.137 0.0431 2.77 0.123 0.0453 3.16 4.1967 0.9978 2067912 IFLab1_004451 Brc1ccc(cc1)c2nnc3SC(=C)Cn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K08 compound treatment 0.37 0.276 17.77 0.263 0.185 12.94 21.717 0.9879 1154278 IFLab1_004452 Cc1c(sc2nc(C)nc(N3CCOCC3)c12)C(=O)Nc4cccc(Cl)c4C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K09 compound treatment 0.131 0.0371 2.39 0.104 0.0263 1.84 2.9851 0.9916 2067913 IFLab1_004453 CC(C)Oc1ccc(cc1N)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K10 compound treatment 0.177 0.0831 5.35 0.146 0.0683 4.77 7.1534 0.9984 1302617 IFLab1_004454 Cc1c(sc2nc[nH]c(=O)c12)C(=O)N3CCN(CC3)c4cccc(Cl)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K11 compound treatment 0.077 -0.0169 -1.09 0.065 -0.0127 -0.89 -1.3992 -0.9948 2067914 IFLab1_004455 C=CCSc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K12 compound treatment 0.095 0.00106 0.07 0.074 -0.00372 -0.26 -0.1353 -0.5038 1198483 IFLab1_004456 Cc1nc2cc(ccc2n1c3cccc(F)c3)C(=O)NCc4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K13 compound treatment 0.116 0.0221 1.42 0.096 0.0183 1.28 1.9072 0.9986 1328673 IFLab1_004457 COc1ccc(CN2CCN(CC2)C(=O)c3ccccc3F)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K14 compound treatment 0.121 0.0271 1.74 0.1 0.0223 1.56 2.3324 0.9984 2067915 IFLab1_004458 Cc1cc(O)nc(SCc2cn3ccccc3n2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K15 compound treatment 0.413 0.319 20.54 0.317 0.239 16.72 26.3416 0.9948 1293452 IFLab1_004459 Clc1ccc(CC(=O)Nc2cccc3nsnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K16 compound treatment 0.143 0.0491 3.16 0.105 0.0273 1.91 3.5806 0.9708 1651872 IFLab1_004460 CCOCN(C(=O)Cn1cnc2ccccc12)c3c(C)cccc3CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K17 compound treatment 0.113 0.0191 1.23 0.086 0.00828 0.58 1.2767 0.9411 1653161 IFLab1_004461 Cc1cccc(NC(=O)CCS(=O)(=O)c2ccccc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K18 compound treatment 0.068 -0.0259 -1.67 0.062 -0.0157 -1.1 -1.957 -0.9793 1510088 IFLab1_004462 CC(C)N(C(=O)CSc1nc2ccccc2n1C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K19 compound treatment 0.204 0.11 7.08 0.155 0.0773 5.4 8.8268 0.991 1404903 IFLab1_004463 COc1ccc(Oc2ccc3[nH]c4C(=O)CCCc4c3c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K20 compound treatment 0.042 -0.0519 -3.34 0.041 -0.0367 -2.57 -4.1777 -0.9914 2067916 IFLab1_004464 O=C(/C=C/1\C(=O)Nc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K21 compound treatment 0.578 0.484 31.16 0.503 0.425 29.71 43.0393 0.9997 1607380 IFLab1_004465 COc1cc2CN(C(=O)c3ccccc3)C(C)(C)Cc2cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K22 compound treatment 0.524 0.43 27.68 0.4 0.322 22.51 35.4936 0.9947 1643121 IFLab1_004466 CCOC(=O)N1CCN(CC1)S(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K23 mock treatment 0.096 0.00206 0.13 0.09 0.0123 0.86 0.7005 0.8069 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 K24 mock treatment 0.099 0.00506 0.33 0.079 0.00128 0.09 0.2937 0.8691 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L01 compound treatment 0.195 0.101 6.5 0.112 0.0343 2.39 6.2931 0.9079 2067917 IFLab1_004467 Cc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)N2CCc3ccccc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L02 compound treatment 0.727 0.633 40.75 0.806 0.728 50.88 64.7884 0.9939 1318328 IFLab1_004468 Cc1c(C)c2ccccc2n1CC(O)CNc3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L03 compound treatment 0.523 0.429 27.62 0.45 0.372 26.01 37.918 0.9996 2067918 IFLab1_004469 Clc1ccc(SCC(=O)N2CCCC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L04 compound treatment 0.106 0.0121 0.78 0.077 -7.19E-4 -0.05 0.5135 0.66 1416271 IFLab1_004470 Cc1ccc(OCC(O)CN2CCN(CC2)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L05 compound treatment 0.109 0.0151 0.97 0.077 -7.19E-4 -0.05 0.65 0.6696 1361906 IFLab1_004471 O=C(CSC1CCCCC1)N2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L06 compound treatment 0.092 -0.00194 -0.12 0.067 -0.0107 -0.75 -0.6177 -0.8137 1475405 IFLab1_004472 Cc1ccc(NC2SC(=O)N(C2=O)c3ccc(C)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L07 compound treatment 0.156 0.0621 3.99 0.111 0.0333 2.33 4.4687 0.9668 1236624 IFLab1_004473 O=C(CSc1nc2ccccc2s1)N3CCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L08 compound treatment 0.061 -0.0329 -2.12 0.066 -0.0117 -0.82 -2.078 -0.9144 2067919 IFLab1_004474 NC1(Oc2cc(Cl)c(Cl)cc2O1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L09 compound treatment 0.546 0.452 29.1 0.527 0.449 31.39 42.7684 0.9993 2067920 IFLab1_004475 FC(F)(F)c1ccc(Cl)c(NC(=O)CSCc2ccco2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L10 compound treatment 0.205 0.111 7.15 0.142 0.0643 4.49 8.2302 0.9749 1536276 IFLab1_004476 Cc1ccc(NC(c2ccc(O)cc2)P(=O)(c3ccccc3)c4ccccc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L11 compound treatment 0.215 0.121 7.79 0.138 0.0603 4.21 8.4877 0.9583 1742239 IFLab1_004477 Cc1cc(NC(=O)CSC2=NCCS2)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L12 compound treatment 0.086 -0.00794 -0.51 0.074 -0.00372 -0.26 -0.545 -0.9508 1458992 IFLab1_004478 S=C(SCc1cn2ccccc2n1)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L13 compound treatment 0.119 0.0251 1.61 0.07 -0.00772 -0.54 0.7594 0.4465 2067921 IFLab1_004479 Oc1c(CC=C)cccc1/C=N/c2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L14 compound treatment 0.176 0.0821 5.28 0.057 -0.0207 -1.45 2.7114 0.4951 1503358 IFLab1_004480 CC(NCC(O)COc1ccc2CCCc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L15 compound treatment 0.1 0.00606 0.39 0.081 0.00328 0.23 0.438 0.9678 1382037 IFLab1_004481 NC(=O)c1cc2ccccc2oc1=NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L16 compound treatment 0.143 0.0491 3.16 0.097 0.0193 1.35 3.1854 0.9278 2067922 IFLab1_004482 Cc1nc(cs1)c2c(noc2c3ccc(O)cc3O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L17 compound treatment 0.064 -0.0299 -1.93 0.06 -0.0177 -1.24 -2.2378 -0.9771 2067923 IFLab1_004483 Oc1ccc(cc1)C(=O)OCC(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L18 compound treatment 0.108 0.0141 0.91 0.092 0.0143 1.0 1.3455 0.9988 1610504 IFLab1_004484 CS(=O)(=O)Nc1cc(Br)c(O)c(Br)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L19 compound treatment 0.074 -0.0199 -1.28 0.066 -0.0117 -0.82 -1.4863 -0.9764 1180167 IFLab1_004485 Cc1ccc(cc1C)C(=O)NCc2ccc3OCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L20 compound treatment 0.042 -0.0519 -3.34 0.04 -0.0377 -2.64 -4.2271 -0.9931 1407742 IFLab1_004486 O=C1CCCCCN1Sc2c(nc3sccn23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L21 compound treatment 0.063 -0.0309 -1.99 0.063 -0.0147 -1.03 -2.1351 -0.9527 1016009 IFLab1_004487 O=C1CCCCC1CN2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L22 compound treatment 0.173 0.0791 5.09 0.103 0.0253 1.77 4.8472 0.8999 1135361 IFLab1_004488 COc1ccc(CCNS(=O)(=O)c2cccc3cccnc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L23 mock treatment 0.097 0.00306 0.2 0.079 0.00128 0.09 0.2027 0.9362 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 L24 mock treatment 0.098 0.00406 0.26 0.062 -0.0157 -1.1 -0.5916 -0.5241 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M01 compound treatment 0.215 0.121 7.79 0.145 0.0673 4.7 8.8335 0.9707 1513352 IFLab1_004489 COc1ccc(cc1OC)C(=O)N2CCc3cc(OC)c(OC)cc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M02 compound treatment 0.192 0.0981 6.31 0.12 0.0423 2.95 6.5517 0.9402 1171272 IFLab1_004490 Fc1ccc(cc1C(=O)Nc2cccc(Cl)c2)S(=O)(=O)N3CCCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M03 compound treatment 0.12 0.0261 1.68 0.069 -0.00872 -0.61 0.7555 0.4233 2067924 IFLab1_004491 CS(=O)(=O)/N=C(\N)/c1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M04 compound treatment 0.301 0.207 13.33 0.181 0.103 7.22 14.5259 0.9585 2067925 IFLab1_004492 OC(=O)c1ccc(CSCc2c(F)cccc2Cl)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M05 compound treatment 0.109 0.0151 0.97 0.078 2.81E-4 0.02 0.6994 0.7213 2067926 IFLab1_004493 NC(=O)c1ccccc1NC(=O)CSc2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M06 compound treatment 0.166 0.0721 4.64 0.11 0.0323 2.26 4.8744 0.9451 1645794 IFLab1_004494 Cc1ccc(NC(=O)c2cc(ccc2F)S(=O)(=O)N3CCCC3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M07 compound treatment 0.117 0.0231 1.48 0.083 0.00528 0.37 1.3105 0.8568 1223484 IFLab1_004495 CC(=O)Nc1ccc2nc(N)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M08 compound treatment 0.138 0.0441 2.84 0.094 0.0163 1.14 2.8097 0.9195 1452318 IFLab1_004496 OC(=O)CC(NS(=O)(=O)c1ccc(Cl)cc1)c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M09 compound treatment 0.781 0.687 44.22 0.591 0.513 35.86 56.6255 0.9946 2067927 IFLab1_004497 C(Sc1nnnn1c2ccccc2)c3csc(n3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M10 compound treatment 0.162 0.0681 4.38 0.092 0.0143 1.0 3.8032 0.8465 2067928 IFLab1_004498 Cc1c(sc2nc[nH]c(=O)c12)C(=O)Nc3nc4ccc(Br)cc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M11 compound treatment 0.124 0.0301 1.93 0.102 0.0243 1.7 2.5677 0.9978 1006147 IFLab1_004499 CSc1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M12 compound treatment 0.181 0.0871 5.6 0.097 0.0193 1.35 4.9149 0.8528 1652255 IFLab1_004500 Cc1cc(C)cc(Nc2ccc(cc2N)C(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M13 compound treatment 0.166 0.0721 4.64 0.097 0.0193 1.35 4.2322 0.8763 1484553 IFLab1_004501 COc1cc(CN2CCN(Cc3ccc4ccccc4c3)CC2)cc(OC)c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M14 compound treatment 0.155 0.0611 3.93 0.101 0.0233 1.63 3.9292 0.9238 2067929 IFLab1_004502 Cc1cc(O)nc(SCc2nc3ccccn3c2Br)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M15 compound treatment 0.154 0.0601 3.87 0.09 0.0123 0.86 3.3403 0.8435 1315868 IFLab1_004503 O=C(N1CCCCCC1)c2cccc(c2)N3C(=O)C4CC=CCC4C3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M16 compound treatment 0.125 0.0311 2.0 0.096 0.0183 1.28 2.3168 0.9766 1328703 IFLab1_004504 CC(=O)Nc1ccc(NC(=O)Oc2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M17 compound treatment 0.084 -0.00994 -0.64 0.063 -0.0147 -1.03 -1.1794 -0.9739 2067930 IFLab1_004505 CCOc1ccc(cc1)c2ncnn2c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M18 compound treatment 1.32 1.23 78.92 1.185 1.11 77.35 110.4995 1.0 1126378 IFLab1_004506 COc1ccccc1Nc2nc(cs2)c3ccc(OC)c(OC)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M19 compound treatment 0.12 0.0261 1.68 0.126 0.0483 3.37 3.5712 0.948 1729956 IFLab1_004507 CC12C3CC(C=C3)C2C(=O)N(Cc4ccccc4)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M20 compound treatment 0.099 0.00506 0.33 0.076 -0.00172 -0.12 0.1455 0.419 1257229 IFLab1_004508 COc1cc2cc(O)nc(C)c2cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M21 compound treatment 0.081 -0.0129 -0.83 0.068 -0.00972 -0.68 -1.0689 -0.9949 1365211 IFLab1_004509 CCOC(=O)C1CCCc2c1[nH]c3c(cccc23)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M22 compound treatment 0.072 -0.0219 -1.41 0.062 -0.0157 -1.1 -1.7749 -0.9923 2067931 IFLab1_004510 O=C(/C=C\c1cccs1)N2CCN(Cc3ccc4OCOc4c3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M23 mock treatment 0.101 0.00706 0.45 0.068 -0.00972 -0.68 -0.1587 -0.1942 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 M24 mock treatment 0.099 0.00506 0.33 0.077 -7.19E-4 -0.05 0.1949 0.5912 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N01 compound treatment 0.217 0.123 7.92 0.124 0.0463 3.23 7.8871 0.9219 1865661 IFLab1_004511 COC(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N02 compound treatment 0.481 0.387 24.91 0.394 0.316 22.1 33.2401 0.9982 1436371 IFLab1_004512 OC(COc1ccc(Br)cc1)Cn2nnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N03 compound treatment 0.371 0.277 17.83 0.323 0.245 17.14 24.7264 0.9998 1486361 IFLab1_004513 O=C(CSc1nc2ccccc2s1)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N04 compound treatment 0.132 0.0381 2.45 0.083 0.00528 0.37 1.9932 0.8045 1327244 IFLab1_004514 Cc1nc2ccccc2n1CC(O)COc3ccccc3CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N05 compound treatment 0.157 0.0631 4.06 0.102 0.0243 1.7 4.0696 0.9251 1271955 IFLab1_004515 O=C(CSCc1ccccc1)N2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N06 compound treatment 0.094 6.25E-5 0.0 0.073 -0.00472 -0.33 -0.2303 -0.6984 1406581 IFLab1_004516 Clc1cc(Br)c(OC(=O)N2CCOCC2)c3ncccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N07 compound treatment 0.4 0.306 19.7 0.26 0.182 12.73 22.9342 0.9777 2067932 IFLab1_004517 Clc1ccc(SCC(=O)N2CCCc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N08 compound treatment 0.096 0.00206 0.13 0.073 -0.00472 -0.33 -0.1392 -0.3918 1607731 IFLab1_004518 Fc1ccc(cc1)C(=O)Nc2ccncc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N09 compound treatment 0.154 0.0601 3.87 0.137 0.0593 4.14 5.662 0.9994 2067933 IFLab1_004519 FC(F)(F)c1ccc(Cl)c(NC(=O)CSC2=NCCS2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N10 compound treatment 0.059 -0.0349 -2.25 0.056 -0.0217 -1.52 -2.663 -0.9817 3061579 IFLab1_004520 Cc1sc2sc(c(N)[n+]2c1C)c3ccccc3.OS(=O)(=O)c1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N11 compound treatment 0.154 0.0601 3.87 0.094 0.0163 1.14 3.5379 0.8779 1410761 IFLab1_004521 Cc1cc(NC(=O)CSc2nc3ccccc3s2)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N12 compound treatment 0.047 -0.0469 -3.02 0.046 -0.0317 -2.22 -3.7031 -0.9884 1690107 IFLab1_004522 Cc1cc(NC(c2cccc(Br)c2)c3ccc4cccnc4c3O)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N13 compound treatment 0.071 -0.0229 -1.48 0.054 -0.0237 -1.66 -2.2156 -0.9983 2067935 IFLab1_004523 c1ccc(cc1)c2nnc(o2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N14 compound treatment 0.071 -0.0229 -1.48 0.067 -0.0107 -0.75 -1.5734 -0.9505 1582367 IFLab1_004524 CCN(CC(O)COc1ccc(Cl)cc1Cl)Cc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N15 compound treatment 0.14 0.0461 2.96 0.073 -0.00472 -0.33 1.8633 0.6246 1499530 IFLab1_004525 Clc1cc(Cl)c2oc(=O)c(cc2c1)C(=O)NCCC3=CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N16 compound treatment 0.374 0.28 18.03 0.227 0.149 10.43 20.1207 0.9662 1019542 IFLab1_004526 c1nc(oc1c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N17 compound treatment 0.212 0.118 7.6 0.165 0.0873 6.1 9.6849 0.994 2067936 IFLab1_004527 Oc1ccccc1C(=O)OCC(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N18 compound treatment 0.251 0.157 10.11 0.253 0.175 12.25 15.807 0.9955 1298704 IFLab1_004528 Cc1ccc(cc1)S(=O)(=O)Nc2cc(C)c3oc(=O)sc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N19 compound treatment 0.152 0.0581 3.74 0.095 0.0173 1.21 3.4963 0.8902 1376525 IFLab1_004529 COc1ccc(Br)cc1S(=O)(=O)NCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N20 compound treatment 0.095 0.00106 0.07 0.074 -0.00372 -0.26 -0.1353 -0.5038 2067937 IFLab1_004530 COC(=O)CCNc1ccccn1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N21 compound treatment 0.104 0.0101 0.65 0.077 -7.19E-4 -0.05 0.4225 0.6503 2067938 IFLab1_004531 OCN1CCCCCC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N22 compound treatment 0.543 0.449 28.9 0.422 0.344 24.05 37.4451 0.9958 1247227 IFLab1_004532 O=C(N1CCc2ccccc12)c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N23 mock treatment 0.117 0.0231 1.48 0.096 0.0183 1.28 1.9527 0.9972 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 N24 mock treatment 0.087 -0.00694 -0.45 0.079 0.00128 0.09 -0.2525 -0.5543 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O01 compound treatment 0.094 6.25E-5 0.0 0.082 0.00428 0.3 0.2143 0.7166 1385689 IFLab1_004533 COc1ccc(cc1OC)C(=O)Oc2ccc3c4CCCCc4c(=O)oc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O02 compound treatment 0.139 0.0451 2.9 0.1 0.0223 1.56 3.1516 0.9574 2067939 IFLab1_004534 Cc1[nH]nc2nc(SCc3ccccc3Cl)n(c4ccc(Cl)c(C)c4)c(=N)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O03 compound treatment 0.091 -0.00294 -0.19 0.072 -0.00572 -0.4 -0.4162 -0.9416 2067940 IFLab1_004535 C/C(=N\S(=O)(=O)c1ccc(Cl)cc1)/N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O04 compound treatment 0.088 -0.00594 -0.38 0.071 -0.00672 -0.47 -0.6021 -0.9948 1133737 IFLab1_004536 CCCNC(=O)c1ccc2n(cnc2c1)c3cccc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O05 compound treatment 0.098 0.00406 0.26 0.076 -0.00172 -0.12 0.1 0.3475 1008818 IFLab1_004537 OC(=O)c1ccccc1C(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O06 compound treatment 0.3 0.206 13.26 0.176 0.0983 6.87 14.2334 0.953 1193623 IFLab1_004538 Cc1ccc(NC(=O)c2cc(ccc2F)S(=O)(=O)N3CCCCC3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O07 compound treatment 0.096 0.00206 0.13 0.086 0.00828 0.58 0.503 0.8473 1119595 IFLab1_004539 OC(=O)C1(CC1)S(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O08 compound treatment 0.101 0.00706 0.45 0.077 -7.19E-4 -0.05 0.2859 0.6252 1598317 IFLab1_004540 CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c3ccccc3F)C(=O)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O09 compound treatment 0.067 -0.0269 -1.73 0.065 -0.0127 -0.89 -1.8543 -0.9518 2067941 IFLab1_004541 CC(C)Cc1nc2ccccc2n1C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O10 compound treatment 0.105 0.0111 0.71 0.086 0.00828 0.58 0.9126 0.9947 1631779 IFLab1_004542 COc1ccc(NC(=O)c2oc(=O)c3ccccc3c2c4ccccc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O11 compound treatment 0.099 0.00506 0.33 0.074 -0.00372 -0.26 0.0467 0.1121 1153827 IFLab1_004543 CCn1c(NN)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O12 compound treatment 0.065 -0.0289 -1.86 0.057 -0.0207 -1.45 -2.3405 -0.9922 2067942 IFLab1_004544 OCCCc1nc2cc(Cc3ccc4[nH]c(CCCO)nc4c3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O13 compound treatment 0.147 0.0531 3.42 0.087 0.00928 0.65 2.8735 0.8266 1178468 IFLab1_004545 COc1cccc(CN2CCN(Cc3cccnc3)CC2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O14 compound treatment 0.125 0.0311 2.0 0.095 0.0173 1.21 2.2674 0.9708 1354178 IFLab1_004546 CC(C)C1CCC(C)CC1OP(=O)(N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O15 compound treatment 0.193 0.0991 6.38 0.116 0.0383 2.67 6.3997 0.9256 2067943 IFLab1_004547 COC(=O)c1cn(nc1N)C(=O)c2cc(Br)ccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O16 compound treatment 0.068 -0.0259 -1.67 0.056 -0.0217 -1.52 -2.2534 -0.9989 2067944 IFLab1_004548 Brc1ccccc1/N=C/c2ccc(OC(=O)c3ccccn3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O17 compound treatment 0.077 -0.0169 -1.09 0.065 -0.0127 -0.89 -1.3992 -0.9948 2067945 IFLab1_004549 COc1ccccc1c2nc(cc(=O)o2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O18 compound treatment 0.07 -0.0239 -1.54 0.068 -0.00972 -0.68 -1.5696 -0.9322 1704237 IFLab1_004550 COc1ccc(C(=O)CSc2nc3ccccc3n2C)c(F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O19 compound treatment 0.114 0.0201 1.29 0.068 -0.00972 -0.68 0.433 0.2968 2067946 IFLab1_004551 CCC(C)(O)c1cn(Cc2ccccc2)nn1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O20 compound treatment 0.062 -0.0319 -2.06 0.061 -0.0167 -1.17 -2.2794 -0.9641 1026023 IFLab1_004552 CCCSc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O21 compound treatment 0.221 0.127 8.18 0.168 0.0903 6.31 10.2427 0.9918 1366338 IFLab1_004553 CCOC(=O)c1c(N)c(C#N)c2CCCCCn12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O22 compound treatment 0.089 -0.00494 -0.32 0.08 0.00228 0.16 -0.112 -0.3151 2067947 IFLab1_004554 Cc1ccc(cc1)c2nnc(SCC(=O)c3ccc(Cl)cc3)[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O23 mock treatment 0.1 0.00606 0.39 0.083 0.00528 0.37 0.5368 0.9996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 O24 mock treatment 0.107 0.0131 0.84 0.081 0.00328 0.23 0.7566 0.8682 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P01 compound treatment 0.376 0.282 18.15 0.204 0.126 8.82 19.0756 0.945 2067948 IFLab1_004555 Cc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P02 compound treatment 0.092 -0.00194 -0.12 0.068 -0.00972 -0.68 -0.5683 -0.8232 1671185 IFLab1_004556 Cc1nccn1CC(O)COc2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P03 compound treatment 0.157 0.0631 4.06 0.111 0.0333 2.33 4.5142 0.965 1279371 IFLab1_004557 O=C(CSc1nc2ccccc2o1)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P04 compound treatment 0.079 -0.0149 -0.96 0.068 -0.00972 -0.68 -1.1599 -0.9855 1129329 IFLab1_004558 Cc1ccc(NCC(O)COc2ccc(OCc3ccccc3)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P05 compound treatment 0.299 0.205 13.2 0.205 0.127 8.89 15.6205 0.9815 1197141 IFLab1_004559 CCOC(=O)N1CCN(CC1)C(=O)CSc2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P06 compound treatment 0.195 0.101 6.5 0.229 0.151 10.57 12.0727 0.9728 1151475 IFLab1_004560 CCN(CC)C(=O)Oc1c(I)cc(Cl)c2cccnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P07 compound treatment 0.159 0.0651 4.19 0.119 0.0413 2.88 5.0004 0.9834 2067949 IFLab1_004561 FC(F)(F)c1ccccc1NC(=O)CSc2ncccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P08 compound treatment 0.141 0.0471 3.03 0.09 0.0123 0.86 2.7486 0.873 2067950 IFLab1_004562 FC(F)(F)C(=O)NC1(Oc2ccccc2O1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P09 compound treatment 0.226 0.132 8.5 0.158 0.0803 5.61 9.9763 0.9796 1724321 IFLab1_004563 O=C(CSC1CCCCC1)Nc2nccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P10 compound treatment 0.117 0.0231 1.48 0.089 0.0113 0.79 1.6069 0.9561 3176314 IFLab1_004564 CSc1sc(c2NC(=O)C[n+]12)c3ccccc3.OS(=O)(=O)c1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P11 compound treatment 0.12 0.0261 1.68 0.098 0.0203 1.42 2.188 0.9965 1620221 IFLab1_004565 CCOC(=O)c1c(NC(=O)C(C)Sc2ncccn2)sc3CCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P12 compound treatment 0.056 -0.0379 -2.44 0.054 -0.0237 -1.66 -2.8983 -0.9822 1616233 IFLab1_004566 CC1(C)CC(CC(C)(C)N1)N2COc3c(C2)cc(Cl)c4cccnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P13 compound treatment 0.28 0.186 11.98 0.538 0.46 32.16 31.2054 0.9094 1205710 IFLab1_004567 CCOC(=O)c1cc2cc(OC)ccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P14 compound treatment 0.076 -0.0179 -1.15 0.078 2.81E-4 0.02 -0.8025 -0.695 1412296 IFLab1_004568 CC1(C)CC(O)CC(C)(C)N1CC(O)COCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P15 compound treatment 0.264 0.17 10.95 0.191 0.113 7.91 13.3359 0.9873 1440750 IFLab1_004569 CCOc1ccccc1NC(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P16 compound treatment 0.091 -0.00294 -0.19 0.071 -0.00672 -0.47 -0.4656 -0.9201 1548337 IFLab1_004570 O=S(=O)(NC1CCCCC1N2CCCCC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P17 compound treatment 0.158 0.0641 4.12 0.15 0.0723 5.05 6.4862 0.9949 2067952 IFLab1_004571 Cc1sc2ncnc(O)c2c1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P18 compound treatment 0.096 0.00206 0.13 0.076 -0.00172 -0.12 0.009 0.0501 1518118 IFLab1_004572 CC1=C(C(c2ccc(F)cc2)n3ncnc3N1)C(=O)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P19 compound treatment 0.126 0.0321 2.06 0.111 0.0333 2.33 3.1033 0.9982 1289630 IFLab1_004573 COc1ccc(OC)c(c1)S(=O)(=O)NCCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P20 compound treatment 0.089 -0.00494 -0.32 0.069 -0.00872 -0.61 -0.6554 -0.954 2067953 IFLab1_004574 CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P21 compound treatment 0.041 -0.0529 -3.41 0.041 -0.0367 -2.57 -4.2232 -0.9902 2067954 IFLab1_004575 CN(C)C(=S)SCN1CCCCCC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P22 compound treatment 0.114 0.0201 1.29 0.081 0.00328 0.23 1.0752 0.8198 1384114 IFLab1_004576 Cc1ccc(cc1)c2nc3SC(CC(=O)n3n2)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P23 mock treatment 0.104 0.0101 0.65 0.074 -0.00372 -0.26 0.2743 0.393 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1424 P24 mock treatment 0.093 -9.37E-4 -0.06 0.068 -0.00972 -0.68 -0.5228 -0.7669 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A01 compound treatment 0.072 0.00225 0.14 0.07 0.00584 0.41 0.3911 0.9028 1867102 IFLab1_004577 COc1ccccc1N2CCN(CC2)S(=O)(=O)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A02 compound treatment 0.082 0.0123 0.79 0.089 0.0248 1.74 1.7848 0.9363 2067955 IFLab1_004578 COc1cc(/C=N/S(=O)(=O)CCc2ccccc2)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A03 compound treatment 0.099 0.0293 1.88 0.081 0.0168 1.18 2.1633 0.9744 1399613 IFLab1_004579 COc1cccc2cc(C(=O)NC3CCCCC3)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A04 compound treatment 0.659 0.589 37.93 0.727 0.663 46.31 59.5619 0.9951 2067956 IFLab1_004580 COc1ccc(c2n[nH]c(c2c3cnn(c3)c4ccccc4)C(F)(F)F)c(O)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A05 compound treatment 0.087 0.0173 1.11 0.084 0.0198 1.39 1.7653 0.9939 1423467 IFLab1_004581 O=C(COc1ccccc1)Nc2sc3CCCCc3c2C(=O)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A06 compound treatment 0.076 0.00625 0.4 0.069 0.00484 0.34 0.5237 0.9963 2067957 IFLab1_004582 CCc1cc2c(=O)c(Oc3ccccc3F)c(oc2c(CN(C)C)c1O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A07 compound treatment 0.07 2.5E-4 0.02 0.059 -0.00516 -0.36 -0.2433 -0.6748 1436811 IFLab1_004583 COc1ccc(Cl)cc1S(=O)(=O)NCCN2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A08 compound treatment 0.072 0.00225 0.14 0.07 0.00584 0.41 0.3911 0.9028 1374298 IFLab1_004584 OCCCc1nc2ccccc2n1Cc3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A09 compound treatment 0.183 0.113 7.29 0.207 0.143 9.98 12.2106 0.9881 2067958 IFLab1_004585 Cc1cc(C)nc(SC(C#N)c2ccccc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A10 compound treatment 0.081 0.0113 0.72 0.068 0.00384 0.27 0.7019 0.9088 2067959 IFLab1_004586 OC(=O)CC1S/C(=N/c2ccccc2)/N(C1=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A11 compound treatment 0.073 0.00325 0.21 0.07 0.00584 0.41 0.4366 0.9518 2067960 IFLab1_004587 CC1=CC(=O)/C(=C/Nc2cccc(c2)C(F)(F)F)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A12 compound treatment 0.071 0.00125 0.08 0.072 0.00784 0.55 0.4444 0.8023 1638905 IFLab1_004588 O=C(CC1SC(=O)NC1=O)Nc2nccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A13 compound treatment 0.069 -7.5E-4 -0.05 0.069 0.00484 0.34 0.2051 0.6002 2067961 IFLab1_004589 O=C(CN1C(=O)/C(=C\c2cccs2)/SC1=S)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A14 compound treatment 0.19 0.12 7.74 0.181 0.117 8.16 11.2448 0.9996 1276376 IFLab1_004590 Oc1cccc2CCCN(c12)S(=O)(=O)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A15 compound treatment 0.067 -0.00275 -0.18 0.063 -0.00116 -0.08 -0.1823 -0.9369 2067962 IFLab1_004591 CCOc1ccccc1NC(=O)CCCN2C(=O)/C(=C\c3ccco3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A16 compound treatment 0.074 0.00425 0.27 0.11 0.0458 3.2 2.458 0.7647 2067963 IFLab1_004592 C=CCn1c(SCC(=O)c2ccccc2)nnc1c3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A17 compound treatment 0.067 -0.00275 -0.18 0.061 -0.00316 -0.22 -0.2811 -0.9941 2067964 IFLab1_004593 O=C(CCCN1C(=O)/C(=C/C=C/c2ccccc2)/SC1=S)NC3=NCCS3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A18 compound treatment 0.527 0.457 29.43 0.519 0.455 31.78 43.2793 0.9993 1275009 IFLab1_004594 OC(=O)Cc1cc(=O)oc2c1ccc3ccccc32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A19 compound treatment 0.067 -0.00275 -0.18 0.06 -0.00416 -0.29 -0.3305 -0.9718 1331110 IFLab1_004595 O=C(Cc1cccs1)Nc2ccc(cc2)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A20 compound treatment 0.079 0.00925 0.6 0.072 0.00784 0.55 0.8085 0.9991 1565168 IFLab1_004596 Oc1ccc(CN2CCN(CC2)c3ccc(F)cc3)c4cccnc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A21 compound treatment 0.064 -0.00575 -0.37 0.061 -0.00316 -0.22 -0.4176 -0.9694 1587927 IFLab1_004597 Cc1ccc(cc1)N2C(=O)C3C4OC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A22 compound treatment 0.092 0.0222 1.43 0.087 0.0228 1.6 2.1411 0.9985 1701435 IFLab1_004598 CCOC(=O)c1c(C)oc2c1c3CN(CCO)COc3c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A23 mock treatment 0.061 -0.00875 -0.56 0.063 -0.00116 -0.08 -0.4554 -0.8003 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 A24 mock treatment 0.09 0.0203 1.3 0.07 0.00584 0.41 1.2103 0.8861 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B01 compound treatment 0.071 0.00125 0.08 0.075 0.0108 0.76 0.5926 0.7778 1488289 IFLab1_004599 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NC4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B02 compound treatment 0.079 0.00925 0.6 0.069 0.00484 0.34 0.6603 0.9642 1352342 IFLab1_004600 COc1ccc(cc1)N(C2CS(=O)(=O)C=C2)C(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B03 compound treatment 0.119 0.0493 3.17 0.096 0.0318 2.22 3.8145 0.985 1158402 IFLab1_004601 CC1CN(CC(C)O1)c2oc(nc2C#N)c3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B04 compound treatment 0.076 0.00625 0.4 0.066 0.00184 0.13 0.3755 0.8891 2067965 IFLab1_004602 OC(=O)C(CC(=O)Nc1ccccc1)NCc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B05 compound treatment 0.098 0.0283 1.82 0.086 0.0218 1.53 2.3648 0.9962 1554471 IFLab1_004603 Clc1ccc(Nc2nc(CC(=O)NCc3ccccc3)cs2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B06 compound treatment 0.066 -0.00375 -0.24 0.068 0.00384 0.27 0.0192 0.0532 2067966 IFLab1_004604 CC(C)NC(CC(=O)Nc1ccc(C)cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B07 compound treatment 0.078 0.00825 0.53 0.079 0.0148 1.04 1.1087 0.9517 1419715 IFLab1_004605 Cn1c(=NC(=O)c2ccc(Cl)s2)sc3cc(ccc13)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B08 compound treatment 0.07 2.5E-4 0.02 0.07 0.00584 0.41 0.3 0.7344 1382065 IFLab1_004606 COc1ccccc1N2CCN(CC(O)COc3c(F)cc(Br)cc3F)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B09 compound treatment 0.076 0.00625 0.4 0.073 0.00884 0.62 0.7213 0.9784 1237175 IFLab1_004607 NC(=O)CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3cccc(Cl)c3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B10 compound treatment 0.07 2.5E-4 0.02 0.071 0.00684 0.48 0.3494 0.7305 1480977 IFLab1_004608 CC(C)C(NC(=O)C1(CC2(C)CC3(C)CC(C)(C2)C1)C3)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B11 compound treatment 0.096 0.0262 1.69 0.082 0.0178 1.25 2.0762 0.9888 1296257 IFLab1_004609 CC1=C(C(C(=C(N1)SCC(=O)Nc2ccc(F)cc2)C#N)c3cccs3)C(=O)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B12 compound treatment 0.071 0.00125 0.08 0.058 -0.00616 -0.43 -0.2472 -0.565 1181255 IFLab1_004610 OC(=O)CNC(=O)CC1(CC2CC3CC(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B13 compound treatment 0.123 0.0532 3.43 0.129 0.0648 4.53 5.6267 0.9905 1500326 IFLab1_004611 CCN(CC)S(=O)(=O)c1ccc2SC(=O)c3cccc1c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B14 compound treatment 0.064 -0.00575 -0.37 0.06 -0.00416 -0.29 -0.467 -0.9928 1610407 IFLab1_004612 COc1cc(Cl)c(cc1Cl)S(=O)(=O)Nc2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B15 compound treatment 0.066 -0.00375 -0.24 0.066 0.00184 0.13 -0.0796 -0.2909 1626661 IFLab1_004613 CCOC(Cn1c(CO)nc2ccccc12)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B16 compound treatment 0.141 0.0712 4.59 0.137 0.0728 5.09 6.8412 0.9987 2067967 IFLab1_004614 O=C1C(=Cc2ccco2)C(=O)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B17 compound treatment 0.419 0.349 22.48 0.392 0.328 22.9 32.0903 1.0 2067968 IFLab1_004615 O/N=C/c1nc(c2ccccc2)n3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B18 compound treatment 0.078 0.00825 0.53 0.071 0.00684 0.48 0.7136 0.9986 1487281 IFLab1_004616 CC1(C)C2CCC1(CS(=O)(=O)N3CCN(CC3)c4ccccc4F)C(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B19 compound treatment 0.075 0.00525 0.34 0.068 0.00384 0.27 0.4288 0.9935 1388984 IFLab1_004617 CCN1CCN(CC1)C(c2c(C)[nH]c3ccccc23)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B20 compound treatment 0.439 0.369 23.77 0.412 0.348 24.3 33.9885 0.9999 1328803 IFLab1_004618 Cc1ccc(o1)c2c3CCCCc3nc4sc(C(=O)N)c(N)c24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B21 compound treatment 0.066 -0.00375 -0.24 0.062 -0.00216 -0.15 -0.2772 -0.9742 2067969 IFLab1_004619 Brc1ccc(/C=C/C(=O)\C=C\c2ccc(Br)o2)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B22 compound treatment 0.07 2.5E-4 0.02 0.063 -0.00116 -0.08 -0.0457 -0.5553 2067970 IFLab1_004620 COc1ccc(cc1)C(=O)CSc2nc(C)c(C(=O)N)c(C)c2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B23 mock treatment 0.079 0.00925 0.6 0.065 8.44E-4 0.06 0.4627 0.7733 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 B24 mock treatment 0.065 -0.00475 -0.31 0.062 -0.00216 -0.15 -0.3227 -0.9468 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C01 compound treatment 0.064 -0.00575 -0.37 0.063 -0.00116 -0.08 -0.3188 -0.8416 1867103 IFLab1_004621 O=S(=O)(/C=C/c1ccccc1)N2CCN(CC2)c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C02 compound treatment 0.095 0.0253 1.63 0.089 0.0248 1.74 2.3764 0.9995 2067971 IFLab1_004622 NC(=O)/C=C/C(=O)Nc1ccc(cc1)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C03 compound treatment 0.08 0.0103 0.66 0.098 0.0338 2.36 2.1383 0.8711 1531823 IFLab1_004623 CN(C)C(=O)c1cc2cccc(CC=C)c2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C04 compound treatment 0.116 0.0462 2.98 0.092 0.0278 1.95 3.4804 0.9787 1712547 IFLab1_004624 COc1ccc2c(=O)c(Oc3ccccc3F)c(C)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C05 compound treatment 0.053 -0.0168 -1.08 0.049 -0.0152 -1.06 -1.511 -1.0 2067972 IFLab1_004625 COc1nc(nc(Cl)c1NC(=O)c2cccs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C06 compound treatment 0.063 -0.00675 -0.43 0.068 0.00384 0.27 -0.1173 -0.2297 1139894 IFLab1_004626 CC12CS(=O)(=O)CC2SC(=S)N1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C07 compound treatment 0.084 0.0143 0.92 0.085 0.0208 1.46 1.6782 0.9752 2067973 IFLab1_004627 COc1cc(c(OC)cc1Br)S(=O)(=O)NCc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C08 compound treatment 0.06 -0.00975 -0.63 0.061 -0.00316 -0.22 -0.5997 -0.9015 1214357 IFLab1_004628 C(Cn1cnc2ccccc12)Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C09 compound treatment 0.148 0.0783 5.04 0.078 0.0138 0.97 4.2452 0.8278 2067974 IFLab1_004629 Cc1sc2nc(SCc3ccc(cc3)C(=O)NCCO)nc(N)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C10 compound treatment 0.072 0.00225 0.14 0.066 0.00184 0.13 0.1935 0.9983 2067975 IFLab1_004630 Oc1ccc(/N=C/2\NC(=O)CS2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C11 compound treatment 0.838 0.768 49.45 0.734 0.67 46.8 68.0545 0.9996 1425224 IFLab1_004631 COc1ccc(cc1OC)C(=O)Oc2c(C)occc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C12 compound treatment 0.077 0.00725 0.47 0.076 0.0118 0.83 0.915 0.9633 2067976 IFLab1_004632 O=C(Nc1ccccc1)/C=C/2\SC(=O)NC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C13 compound treatment 0.07 2.5E-4 0.02 0.069 0.00484 0.34 0.2507 0.7399 2067977 IFLab1_004633 O=C(CN1C(=O)/C(=C\c2cccs2)/SC1=S)Nc3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C14 compound treatment 0.549 0.479 30.85 0.505 0.441 30.8 43.589 1.0 1224768 IFLab1_004634 COc1ccc(cc1)S(=O)(=O)N2CCCc3cccc(O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C15 compound treatment 0.068 -0.00175 -0.11 0.065 8.44E-4 0.06 -0.038 -0.2987 2067978 IFLab1_004635 CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccco3)/SC2=S)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C16 compound treatment 0.076 0.00625 0.4 0.064 -1.56E-4 -0.01 0.2767 0.6877 1635746 IFLab1_004636 COc1ccc(cc1)N2CCN(CC(O)COc3ccccc3CC=C)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C17 compound treatment 0.172 0.102 6.58 0.145 0.0808 5.65 8.6472 0.9971 2067979 IFLab1_004637 C/C(=C\c1ccccc1)/C=C/2\SC(=S)N(CCCC(=O)Nc3cccnc3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C18 compound treatment 0.078 0.00825 0.53 0.075 0.0108 0.76 0.9111 0.9849 2067980 IFLab1_004638 Brc1ccc(NC(=O)c2cccs2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C19 compound treatment 0.09 0.0203 1.3 0.08 0.0158 1.11 1.7043 0.9967 1174397 IFLab1_004639 Cc1cccc(N2C(=O)CC(N(O)c3ccccc3)C2=O)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C20 compound treatment 0.059 -0.0107 -0.69 0.064 -1.56E-4 -0.01 -0.497 -0.7182 1196000 IFLab1_004640 Oc1ccc(CNc2ccc(Cl)cn2)c3cccnc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C21 compound treatment 0.065 -0.00475 -0.31 0.069 0.00484 0.34 0.0231 0.0506 1653982 IFLab1_004641 Cc1ccc(N2C(=O)CC(Sc3ccccc3C(=O)O)C2=O)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C22 compound treatment 0.178 0.108 6.97 0.138 0.0738 5.16 8.5745 0.9891 1636765 IFLab1_004642 COc1ccc(CCN2COc3c(C2)cc(Cl)c4cccnc34)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C23 mock treatment 0.072 0.00225 0.14 0.062 -0.00216 -0.15 -0.0041 -0.0197 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 C24 mock treatment 0.067 -0.00275 -0.18 0.072 0.00784 0.55 0.2623 0.4555 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D01 compound treatment 0.104 0.0343 2.2 0.098 0.0338 2.36 3.2306 0.9994 1670351 IFLab1_004643 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D02 compound treatment 0.081 0.0113 0.72 0.061 -0.00316 -0.22 0.3561 0.4705 2067981 IFLab1_004644 OC(=O)C(CC(=O)Nc1cccc(Cl)c1)NC2CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D03 compound treatment 0.069 -7.5E-4 -0.05 0.054 -0.0102 -0.71 -0.5358 -0.7535 1552352 IFLab1_004645 CN1CCN(CC1)c2oc(nc2C#N)c3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D04 compound treatment 0.071 0.00125 0.08 0.063 -0.00116 -0.08 -2.0E-4 -0.002 2067982 IFLab1_004646 OC(=O)C(CC(=O)Nc1ccccc1)NCCC2=CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D05 compound treatment 0.075 0.00525 0.34 0.065 8.44E-4 0.06 0.2806 0.8181 1268870 IFLab1_004647 COc1ccc(OC)c(NC(=O)CCC(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D06 compound treatment 0.071 0.00125 0.08 0.067 0.00284 0.2 0.1974 0.9208 1258179 IFLab1_004648 CC(C)c1ccccc1OCC(O)CN2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D07 compound treatment 0.079 0.00925 0.6 0.079 0.0148 1.04 1.1543 0.9653 1163664 IFLab1_004649 Cn1c(=NC(=O)c2c(F)cccc2F)sc3cc(ccc13)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D08 compound treatment 0.074 0.00425 0.27 0.068 0.00384 0.27 0.3833 1.0 1213728 IFLab1_004650 COc1ccccc1N2CCN(CC(O)COc3ccccc3C(C)(C)C)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D09 compound treatment 0.133 0.0633 4.07 0.139 0.0748 5.23 6.5758 0.9923 1121939 IFLab1_004651 CCOC(=O)CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3cccc(Cl)c3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D10 compound treatment 0.074 0.00425 0.27 0.065 8.44E-4 0.06 0.2351 0.8402 1611471 IFLab1_004652 Cc1ccc(cc1)C2(CC3CC4CC(C3)(C2)C(=O)NCC(=O)O)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D11 compound treatment 0.087 0.0173 1.11 0.063 -0.00116 -0.08 0.728 0.6539 2067983 IFLab1_004653 Brc1cccc(c1)C2CC(=O)NC(=C2C#N)SCC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D12 compound treatment 0.064 -0.00575 -0.37 0.072 0.00784 0.55 0.1258 0.1902 1193720 IFLab1_004654 CC(C)C(NC(=O)CC1(CC2CC3CC(C2)C1)C3)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D13 compound treatment 0.074 0.00425 0.27 0.065 8.44E-4 0.06 0.2351 0.8402 1133429 IFLab1_004655 OC(=O)c1cccc(c1)S(=O)(=O)Nc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D14 compound treatment 0.058 -0.0118 -0.76 0.065 8.44E-4 0.06 -0.4931 -0.65 1425263 IFLab1_004656 COc1c(Cl)c(Cl)ccc1S(=O)(=O)Nc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D15 compound treatment 0.065 -0.00475 -0.31 0.065 8.44E-4 0.06 -0.1745 -0.5605 1701281 IFLab1_004657 CCOC(Cn1c(nc2ccccc12)C(C)O)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D16 compound treatment 0.081 0.0113 0.72 0.073 0.00884 0.62 0.9489 0.9969 2067984 IFLab1_004658 Cc1sc2nc(SCc3nnc(Nc4ccccc4)s3)nc(N)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D17 compound treatment 0.296 0.226 14.56 0.304 0.24 16.76 22.1452 0.9976 2067985 IFLab1_004659 OC(=O)/C=C/c1nc(c2ccccc2)n3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D18 compound treatment 0.098 0.0283 1.82 0.089 0.0248 1.74 2.513 0.9997 2067986 IFLab1_004660 Cc1cc(C)n(n1)c2nc(nc3ccccc23)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D19 compound treatment 0.06 -0.00975 -0.63 0.065 8.44E-4 0.06 -0.4021 -0.6379 1243310 IFLab1_004661 Cc1[nH]c2ccccc2c1C(N3CCC(CC3)C(=O)N)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D20 compound treatment 0.067 -0.00275 -0.18 0.063 -0.00116 -0.08 -0.1823 -0.9369 2067987 IFLab1_004662 Brc1ccc(NC(=O)CSC2=C(C#N)C(CC(=O)N2)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D21 compound treatment 0.127 0.0573 3.68 0.115 0.0508 3.55 5.1172 0.9998 1610342 IFLab1_004663 Oc1cc(c2ccc(Cl)cc2Cl)c3oc(=O)sc3c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D22 compound treatment 0.076 0.00625 0.4 0.077 0.0128 0.9 0.9189 0.9345 1672509 IFLab1_004664 O=C(CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccco3)NCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D23 mock treatment 0.072 0.00225 0.14 0.066 0.00184 0.13 0.1935 0.9983 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 D24 mock treatment 0.066 -0.00375 -0.24 0.063 -0.00116 -0.08 -0.2278 -0.895 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E01 compound treatment 0.139 0.0693 4.46 0.131 0.0668 4.67 6.4537 0.9997 1328309 IFLab1_004665 CCCOC(=O)c1cccc(NC(=O)C2(CCC3(C)C(=O)O2)C3(C)C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E02 compound treatment 0.464 0.394 25.38 0.423 0.359 25.07 35.6698 1.0 1419652 IFLab1_004666 O=S(=O)(N1CCCc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E03 compound treatment 0.064 -0.00575 -0.37 0.055 -0.00916 -0.64 -0.714 -0.9662 1629177 IFLab1_004667 OC(=O)c1ccccc1C(=O)NCc2ccc3OCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E04 compound treatment 0.063 -0.00675 -0.43 0.062 -0.00216 -0.15 -0.4137 -0.8997 1206695 IFLab1_004668 CN(C)Cc1c(O)ccc2c(=O)c(c3cnn(c3)c4ccccc4)c(C)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E05 compound treatment 0.075 0.00525 0.34 0.069 0.00484 0.34 0.4782 1.0 1574212 IFLab1_004669 CCOc1ccc(cc1)S(=O)(=O)NCc2ccncc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E06 compound treatment 0.066 -0.00375 -0.24 0.062 -0.00216 -0.15 -0.2772 -0.9742 2067988 IFLab1_004670 CCN(CC)C(=S)SC1=C(Cl)CS(=O)(=O)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E07 compound treatment 0.596 0.526 33.87 0.606 0.542 37.85 50.7174 0.9985 1143921 IFLab1_004671 COc1cc(c(OC)cc1Br)S(=O)(=O)N2CCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E08 compound treatment 0.057 -0.0127 -0.82 0.056 -0.00816 -0.57 -0.9832 -0.9841 2067989 IFLab1_004672 CCc1nc2ccccc2n1CCOc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E09 compound treatment 0.061 -0.00875 -0.56 0.062 -0.00216 -0.15 -0.5048 -0.8658 2067990 IFLab1_004673 CCOC(=O)CSc1nc(N)c2c3CCCc3sc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E10 compound treatment 0.179 0.109 7.03 0.193 0.129 9.0 11.337 0.9925 2067991 IFLab1_004674 OC(=O)CCCN1C(=O)S/C(=C\C=C\c2ccccc2)/C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E11 compound treatment 0.077 0.00725 0.47 0.07 0.00584 0.41 0.6186 0.9978 1052339 IFLab1_004675 OCc1cc(=O)c(O)c(CN2CCOCC2)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E12 compound treatment 0.091 0.0213 1.37 0.074 0.00984 0.69 1.4534 0.9494 2067992 IFLab1_004676 O=C(Nc1nccs1)/C=C/2\SC(=O)NC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E13 compound treatment 0.069 -7.5E-4 -0.05 0.069 0.00484 0.34 0.2051 0.6002 2067993 IFLab1_004677 O=C(CN1C(=O)/C(=C\c2cccs2)/SC1=S)N3CCCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E14 compound treatment 0.191 0.121 7.8 0.137 0.0728 5.09 9.1168 0.9785 2067994 IFLab1_004678 CC1CCN(CC1)S(=O)(=O)c2ccc(Cl)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E15 compound treatment 0.079 0.00925 0.6 0.07 0.00584 0.41 0.7097 0.9831 2067995 IFLab1_004679 FC(F)(F)c1ccccc1NC(=O)CCCN2C(=O)/C(=C\c3ccco3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E16 compound treatment 0.083 0.0133 0.85 0.068 0.00384 0.27 0.7929 0.8868 1224542 IFLab1_004680 COc1ccc(cc1)N2CCN(CC(O)COC3C(C)(C)C4CCC3(C)C4)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E17 compound treatment 0.077 0.00725 0.47 0.076 0.0118 0.83 0.915 0.9633 2067996 IFLab1_004681 C/C(=C\c1ccccc1)/C=C/2\SC(=S)N(CCCC(=O)Nc3cc(C)on3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E18 compound treatment 0.078 0.00825 0.53 0.075 0.0108 0.76 0.9111 0.9849 1047188 IFLab1_004682 Clc1ccc(cc1Cl)S(=O)(=O)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E19 compound treatment 0.072 0.00225 0.14 0.066 0.00184 0.13 0.1935 0.9983 2067997 IFLab1_004683 O=C(Nc1ccc(cc1)N2CCOCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E20 compound treatment 0.067 -0.00275 -0.18 0.063 -0.00116 -0.08 -0.1823 -0.9369 1132054 IFLab1_004684 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NC4CC(C)(C)NC(C)(C)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E21 compound treatment 0.041 -0.0288 -1.85 0.042 -0.0222 -1.55 -2.403 -0.9961 2067998 IFLab1_004685 [O-]/[N+](=C\c1ccc(F)cc1)/c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E22 compound treatment 0.092 0.0222 1.43 0.073 0.00884 0.62 1.4495 0.9294 1283697 IFLab1_004686 Clc1cc2CN(COc2c3ncccc13)C4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E23 mock treatment 0.068 -0.00175 -0.11 0.057 -0.00716 -0.5 -0.4332 -0.8452 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 E24 mock treatment 0.07 2.5E-4 0.02 0.069 0.00484 0.34 0.2507 0.7399 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F01 compound treatment 0.129 0.0592 3.81 0.118 0.0538 3.76 5.3564 1.0 1370382 IFLab1_004687 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NCc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F02 compound treatment 0.074 0.00425 0.27 0.069 0.00484 0.34 0.4327 0.9944 2067999 IFLab1_004688 OC(=O)C(CC(=O)Nc1cccc(Cl)c1Cl)NCC2CCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F03 compound treatment 0.826 0.756 48.68 0.772 0.708 49.45 69.3855 1.0 1125272 IFLab1_004689 Fc1ccccc1c2nc(C#N)c(NC3CCCCC3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F04 compound treatment 0.068 -0.00175 -0.11 0.058 -0.00616 -0.43 -0.3838 -0.8632 2068000 IFLab1_004690 OC(=O)C(CC(=O)Nc1ccccc1)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F05 compound treatment 0.087 0.0173 1.11 0.073 0.00884 0.62 1.222 0.9617 2068001 IFLab1_004691 C=CC/N=C/1\SCC(=O)N1S(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F06 compound treatment 0.072 0.00225 0.14 0.064 -1.56E-4 -0.01 0.0947 0.652 1514657 IFLab1_004692 CC(C)c1ccccc1OCC(O)CN2CC(C)OC(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F07 compound treatment 0.067 -0.00275 -0.18 0.054 -0.0102 -0.71 -0.6269 -0.8572 2068002 IFLab1_004693 COc1ccc(Cl)cc1NC(=O)/C(=C\C(=O)O)/C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F08 compound treatment 0.073 0.00325 0.21 0.06 -0.00416 -0.29 -0.0574 -0.1604 1639934 IFLab1_004694 CCCc1cc(NCCN(C)C)n2c3ccccc3nc2c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F09 compound treatment 0.081 0.0113 0.72 0.069 0.00484 0.34 0.7513 0.94 1413907 IFLab1_004695 CCOC(=O)c1sc2nc3CCCC(=O)c3cc2c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F10 compound treatment 0.077 0.00725 0.47 0.064 -1.56E-4 -0.01 0.3222 0.6904 1594347 IFLab1_004696 Cc1ccc(cc1)C(=O)NCC(=O)NC2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F11 compound treatment 0.082 0.0123 0.79 0.069 0.00484 0.34 0.7968 0.9287 2068003 IFLab1_004697 Fc1ccccc1C2CC(=O)NC(=C2C#N)SCC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F12 compound treatment 0.123 0.0532 3.43 0.101 0.0368 2.57 4.2436 0.99 1173735 IFLab1_004698 Cc1ccc(c(C)c1C)S(=O)(=O)NCc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F13 compound treatment 0.08 0.0103 0.66 0.068 0.00384 0.27 0.6564 0.9215 1200595 IFLab1_004699 COc1ccc(NS(=O)(=O)c2cccc(c2)C(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F14 compound treatment 0.07 2.5E-4 0.02 0.068 0.00384 0.27 0.2013 0.7481 1675115 IFLab1_004700 COc1c(Cl)c(Cl)ccc1S(=O)(=O)n2cnc(C)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F15 compound treatment 0.069 -7.5E-4 -0.05 0.064 -1.56E-4 -0.01 -0.0419 -0.8456 1471952 IFLab1_004701 CCOC(Cn1c(COc2ccccc2)nc3ccccc13)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F16 compound treatment 0.178 0.108 6.97 0.126 0.0618 4.32 7.9818 0.9736 1263925 IFLab1_004702 Cc1sc2ncnc(Nc3ccc(F)cc3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F17 compound treatment 0.064 -0.00575 -0.37 0.054 -0.0102 -0.71 -0.7634 -0.954 1451270 IFLab1_004703 OC(c1cccs1)c2nccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F18 compound treatment 0.14 0.0703 4.52 0.108 0.0438 3.06 5.3631 0.982 1321579 IFLab1_004704 Cc1noc(C)c1COc2ccc3ccc(=O)oc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F19 compound treatment 0.063 -0.00675 -0.43 0.059 -0.00516 -0.36 -0.5619 -0.9957 2068004 IFLab1_004705 CC1=CC(=O)/C(=C/Nc2cccc(F)c2)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F20 compound treatment 0.09 0.0203 1.3 0.089 0.0248 1.74 2.1489 0.99 1509495 IFLab1_004706 Cc1ccc(NC(=O)CSC2=C(C#N)C3(CCCCC3)C(C#N)C(=O)N2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F21 compound treatment 1.258 1.19 76.48 1.189 1.12 78.58 109.6461 0.9999 1124052 IFLab1_004707 Oc1cc(c2ccc(F)cc2)c3oc(=O)sc3c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F22 compound treatment 0.087 0.0173 1.11 0.082 0.0178 1.25 1.6665 0.9983 1692546 IFLab1_004708 CCc1ccc(NC(=O)CSC2=C(C#N)C(C3=C(CCCC3=O)N2)c4ccco4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F23 mock treatment 0.069 -7.5E-4 -0.05 0.059 -0.00516 -0.36 -0.2888 -0.7948 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 F24 mock treatment 0.075 0.00525 0.34 0.058 -0.00616 -0.43 -0.0652 -0.1191 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G01 compound treatment 0.086 0.0163 1.05 0.078 0.0138 0.97 1.4234 0.9992 1683742 IFLab1_004709 Cc1cc(C)nc(SCC(CSc2nc(C)cc(C)n2)C(=O)O)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G02 compound treatment 0.067 -0.00275 -0.18 0.069 0.00484 0.34 0.1141 0.2988 2068005 IFLab1_004710 COc1ccc(NC(=O)CC2SC(=N)NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G03 compound treatment 0.07 2.5E-4 0.02 0.065 8.44E-4 0.06 0.0531 0.8684 2068006 IFLab1_004711 FC(F)(F)C(=C(C#N)C#N)Nc1ccccn1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G04 compound treatment 0.078 0.00825 0.53 0.068 0.00384 0.27 0.5654 0.9501 1718602 IFLab1_004712 CN(C)Cc1cc2c(=O)c(c3cnn(c3)c4ccccc4)c(C)oc2c(C)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G05 compound treatment 0.229 0.159 10.25 0.225 0.161 11.24 15.1933 0.9989 1612106 IFLab1_004713 Clc1ccc(Cl)c(c1)S(=O)(=O)NCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G06 compound treatment 0.075 0.00525 0.34 0.062 -0.00216 -0.15 0.1324 0.3579 1212778 IFLab1_004714 COc1ccccc1NC2CCS(=O)(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G07 compound treatment 0.105 0.0352 2.27 0.103 0.0388 2.71 3.5231 0.996 1321934 IFLab1_004715 COc1cccc2cc(C(=O)N3CCN(CC3)c4ccccc4)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G08 compound treatment 0.073 0.00325 0.21 0.068 0.00384 0.27 0.3378 0.9924 1724423 IFLab1_004716 CC(O)c1nc2ccccc2n1CCOc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G09 compound treatment 0.088 0.0182 1.17 0.081 0.0168 1.18 1.6627 1.0 1579401 IFLab1_004717 COc1ccc(cc1)C(=O)N2CCN(CCn3c(C)ccc3C)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G10 compound treatment 0.069 -7.5E-4 -0.05 0.07 0.00584 0.41 0.2545 0.6192 2068007 IFLab1_004718 OC(=O)/C=C/1\SC(=O)NC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G11 compound treatment 0.057 -0.0127 -0.82 0.055 -0.00916 -0.64 -1.0326 -0.9924 2068008 IFLab1_004719 Cc1cccnc1N/C=C/2\C(=O)Oc3ccccc3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G12 compound treatment 0.096 0.0262 1.69 0.087 0.0228 1.6 2.3232 0.9996 1297968 IFLab1_004720 CC(C)Cn1c(NN)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G13 compound treatment 0.071 0.00125 0.08 0.069 0.00484 0.34 0.2962 0.8515 2068009 IFLab1_004721 O=C(CN1C(=O)/C(=C\c2cccs2)/SC1=S)N3CCN(CC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G14 compound treatment 0.074 0.00425 0.27 0.066 0.00184 0.13 0.2845 0.941 1641682 IFLab1_004722 Clc1ccc(s1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)c3ccc(Cl)s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G15 compound treatment 0.178 0.108 6.97 0.143 0.0788 5.51 8.8215 0.9932 2068010 IFLab1_004723 Clc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccco3)/SC2=S)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G16 compound treatment 0.069 -7.5E-4 -0.05 0.062 -0.00216 -0.15 -0.1406 -0.8892 1648540 IFLab1_004724 CC1(C)C(OCC(O)CN2CCN(CC2)c3cccc(Cl)c3)C4(C)CCC1C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G17 compound treatment 0.1 0.0302 1.95 0.092 0.0278 1.95 2.7522 1.0 2068011 IFLab1_004725 C/C(=C\c1ccccc1)/C=C/2\SC(=S)N(CC(=O)Nc3cccnc3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G18 compound treatment 0.057 -0.0127 -0.82 0.051 -0.0132 -0.92 -1.2302 -0.9984 1337253 IFLab1_004726 CN(CC(O)COCc1ccc2OCOc2c1)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G19 compound treatment 0.041 -0.0288 -1.85 0.041 -0.0232 -1.62 -2.4524 -0.9978 2068012 IFLab1_004727 Cc1ccccc1/[N+](=C/c2ccncc2)/[O-] 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G20 compound treatment 0.092 0.0222 1.43 0.054 -0.0102 -0.71 0.511 0.3197 1648175 IFLab1_004728 CCOC(=O)c1c(C)oc2c1c(CN3CCN(C)CC3)c(O)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G21 compound treatment 0.083 0.0133 0.85 0.086 0.0218 1.53 1.6821 0.9622 2068013 IFLab1_004729 FC(F)(F)c1cccc(c1)N2C(=O)CC(Nc3ccc(cc3)N4CCOCC4)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G22 compound treatment 0.081 0.0113 0.72 0.069 0.00484 0.34 0.7513 0.94 1271328 IFLab1_004730 Clc1cc2CN(CCCN3CCOCC3)COc2c4ncccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G23 mock treatment 0.06 -0.00975 -0.63 0.062 -0.00216 -0.15 -0.5503 -0.8526 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 G24 mock treatment 0.065 -0.00475 -0.31 0.069 0.00484 0.34 0.0231 0.0506 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H01 compound treatment 0.108 0.0382 2.46 0.091 0.0268 1.88 3.0669 0.991 1679577 IFLab1_004731 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)N4CC(C)OC(C)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H02 compound treatment 0.071 0.00125 0.08 0.062 -0.00216 -0.15 -0.0496 -0.2906 2068014 IFLab1_004732 NC(CC(=O)Nc1ccc(Cl)cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H03 compound treatment 0.13 0.0602 3.88 0.108 0.0438 3.06 4.908 0.9932 1204754 IFLab1_004733 COc1ccc(cc1)c2nc(C#N)c(o2)N3CC(C)OC(C)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H04 compound treatment 0.072 0.00225 0.14 0.064 -1.56E-4 -0.01 0.0947 0.652 2068015 IFLab1_004734 OC(=O)C(CC(=O)Nc1ccccc1)NCc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H05 compound treatment 0.094 0.0243 1.56 0.09 0.0258 1.81 2.3803 0.9974 1574049 IFLab1_004735 OCCNC(=O)c1ccc(CSc2nc3sc4CCCc4c3c(=O)[nH]2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H06 compound treatment 0.055 -0.0147 -0.95 0.056 -0.00816 -0.57 -1.0742 -0.9702 1471476 IFLab1_004736 CC(C)c1ccccc1OCC(O)CN(C)C2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H07 compound treatment 0.078 0.00825 0.53 0.074 0.00984 0.69 0.8617 0.9918 1313936 IFLab1_004737 COc1ccc2oc(=Nc3ccccc3)c(cc2c1)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H08 compound treatment 0.091 0.0213 1.37 0.089 0.0248 1.74 2.1944 0.993 1627175 IFLab1_004738 C1CCN(C1)c2ncnc3scc(c4ccccc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H09 compound treatment 1.005 0.935 60.2 0.874 0.81 56.58 82.5709 0.9995 1702530 IFLab1_004739 CC1(C)CC(=O)c2cc(C#N)c(SCC=C)nc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H10 compound treatment 0.072 0.00225 0.14 0.066 0.00184 0.13 0.1935 0.9983 1411984 IFLab1_004740 CC(NC(=O)c1ccc(C)cc1)C(=O)NC2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H11 compound treatment 0.095 0.0253 1.63 0.085 0.0208 1.46 2.1788 0.9985 2068016 IFLab1_004741 Fc1ccccc1C2CC(=O)NC(=C2C#N)SCC(=O)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H12 compound treatment 0.083 0.0133 0.85 0.075 0.0108 0.76 1.1387 0.9983 1535363 IFLab1_004742 COc1ccc(OC)c(c1)S(=O)(=O)NC2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H13 compound treatment 0.083 0.0133 0.85 0.064 -1.56E-4 -0.01 0.5953 0.698 1417274 IFLab1_004743 O=C(Oc1ccc2ccc(=O)oc2c1)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H14 compound treatment 0.123 0.0532 3.43 0.094 0.0298 2.08 3.8978 0.9716 1295540 IFLab1_004744 Brc1ccc2oc(=O)c(cc2c1)C(=O)OCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H15 compound treatment 0.081 0.0113 0.72 0.071 0.00684 0.48 0.8501 0.9797 1312039 IFLab1_004745 CCCCn1c(nc2ccccc12)C3CN(C(=O)C3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H16 compound treatment 0.07 2.5E-4 0.02 0.065 8.44E-4 0.06 0.0531 0.8684 1285134 IFLab1_004746 Cc1sc2ncnc(Nc3ccc4OCOc4c3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H17 compound treatment 0.071 0.00125 0.08 0.063 -0.00116 -0.08 -2.0E-4 -0.002 2068017 IFLab1_004747 CCOC(=O)c1ccc(N/C=C\2/C(=O)OC(=CC2=O)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H18 compound treatment 0.051 -0.0187 -1.21 0.047 -0.0172 -1.2 -1.7009 -1.0 1237999 IFLab1_004748 COC(=O)c1c(NC(=O)CCN2CCC(C)CC2)scc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H19 compound treatment 0.068 -0.00175 -0.11 0.062 -0.00216 -0.15 -0.1862 -0.9897 2068018 IFLab1_004749 CC1=CC(=O)/C(=C/Nc2ccccc2Br)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H20 compound treatment 0.104 0.0343 2.2 0.097 0.0328 2.29 3.1812 0.9998 1271820 IFLab1_004750 CCc1ccc(NC(=O)CSC2=C(C#N)C3(CCCCC3)C(C#N)C(=O)N2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H21 compound treatment 0.077 0.00725 0.47 0.071 0.00684 0.48 0.668 0.9999 2068019 IFLab1_004751 Cc1ccc(cc1)C(=O)CC(c2cccs2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H22 compound treatment 0.078 0.00825 0.53 0.067 0.00284 0.2 0.516 0.91 1429648 IFLab1_004752 COc1ccc(cc1OC)C2C(=C(NC(=C2C(=O)Nc3ccccc3C)C)SC)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H23 mock treatment 0.072 0.00225 0.14 0.068 0.00384 0.27 0.2923 0.958 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 H24 mock treatment 0.06 -0.00975 -0.63 0.058 -0.00616 -0.43 -0.7479 -0.983 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I01 compound treatment 0.088 0.0182 1.17 0.075 0.0108 0.76 1.3663 0.9775 1523731 IFLab1_004753 CC1(CC2C(C(=O)NCC=C)C(=O)N1)Oc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I02 compound treatment 0.083 0.0133 0.85 0.074 0.00984 0.69 1.0893 0.9943 1479951 IFLab1_004754 O=C(CC1Sc2ccccc2NC1=O)Nc3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I03 compound treatment 0.081 0.0113 0.72 0.07 0.00584 0.41 0.8007 0.9632 1480556 IFLab1_004755 CCCOC1(NC(=O)c2ccc(C)cc2)C(=CC(=O)C=C1C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I04 compound treatment 0.069 -7.5E-4 -0.05 0.057 -0.00716 -0.5 -0.3876 -0.7718 1218950 IFLab1_004756 CN(C)Cc1cc2c(=O)c(Oc3ccccc3F)c(C)oc2c(C)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I05 compound treatment 0.066 -0.00375 -0.24 0.064 -1.56E-4 -0.01 -0.1784 -0.7383 1403868 IFLab1_004757 COc1cc(ccc1Cl)S(=O)(=O)Nc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I06 compound treatment 0.08 0.0103 0.66 0.071 0.00684 0.48 0.8046 0.9875 2068020 IFLab1_004758 O=S1(=O)CC2SC(=S)N(Cc3ccccc3)C2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I07 compound treatment 0.044 -0.0257 -1.66 0.045 -0.0192 -1.34 -2.1182 -0.9944 2068021 IFLab1_004759 CCc1ccc(/N=C/c2c(O)ccc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I08 compound treatment 0.062 -0.00775 -0.5 0.062 -0.00216 -0.15 -0.4592 -0.8813 2068022 IFLab1_004760 OCCCc1nc2ccccc2n1CCCOc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I09 compound treatment 0.09 0.0203 1.3 0.089 0.0248 1.74 2.1489 0.99 1686056 IFLab1_004761 Cc1oc2c(cc(O)c3ccccc23)c1C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I10 compound treatment 0.111 0.0413 2.66 0.105 0.0408 2.85 3.895 0.9994 2068023 IFLab1_004762 Oc1cccc(NC(=O)CCCN2C(=O)S/C(=C\C=C\c3ccccc3)/C2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I11 compound treatment 0.104 0.0343 2.2 0.098 0.0338 2.36 3.2306 0.9994 1293366 IFLab1_004763 Cc1cc2cc(NC(=O)c3ccco3)ccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I12 compound treatment 0.074 0.00425 0.27 0.066 0.00184 0.13 0.2845 0.941 1729635 IFLab1_004764 CCOC(Cn1c(C)nc2ccccc12)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I13 compound treatment 0.073 0.00325 0.21 0.058 -0.00616 -0.43 -0.1562 -0.3266 2068024 IFLab1_004765 O=C(CN1C(=O)/C(=C\c2cccs2)/SC1=S)N(Cc3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I14 compound treatment 0.258 0.188 12.12 0.261 0.197 13.75 18.2916 0.998 1279880 IFLab1_004766 CC1CCc2ccccc2N1S(=O)(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I15 compound treatment 0.105 0.0352 2.27 0.112 0.0478 3.34 3.9677 0.9822 2068025 IFLab1_004767 O=C(CCCN1C(=O)/C(=C\c2ccco2)/SC1=S)Nc3ccc4ccccc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I16 compound treatment 0.114 0.0442 2.85 0.105 0.0408 2.85 4.0316 1.0 1609431 IFLab1_004768 CC1CC(CC(C)(C)C1)OCC(O)CN2CCN(CC2)c3cccc(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I17 compound treatment 0.09 0.0203 1.3 0.082 0.0178 1.25 1.8031 0.9998 2068026 IFLab1_004769 C/C(=C\c1ccccc1)/C=C/2\SC(=S)N(CC(=O)Nc3ccccn3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I18 compound treatment 0.064 -0.00575 -0.37 0.056 -0.00816 -0.57 -0.6646 -0.9782 1577195 IFLab1_004770 CN(CC(O)COCC1COc2ccccc2O1)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I19 compound treatment 0.09 0.0203 1.3 0.076 0.0118 0.83 1.5067 0.9759 2068027 IFLab1_004771 CC1=CC(=O)N(CCC#N)c2ccccc2N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I20 compound treatment 0.179 0.109 7.03 0.212 0.148 10.33 12.2755 0.9824 2068028 IFLab1_004772 CCOC(=O)c1c(C)oc-2c1/C(=C/NCc3ccccn3)/C(=O)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I21 compound treatment 0.089 0.0193 1.24 0.085 0.0208 1.46 1.9058 0.9968 2068029 IFLab1_004773 COc1cc(/C=N\S(=O)(=O)c2cccs2)cc(Br)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I22 compound treatment 0.057 -0.0127 -0.82 0.053 -0.0112 -0.78 -1.1314 -0.9997 1446470 IFLab1_004774 CN1CCN(Cc2c(c(C)c3ccccn23)c4ccccc4)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I23 mock treatment 0.07 2.5E-4 0.02 0.067 0.00284 0.2 0.1519 0.7619 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 I24 mock treatment 0.071 0.00125 0.08 0.071 0.00684 0.48 0.395 0.8146 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J01 compound treatment 0.083 0.0133 0.85 0.075 0.0108 0.76 1.1387 0.9983 1614018 IFLab1_004775 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)N4CCN(CC)CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J02 compound treatment 0.075 0.00525 0.34 0.063 -0.00116 -0.08 0.1818 0.5233 2068030 IFLab1_004776 OC(=O)C(CC(=O)Nc1ccc(Cl)cc1)NCCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J03 compound treatment 0.11 0.0403 2.59 0.082 0.0178 1.25 2.7133 0.9438 1372168 IFLab1_004777 Clc1ccccc1c2nc(C#N)c(o2)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J04 compound treatment 0.069 -7.5E-4 -0.05 0.062 -0.00216 -0.15 -0.1406 -0.8892 2068031 IFLab1_004778 COc1ccccc1NC(=O)CC(NCc2ccccc2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J05 compound treatment 0.072 0.00225 0.14 0.072 0.00784 0.55 0.4899 0.8643 1639457 IFLab1_004779 CC(=O)N=c1sc2cc(ccc2n1C)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J06 compound treatment 0.069 -7.5E-4 -0.05 0.063 -0.00116 -0.08 -0.0913 -0.9697 1391862 IFLab1_004780 CC(C)c1ccccc1OCC(O)CN2C(C)(C)CC(O)CC2(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J07 compound treatment 0.076 0.00625 0.4 0.076 0.0118 0.83 0.8695 0.9451 1459734 IFLab1_004781 CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3cccc(Cl)c3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J08 compound treatment 0.073 0.00325 0.21 0.068 0.00384 0.27 0.3378 0.9924 1593253 IFLab1_004782 CN(C)CCN1C(C(=C(O)C1=O)C(=O)c2ccc(Cl)cc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J09 compound treatment 0.136 0.0663 4.26 0.121 0.0568 3.97 5.8232 0.9994 1514613 IFLab1_004783 Nc1c(sc2nc3CCCC(=O)c3cc12)C(=O)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J10 compound treatment 0.083 0.0133 0.85 0.057 -0.00716 -0.5 0.2495 0.2524 1203559 IFLab1_004784 CC(C)CC(NC(=O)c1ccc(C)cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J11 compound treatment 0.094 0.0243 1.56 0.071 0.00684 0.48 1.4418 0.8832 1691430 IFLab1_004785 Cc1ccccc1C2CC(=O)NC(=C2C#N)SCC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J12 compound treatment 0.058 -0.0118 -0.76 0.057 -0.00716 -0.5 -0.8883 -0.9798 1466915 IFLab1_004786 COc1ccc(Cl)cc1S(=O)(=O)NC2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J13 compound treatment 0.081 0.0113 0.72 0.077 0.0128 0.9 1.1465 0.9943 1660049 IFLab1_004787 CC(=O)Oc1ccc(cc1)N(C(=O)C)S(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J14 compound treatment 0.062 -0.00775 -0.5 0.059 -0.00516 -0.36 -0.6074 -0.9872 1635047 IFLab1_004788 CC1CN(CC(C)O1)C(=O)c2cc3cc(Br)ccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J15 compound treatment 0.071 0.00125 0.08 0.067 0.00284 0.2 0.1974 0.9208 1277840 IFLab1_004789 O=C1CC(CN1c2ccccc2)c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J16 compound treatment 0.061 -0.00875 -0.56 0.065 8.44E-4 0.06 -0.3566 -0.6297 2068032 IFLab1_004790 COC(=O)c1c(NC(=O)CCN2CC(C)OC(C)C2)scc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J17 compound treatment 0.073 0.00325 0.21 0.065 8.44E-4 0.06 0.1896 0.8724 1548974 IFLab1_004791 COc1ccc(NC(c2c(C)[nH]c3ccccc23)c4ccccn4)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J18 compound treatment 0.062 -0.00775 -0.5 0.062 -0.00216 -0.15 -0.4592 -0.8813 1259190 IFLab1_004792 OCCNc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J19 compound treatment 0.071 0.00125 0.08 0.056 -0.00816 -0.57 -0.346 -0.6013 2068033 IFLab1_004793 CC1=CC(=O)/C(=C/Nc2ccc(C)cc2)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J20 compound treatment 0.115 0.0452 2.91 0.103 0.0388 2.71 3.9783 0.9994 2068034 IFLab1_004794 Clc1ccc(NC(=O)CSC2=C(C#N)C3(CCCCC3)C(C#N)C(=O)N2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J21 compound treatment 0.092 0.0222 1.43 0.095 0.0308 2.15 2.5363 0.9803 2068035 IFLab1_004795 Cc1ccc(cc1)c2ccc(/C=N/n3cnnc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J22 compound treatment 0.064 -0.00575 -0.37 0.062 -0.00216 -0.15 -0.3682 -0.9215 1272038 IFLab1_004796 Cc1cccc(NC(=O)CSC2=C(C#N)C(C3=C(CCCC3=O)N2)c4ccccc4C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J23 mock treatment 0.077 0.00725 0.47 0.074 0.00984 0.69 0.8162 0.9822 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 J24 mock treatment 0.074 0.00425 0.27 0.058 -0.00616 -0.43 -0.1107 -0.2171 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K01 compound treatment 0.084 0.0143 0.92 0.071 0.00684 0.48 0.9866 0.9539 1731947 IFLab1_004797 O=C(N1CC(=O)Nc2ccccc12)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K02 compound treatment 0.084 0.0143 0.92 0.064 -1.56E-4 -0.01 0.6408 0.6986 1219728 IFLab1_004798 COC(=O)c1c(NC(=O)CC2Sc3ccccc3NC2=O)sc4CCCCc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K03 compound treatment 0.079 0.00925 0.6 0.073 0.00884 0.62 0.8579 0.9998 1253240 IFLab1_004799 Cc1cc(NC(=O)Cc2ccccc2)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K04 compound treatment 0.091 0.0213 1.37 0.071 0.00684 0.48 1.3052 0.9008 1392397 IFLab1_004800 CCc1cc2c(=O)c(c3cnn(c3)c4ccccc4)c(C)oc2cc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K05 compound treatment 0.063 -0.00675 -0.43 0.065 8.44E-4 0.06 -0.2655 -0.6056 1412463 IFLab1_004801 COc1cc(ccc1Cl)S(=O)(=O)NCc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K06 compound treatment 0.077 0.00725 0.47 0.065 8.44E-4 0.06 0.3716 0.7901 2068036 IFLab1_004802 COC(=O)C(C1CCS(=O)(=O)C1)S(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K07 compound treatment 0.081 0.0113 0.72 0.076 0.0118 0.83 1.0971 0.9978 1599104 IFLab1_004803 Oc1ccccc1c2csc(n2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K08 compound treatment 0.064 -0.00575 -0.37 0.06 -0.00416 -0.29 -0.467 -0.9928 2068037 IFLab1_004804 OCc1nc2ccccc2n1CCCOc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K09 compound treatment 0.052 -0.0177 -1.14 0.048 -0.0162 -1.13 -1.6059 -1.0 2068038 IFLab1_004805 CC1=CC(=O)/C(=C/Nc2ccccn2)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K10 compound treatment 0.108 0.0382 2.46 0.102 0.0378 2.64 3.6103 0.9994 2068039 IFLab1_004806 Oc1ccc(NC(=O)CN2C(=O)S/C(=C\C=C\c3ccccc3)/C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K11 compound treatment 0.067 -0.00275 -0.18 0.061 -0.00316 -0.22 -0.2811 -0.9941 1342138 IFLab1_004807 CC1CN(Cc2oc(CO)cc(=O)c2O)CC(C)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K12 compound treatment 0.061 -0.00875 -0.56 0.057 -0.00716 -0.5 -0.7517 -0.9982 2068040 IFLab1_004808 CC(=C)Cn1c(nc2ccccc12)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K13 compound treatment 0.069 -7.5E-4 -0.05 0.085 0.0208 1.46 0.9955 0.6833 2068041 IFLab1_004809 COc1ccccc1NC(=O)CCCN2C(=O)/C(=C\c3ccco3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K14 compound treatment 0.074 0.00425 0.27 0.068 0.00384 0.27 0.3833 1.0 1596879 IFLab1_004810 O=S(=O)(NCCN1CCOCC1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K15 compound treatment 0.066 -0.00375 -0.24 0.066 0.00184 0.13 -0.0796 -0.2909 2068042 IFLab1_004811 Cc1csc(NC(=O)CCCN2C(=O)/C(=C\c3ccco3)/SC2=S)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K16 compound treatment 0.059 -0.0107 -0.69 0.055 -0.00916 -0.64 -0.9416 -0.9992 1177055 IFLab1_004812 COc1ccc(OCC(O)Cn2cnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K17 compound treatment 0.084 0.0143 0.92 0.075 0.0108 0.76 1.1842 0.9955 2068043 IFLab1_004813 C/C(=C\c1ccccc1)/C=C/2\SC(=S)N(CC(=O)N3CCN(CC3)c4ccccc4)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K18 compound treatment 0.069 -7.5E-4 -0.05 0.064 -1.56E-4 -0.01 -0.0419 -0.8456 1336607 IFLab1_004814 CCc1c(C)c(C#N)c2nc3ccccc3n2c1NCCN(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K19 compound treatment 0.049 -0.0208 -1.34 0.048 -0.0162 -1.13 -1.7425 -0.9965 2068044 IFLab1_004815 Cc1ccc(/C=[N+](\[O-])/c2ccccc2C)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K20 compound treatment 0.16 0.0902 5.81 0.154 0.0898 6.28 8.5457 0.9993 2068045 IFLab1_004816 CCOC(=O)c1c(C)oc-2c1/C(=C/NCc3cccnc3)/C(=O)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K21 compound treatment 0.062 -0.00775 -0.5 0.062 -0.00216 -0.15 -0.4592 -0.8813 2068046 IFLab1_004817 N=C1NC(=O)C(CC(=O)Nc2ccc(cc2)N3CCCCC3)S1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K22 compound treatment 0.064 -0.00575 -0.37 0.057 -0.00716 -0.5 -0.6152 -0.989 1413048 IFLab1_004818 CCOC(=O)c1c(C)oc2c1c(CN3CCN(CC)CC3)c(O)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K23 mock treatment 0.069 -7.5E-4 -0.05 0.061 -0.00316 -0.22 -0.19 -0.842 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 K24 mock treatment 0.062 -0.00775 -0.5 0.058 -0.00616 -0.43 -0.6568 -0.9973 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L01 compound treatment 0.074 0.00425 0.27 0.069 0.00484 0.34 0.4327 0.9944 1673825 IFLab1_004819 Cc1[nH]c2ccccc2c1C(O)c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L02 compound treatment 0.076 0.00625 0.4 0.064 -1.56E-4 -0.01 0.2767 0.6877 2068047 IFLab1_004820 OC(=O)C(CC(=O)Nc1cccc(Cl)c1)NCCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L03 compound treatment 0.328 0.258 16.62 0.264 0.2 13.96 21.6257 0.9962 1329589 IFLab1_004821 COc1ccc(Nc2oc(nc2C#N)c3ccccc3Cl)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L04 compound treatment 0.072 0.00225 0.14 0.062 -0.00216 -0.15 -0.0041 -0.0197 2068048 IFLab1_004822 Cc1ccccc1NC(=O)CC(NCc2ccccc2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L05 compound treatment 0.107 0.0372 2.4 0.079 0.0148 1.04 2.4286 0.9297 1599499 IFLab1_004823 COc1cccc(c1)C(=O)N=c2sc3cc(ccc3n2C)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L06 compound treatment 0.064 -0.00575 -0.37 0.064 -1.56E-4 -0.01 -0.2694 -0.7276 1577554 IFLab1_004824 CCC(C)c1ccccc1OCC(O)CNC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L07 compound treatment 0.152 0.0823 5.29 0.113 0.0488 3.41 6.1562 0.9774 1280637 IFLab1_004825 Cc1ccc(NC(=O)CSC2=C(C#N)C(C3=C(CCCC3=O)N2)c4ccc(C)cc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L08 compound treatment 0.077 0.00725 0.47 0.08 0.0158 1.11 1.1126 0.9263 1216919 IFLab1_004826 OC1=C(C(N(Cc2cccnc2)C1=O)c3ccc(F)cc3)C(=O)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L09 compound treatment 0.403 0.333 21.45 0.296 0.232 16.2 26.6199 0.9904 1733784 IFLab1_004827 CCOC(=O)CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccc(cc3)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L10 compound treatment 0.074 0.00425 0.27 0.063 -0.00116 -0.08 0.1363 0.4779 1422056 IFLab1_004828 COc1ccc(cc1)C(=O)NCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L11 compound treatment 0.167 0.0973 6.26 0.128 0.0638 4.46 7.5799 0.9862 2068049 IFLab1_004829 O=S(=O)(N1CCOCC1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L12 compound treatment 0.092 0.0222 1.43 0.08 0.0158 1.11 1.7953 0.9919 2068050 IFLab1_004830 COc1ccc(OC)c(c1)S(=O)(=O)Nc2cc(Cl)ccc2OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L13 compound treatment 0.069 -7.5E-4 -0.05 0.064 -1.56E-4 -0.01 -0.0419 -0.8456 2068051 IFLab1_004831 NC(=O)CCn1cnc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L14 compound treatment 0.053 -0.0168 -1.08 0.049 -0.0152 -1.06 -1.511 -1.0 2068052 IFLab1_004832 COc1ccc(C=C2C(=O)c3ccccc3C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L15 compound treatment 0.208 0.138 8.9 0.17 0.106 7.39 11.5207 0.9958 1136508 IFLab1_004833 C(Cn1c(nc2ccccc12)c3ccco3)Oc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L16 compound treatment 0.089 0.0193 1.24 0.075 0.0108 0.76 1.4118 0.9721 2068053 IFLab1_004834 COc1ccc(cc1)c2csc3ncnc(n4nc(C)cc4N)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L17 compound treatment 0.065 -0.00475 -0.31 0.065 8.44E-4 0.06 -0.1745 -0.5605 1334590 IFLab1_004835 Cc1cc(NC(c2c(C)[nH]c3ccccc23)c4ccccn4)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L18 compound treatment 0.094 0.0243 1.56 0.109 0.0448 3.13 3.3189 0.9482 1699433 IFLab1_004836 C=CCSc1nnc(o1)c2ccncc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L19 compound treatment 0.075 0.00525 0.34 0.068 0.00384 0.27 0.4288 0.9935 1314063 IFLab1_004837 Clc1ccc(cc1)C(=O)Oc2c(CN3CCOCC3)cc(Cl)c4cccnc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L20 compound treatment 0.105 0.0352 2.27 0.091 0.0268 1.88 2.9304 0.9955 1271753 IFLab1_004838 CC1=C(C(C(=C(N1)SCC(=O)N)C#N)c2ccccc2Cl)C(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L21 compound treatment 0.053 -0.0168 -1.08 0.048 -0.0162 -1.13 -1.5604 -0.9997 1449299 IFLab1_004839 Cc1ccc(CCC(=O)Nc2ccc(cc2)C(=O)O)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L22 compound treatment 0.074 0.00425 0.27 0.072 0.00784 0.55 0.5809 0.9485 1301330 IFLab1_004840 CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccc(OCc4ccccc4)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L23 mock treatment 0.07 2.5E-4 0.02 0.067 0.00284 0.2 0.1519 0.7619 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 L24 mock treatment 0.068 -0.00175 -0.11 0.064 -1.56E-4 -0.01 -0.0874 -0.772 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M01 compound treatment 0.081 0.0113 0.72 0.075 0.0108 0.76 1.0477 0.9997 2068054 IFLab1_004841 CC(=O)N1CC(=O)Nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M02 compound treatment 0.089 0.0193 1.24 0.071 0.00684 0.48 1.2142 0.9143 1454506 IFLab1_004842 COC(=O)c1c(C)c(C)sc1NC(=O)CC2Sc3ccccc3NC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M03 compound treatment 0.077 0.00725 0.47 0.06 -0.00416 -0.29 0.1247 0.2268 1540390 IFLab1_004843 COC1(NC(=O)c2ccccc2)C(=CC(=O)C=C1C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M04 compound treatment 0.094 0.0243 1.56 0.077 0.0128 0.9 1.7381 0.9654 1681787 IFLab1_004844 CCc1cc2c(=O)c(c(C)oc2cc1OCC(=O)O)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M05 compound treatment 0.148 0.0783 5.04 0.13 0.0658 4.6 6.814 0.999 1373556 IFLab1_004845 COc1cc(C)ccc1S(=O)(=O)n2cnc3cc(C)c(C)cc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M06 compound treatment 0.074 0.00425 0.27 0.064 -1.56E-4 -0.01 0.1857 0.6784 1638669 IFLab1_004846 CN(C(=O)c1ccc(Cl)cc1)C2(C)CCS(=O)(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M07 compound treatment 0.07 2.5E-4 0.02 0.079 0.0148 1.04 0.7446 0.718 2068055 IFLab1_004847 O=C/1NC(=S)S\C1=C/Nc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M08 compound treatment 0.053 -0.0168 -1.08 0.053 -0.0112 -0.78 -1.3134 -0.9873 2068056 IFLab1_004848 Cc1nc2ccccc2n1CCCOc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M09 compound treatment 0.054 -0.0158 -1.01 0.079 0.0148 1.04 0.0164 0.0113 2068057 IFLab1_004849 Cc1cc(O)c(/C=N/c2ccccn2)c(=O)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M10 compound treatment 0.08 0.0103 0.66 0.061 -0.00316 -0.22 0.3106 0.4465 2068058 IFLab1_004850 NC(=O)CC1SC(=O)NC1=N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M11 compound treatment 0.075 0.00525 0.34 0.064 -1.56E-4 -0.01 0.2312 0.6839 1679062 IFLab1_004851 Cc1ccc(C)n1CCN2CCN(CC2)C(=O)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M12 compound treatment 0.06 -0.00975 -0.63 0.056 -0.00816 -0.57 -0.8467 -0.9988 1635935 IFLab1_004852 CCCn1c(nc2ccccc12)c3ccc(cc3)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M13 compound treatment 0.077 0.00725 0.47 0.07 0.00584 0.41 0.6186 0.9978 2068059 IFLab1_004853 COc1cccc(NC(=O)CCCN2C(=O)/C(=C\c3ccco3)/SC2=S)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M14 compound treatment 0.093 0.0233 1.5 0.086 0.0218 1.53 2.1372 1.0 1365021 IFLab1_004854 COc1ccc(cc1OC)C2CC(=O)n3nc(nc3S2)c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M15 compound treatment 0.057 -0.0127 -0.82 0.062 -0.00216 -0.15 -0.6868 -0.8231 2068060 IFLab1_004855 Fc1cccc(NC(=O)CCCN2C(=O)/C(=C/C=C/c3ccccc3)/SC2=S)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M16 compound treatment 0.072 0.00225 0.14 0.069 0.00484 0.34 0.3417 0.9283 1353446 IFLab1_004856 Cc1ccc2c(CC(=O)O)cc(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M17 compound treatment 0.067 -0.00275 -0.18 0.063 -0.00116 -0.08 -0.1823 -0.9369 2068061 IFLab1_004857 CCNC(=O)CC1Sc2ccc(cc2NC1=O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M18 compound treatment 0.08 0.0103 0.66 0.064 -1.56E-4 -0.01 0.4588 0.6953 1175381 IFLab1_004858 Cc1c(CCC#N)c(O)n2c3ccccc3nc2c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M19 compound treatment 0.055 -0.0147 -0.95 0.059 -0.00516 -0.36 -0.926 -0.912 2068062 IFLab1_004859 O=C1C=CC(=O)N1c2ccccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M20 compound treatment 0.077 0.00725 0.47 0.066 0.00184 0.13 0.421 0.8698 2068063 IFLab1_004860 CCOC(=O)c1c(C)oc-2c1/C(=C/NCC3CCCO3)/C(=O)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M21 compound treatment 0.072 0.00225 0.14 0.059 -0.00516 -0.36 -0.1523 -0.3923 1389116 IFLab1_004861 CCNC(=O)CC1Nc2cc(C)c(C)cc2NC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M22 compound treatment 0.067 -0.00275 -0.18 0.067 0.00284 0.2 0.0153 0.0576 1354410 IFLab1_004862 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)Nc4ccc(C)cn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M23 mock treatment 0.073 0.00325 0.21 0.058 -0.00616 -0.43 -0.1562 -0.3266 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 M24 mock treatment 0.072 0.00225 0.14 0.061 -0.00316 -0.22 -0.0535 -0.2028 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N01 compound treatment 0.039 -0.0308 -1.98 0.038 -0.0262 -1.83 -2.6916 -0.9992 1348243 IFLab1_004863 Fc1ccccc1c2nc(C#N)c(NCCN3CCOCC3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N02 compound treatment 0.078 0.00825 0.53 0.063 -0.00116 -0.08 0.3184 0.5927 2068064 IFLab1_004864 Cc1cccc(C)c1NC(=O)CC(NCc2ccco2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N03 compound treatment 0.067 -0.00275 -0.18 0.062 -0.00216 -0.15 -0.2317 -0.9968 1144471 IFLab1_004865 CN(C)CCNc1oc(nc1C#N)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N04 compound treatment 0.072 0.00225 0.14 0.058 -0.00616 -0.43 -0.2017 -0.4445 2068065 IFLab1_004866 COc1ccccc1NC(=O)CC(N(C)C)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N05 compound treatment 0.092 0.0222 1.43 0.077 0.0128 0.9 1.6471 0.9746 1631308 IFLab1_004867 Cn1c(=NC(=O)c2cccc3ccccc23)sc4cc(ccc14)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N06 compound treatment 0.061 -0.00875 -0.56 0.057 -0.00716 -0.5 -0.7517 -0.9982 1636718 IFLab1_004868 CCC(C)c1ccccc1OCC(O)CN2CCN(Cc3ccc4OCOc4c3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N07 compound treatment 0.265 0.195 12.57 0.2 0.136 9.49 15.5969 0.9904 1582749 IFLab1_004869 COc1cc(ccc1O)C2C(=C(NC3=C2C(=O)CCC3)SCc4ccccc4)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N08 compound treatment 0.072 0.00225 0.14 0.066 0.00184 0.13 0.1935 0.9983 1529622 IFLab1_004870 OC1=C(C(N(Cc2cccnc2)C1=O)c3ccncc3)C(=O)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N09 compound treatment 0.124 0.0543 3.49 0.246 0.182 12.7 11.4519 0.8692 1714926 IFLab1_004871 CC(C)c1ccc(cc1)C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)N)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N10 compound treatment 0.063 -0.00675 -0.43 0.067 0.00284 0.2 -0.1667 -0.349 1655271 IFLab1_004872 CC(C)C(NC(=O)COc1ccccc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N11 compound treatment 0.475 0.405 26.08 0.44 0.376 26.26 37.0102 1.0 2068066 IFLab1_004873 O=S(=O)(N1CCCCC1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N12 compound treatment 0.075 0.00525 0.34 0.067 0.00284 0.2 0.3794 0.9679 1728353 IFLab1_004874 CC(C)c1ccc(C)c(c1)S(=O)(=O)NCc2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N13 compound treatment 0.064 -0.00575 -0.37 0.063 -0.00116 -0.08 -0.3188 -0.8416 1056487 IFLab1_004875 CCOC(CSc1nc2ccccc2[nH]1)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N14 compound treatment 0.069 -7.5E-4 -0.05 0.069 0.00484 0.34 0.2051 0.6002 2068067 IFLab1_004876 CS/C(=C/1\CCCCC1=O)/NC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N15 compound treatment 0.066 -0.00375 -0.24 0.065 8.44E-4 0.06 -0.129 -0.5192 1513471 IFLab1_004877 Nc1ccc(cc1)c2nc3ccccc3n2CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N16 compound treatment 0.055 -0.0147 -0.95 0.056 -0.00816 -0.57 -1.0742 -0.9702 1648406 IFLab1_004878 CC1CCc2c(C1)sc3ncnc(NCCN4CCOCC4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N17 compound treatment 0.056 -0.0138 -0.89 0.055 -0.00916 -0.64 -1.0781 -0.9873 1185990 IFLab1_004879 CC1CCN(CC1)C(c2c(C)[nH]c3ccccc23)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N18 compound treatment 0.07 2.5E-4 0.02 0.061 -0.00316 -0.22 -0.1445 -0.6538 1349673 IFLab1_004880 Cc1cc(C)n(n1)C(=O)C2CCCN2S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N19 compound treatment 0.056 -0.0138 -0.89 0.053 -0.0112 -0.78 -1.1769 -0.998 1283648 IFLab1_004881 Cc1[nH]c2ccccc2c1C(N3CCCCC3)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N20 compound treatment 0.048 -0.0217 -1.4 0.052 -0.0122 -0.85 -1.5904 -0.9713 1412058 IFLab1_004882 CCOC(=O)CSC1=C(C#N)C(C)C2=C(CCCC2=O)N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N21 compound treatment 0.185 0.115 7.42 0.156 0.0918 6.42 9.7823 0.9974 1341013 IFLab1_004883 CN(C1CCCCC1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N22 compound treatment 0.073 0.00325 0.21 0.062 -0.00216 -0.15 0.0414 0.1606 1230304 IFLab1_004884 CCSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccc(OCc4ccccc4)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N23 mock treatment 0.067 -0.00275 -0.18 0.067 0.00284 0.2 0.0153 0.0576 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 N24 mock treatment 0.064 -0.00575 -0.37 0.064 -1.56E-4 -0.01 -0.2694 -0.7276 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O01 compound treatment 0.093 0.0233 1.5 0.073 0.00884 0.62 1.495 0.9234 1683671 IFLab1_004885 COc1cccc(NC(=O)c2cc3cccc(CC=C)c3oc2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O02 compound treatment 0.18 0.11 7.1 0.135 0.0708 4.95 8.5174 0.9845 2068068 IFLab1_004886 Oc1ccc(c2n[nH]c(c2c3cnn(c3)c4ccccc4)C(F)(F)F)c(O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O03 compound treatment 0.082 0.0123 0.79 0.069 0.00484 0.34 0.7968 0.9287 1578971 IFLab1_004887 COc1ccc(cc1)C(=O)Nc2sc3CCCCc3c2C(=O)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O04 compound treatment 0.074 0.00425 0.27 0.072 0.00784 0.55 0.5809 0.9485 1295379 IFLab1_004888 CCc1cc2c(=O)c(Oc3ccccc3F)c(C)oc2cc1OCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O05 compound treatment 0.052 -0.0177 -1.14 0.055 -0.00916 -0.64 -1.2602 -0.9624 1082126 IFLab1_004889 Cc1ccc(NC(=O)c2ccco2)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O06 compound treatment 0.065 -0.00475 -0.31 0.058 -0.00616 -0.43 -0.5203 -0.986 2068069 IFLab1_004890 Cc1nc2ccc(Br)cc2c(c3ccccc3)c1C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O07 compound treatment 0.068 -0.00175 -0.11 0.072 0.00784 0.55 0.3078 0.5502 2068070 IFLab1_004891 CCN1C(=O)/C(=C/Nc2nc3ccccc3[nH]2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O08 compound treatment 0.052 -0.0177 -1.14 0.051 -0.0132 -0.92 -1.4578 -0.9942 1320029 IFLab1_004892 ONC(=O)c1sc2ccccc2c1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O09 compound treatment 0.256 0.186 11.99 0.061 -0.00316 -0.22 8.3209 0.694 2068071 IFLab1_004893 Cc1cc(O)c(/C=N/c2ccc(I)cc2)c(=O)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O10 compound treatment 0.07 2.5E-4 0.02 0.064 -1.56E-4 -0.01 0.0037 0.1882 2068072 IFLab1_004894 COC(=O)CC/1SC(=O)N\C1=N\c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O11 compound treatment 0.068 -0.00175 -0.11 0.064 -1.56E-4 -0.01 -0.0874 -0.772 1458878 IFLab1_004895 Cc1ccc(C)n1CCN2CCN(CC2)C(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O12 compound treatment 0.555 0.485 31.23 0.543 0.479 33.45 45.7392 0.9994 1191331 IFLab1_004896 Oc1cccc2CCCN(c12)S(=O)(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O13 compound treatment 0.074 0.00425 0.27 0.06 -0.00416 -0.29 -0.0119 -0.0298 2068073 IFLab1_004897 COc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccco3)/SC2=S)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O14 compound treatment 0.079 0.00925 0.6 0.075 0.0108 0.76 0.9567 0.9929 2068074 IFLab1_004898 Cc1ccc(/C=C/C(=O)O)cc1S(=O)(=O)NCc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O15 compound treatment 0.064 -0.00575 -0.37 0.063 -0.00116 -0.08 -0.3188 -0.8416 2068075 IFLab1_004899 O=C(CCCN1C(=O)/C(=C/C=C/c2ccccc2)/SC1=S)Nc3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O16 compound treatment 0.06 -0.00975 -0.63 0.066 0.00184 0.13 -0.3527 -0.5505 1040166 IFLab1_004900 OC(=O)Cc1cc(=O)oc2cc(O)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O17 compound treatment 0.044 -0.0257 -1.66 0.044 -0.0202 -1.41 -2.1676 -0.9967 2068076 IFLab1_004901 Oc1ccc2ccccc2c1/C=N/S(=O)(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O18 compound treatment 0.063 -0.00675 -0.43 0.058 -0.00616 -0.43 -0.6113 -1.0 2068077 IFLab1_004902 Clc1ccc(cc1)c2csc3ncnc(Cl)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O19 compound treatment 0.068 -0.00175 -0.11 0.065 8.44E-4 0.06 -0.038 -0.2987 1404527 IFLab1_004903 CC(=O)Oc1ccc(cc1)N2C(=O)C3C4OC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O20 compound treatment 0.079 0.00925 0.6 0.07 0.00584 0.41 0.7097 0.9831 2068078 IFLab1_004904 CCOC(=O)c1c(C)oc-2c1/C(=C/NCc3ccco3)/C(=O)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O21 compound treatment 0.071 0.00125 0.08 0.065 8.44E-4 0.06 0.0986 0.9883 2068079 IFLab1_004905 COC(=O)c1c(C)c(C)sc1N2C(=O)C3CC(=C(C)CC3C2=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O22 compound treatment 0.081 0.0113 0.72 0.07 0.00584 0.41 0.8007 0.9632 1566101 IFLab1_004906 CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)Nc4cccc(C)n4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O23 mock treatment 0.064 -0.00575 -0.37 0.065 8.44E-4 0.06 -0.22 -0.5871 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 O24 mock treatment 0.072 0.00225 0.14 0.06 -0.00416 -0.29 -0.1029 -0.3172 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P01 compound treatment 0.279 0.209 13.47 0.16 0.0958 6.7 14.2581 0.948 1424679 IFLab1_004907 Fc1ccccc1c2nc(C#N)c(NCCc3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P02 compound treatment 0.083 0.0133 0.85 0.075 0.0108 0.76 1.1387 0.9983 2068080 IFLab1_004908 CN(C)C(CC(=O)Nc1c(C)cccc1C)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P03 compound treatment 0.041 -0.0288 -1.85 0.041 -0.0232 -1.62 -2.4524 -0.9978 1921619 IFLab1_004909 OC(=O)/C=C\C(=O)Nc1ccc(Cl)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P04 compound treatment 0.079 0.00925 0.6 0.067 0.00284 0.2 0.5615 0.8946 2068081 IFLab1_004910 Cc1ccc(C)c(NC(=O)CC(NCCc2ccccc2)C(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P05 compound treatment 0.086 0.0163 1.05 0.082 0.0178 1.25 1.621 0.9962 1647669 IFLab1_004911 Cn1c(=NC(=O)c2ccco2)sc3cc(ccc13)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P06 compound treatment 0.06 -0.00975 -0.63 0.06 -0.00416 -0.29 -0.6491 -0.9387 1630888 IFLab1_004912 CCC(OCC(O)CN1CCCC1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P07 compound treatment 0.08 0.0103 0.66 0.072 0.00784 0.55 0.854 0.9957 1335997 IFLab1_004913 CCSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3cccc(Cl)c3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P08 compound treatment 0.075 0.00525 0.34 0.076 0.0118 0.83 0.824 0.922 1579335 IFLab1_004914 Cc1ccc(cc1)C2N(CCN3CCOCC3)C(=O)C(=C2C(=O)c4ccccc4)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P09 compound treatment 0.146 0.0762 4.91 0.121 0.0568 3.97 6.2783 0.9945 1438643 IFLab1_004915 COC(=O)C1C(C(=C(NC1=O)SCc2ccccc2Cl)C#N)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P10 compound treatment 0.077 0.00725 0.47 0.068 0.00384 0.27 0.5198 0.9656 1199415 IFLab1_004916 OC(=O)C(Cc1ccccc1)NC(=O)COc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P11 compound treatment 0.118 0.0483 3.11 0.109 0.0448 3.13 4.4112 1.0 2068082 IFLab1_004917 COc1ccccc1NS(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P12 compound treatment 0.086 0.0163 1.05 0.078 0.0138 0.97 1.4234 0.9992 1301866 IFLab1_004918 COc1cc(Cl)c(cc1Cl)S(=O)(=O)NCc2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P13 compound treatment 0.081 0.0113 0.72 0.07 0.00584 0.41 0.8007 0.9632 1205579 IFLab1_004919 CCOC(Cn1c(nc2ccccc12)c3ccc(OC)cc3)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P14 compound treatment 0.079 0.00925 0.6 0.073 0.00884 0.62 0.8579 0.9998 1094785 IFLab1_004920 Oc1ccc(C=C2C(=O)c3ccccc3C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P15 compound treatment 0.082 0.0123 0.79 0.066 0.00184 0.13 0.6486 0.8119 1345180 IFLab1_004921 CCn1c(nc2ccccc12)c3ccc(N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P16 compound treatment 0.066 -0.00375 -0.24 0.063 -0.00116 -0.08 -0.2278 -0.895 2068083 IFLab1_004922 Cc1noc(C)c1CN2CCN(CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P17 compound treatment 0.069 -7.5E-4 -0.05 0.06 -0.00416 -0.29 -0.2394 -0.8135 1461963 IFLab1_004923 CCOC(=O)C1CCN(CC1)C(c2c(C)[nH]c3ccccc23)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P18 compound treatment 0.093 0.0233 1.5 0.092 0.0278 1.95 2.4336 0.9916 2068084 IFLab1_004924 Cc1c(O)ccc(c2n[nH]c(c2Oc3ccccc3)C(F)(F)F)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P19 compound treatment 0.073 0.00325 0.21 0.07 0.00584 0.41 0.4366 0.9518 2068085 IFLab1_004925 COc1ccccc1C2CC(=O)CC(S2)c3ccccc3OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P20 compound treatment 0.072 0.00225 0.14 0.069 0.00484 0.34 0.3417 0.9283 1268872 IFLab1_004926 CC1=C(C(C(=C(N1)SCC(=O)c2ccccc2)C#N)c3ccco3)C(=O)Nc4ccccc4C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P21 compound treatment 0.069 -7.5E-4 -0.05 0.066 0.00184 0.13 0.0569 0.414 1451347 IFLab1_004927 CN(C1CCCCC1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P22 compound treatment 0.085 0.0153 0.98 0.065 8.44E-4 0.06 0.7358 0.7482 1261725 IFLab1_004928 NC(=O)c1sc2NC(=O)CC(c2c1N)c3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P23 mock treatment 0.076 0.00625 0.4 0.07 0.00584 0.41 0.5731 1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1425 P24 mock treatment 0.072 0.00225 0.14 0.065 8.44E-4 0.06 0.1441 0.9215 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A01 compound treatment 0.072 0.0113 0.72 0.07 0.00994 0.69 1.0029 0.9998 1331393 IFLab1_004929 COc1ccc(cc1)C2C(=C(NC3=C2C(=O)CC(C)(C)C3)SCC(=O)Nc4ccccc4)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A02 compound treatment 0.069 0.00825 0.53 0.069 0.00894 0.62 0.817 0.9968 1299912 IFLab1_004930 CC1CCN(CC1)C(=O)c2ccc(cc2)C(=O)N3CCC(C)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A03 compound treatment 0.068 0.00725 0.47 0.073 0.0129 0.9 0.9691 0.9527 1234075 IFLab1_004931 CCOc1ccccc1C2C(=C(NC3=C2C(=O)CCC3)SC)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A04 compound treatment 0.075 0.0143 0.92 0.07 0.00994 0.69 1.1395 0.9906 1623784 IFLab1_004932 C(Sc1ccccn1)c2cn3cccnc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A05 compound treatment 0.107 0.0462 2.98 0.091 0.0309 2.16 3.6332 0.9876 1145453 IFLab1_004933 COC(=O)c1ccc(cc1)C(=O)Nc2ccccc2c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A06 compound treatment 0.097 0.0362 2.33 0.095 0.0349 2.44 3.3757 0.9997 1460803 IFLab1_004934 Cc1cc(Cl)ccc1OCc2cn3cccnc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A07 compound treatment 0.072 0.0113 0.72 0.064 0.00394 0.28 0.7065 0.9121 1458206 IFLab1_004935 CC1CN(CC(C)O1)c2nnnn2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A08 compound treatment 0.076 0.0153 0.98 0.074 0.0139 0.97 1.3826 1.0 1516662 IFLab1_004936 Cc1ccc(cc1)N(C2CS(=O)(=O)C=C2)C(=O)COc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A09 compound treatment 0.069 0.00825 0.53 0.068 0.00794 0.55 0.7676 0.9998 2068086 IFLab1_004937 COc1cccc(c1)c2nc3sc4CCCCc4c3c(=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A10 compound treatment 0.079 0.0182 1.17 0.084 0.0239 1.67 2.0131 0.9851 1134486 IFLab1_004938 COc1ccc(NC(=O)CSc2nc3CCCC(=O)c3cc2C#N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A11 compound treatment 0.063 0.00225 0.14 0.063 0.00294 0.21 0.2475 0.9854 2068087 IFLab1_004939 CC1CN(CCC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)CC(C)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A12 compound treatment 0.182 0.121 7.8 0.129 0.0689 4.82 8.9238 0.9731 1638070 IFLab1_004940 CCN(CC)C(=O)c1sc2nc3CC(C)(C)CC(=O)c3cc2c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A13 compound treatment 0.089 0.0283 1.82 0.078 0.0179 1.25 2.1718 0.9835 1253964 IFLab1_004941 C1CN(CCO1)c2nnc(c3cccs3)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A14 compound treatment 0.071 0.0103 0.66 0.069 0.00894 0.62 0.908 0.9996 2068088 IFLab1_004942 Cc1cc(C)c(C#N)c(SCc2cn3c(C)cccc3n2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A15 compound treatment 0.075 0.0143 0.92 0.066 0.00594 0.41 0.9419 0.9357 1676583 IFLab1_004943 Cc1sc2ncnc(NCc3ccc4OCOc4c3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A16 compound treatment 0.065 0.00425 0.27 0.063 0.00294 0.21 0.3385 0.99 1583138 IFLab1_004944 COC(=O)Cc1cc(=O)oc2cc(O)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A17 compound treatment 0.073 0.0123 0.79 0.062 0.00194 0.14 0.6532 0.8165 1667885 IFLab1_004945 CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc(C)c1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A18 compound treatment 0.07 0.00925 0.6 0.07 0.00994 0.69 0.9119 0.9971 1057190 IFLab1_004946 O=C(N1CCOCC1)c2c3CCCCc3nc4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A19 compound treatment 0.068 0.00725 0.47 0.067 0.00694 0.48 0.6727 0.9998 1398007 IFLab1_004947 Cc1cc(=O)oc2cc(Oc3nncc4ccccc34)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A20 compound treatment 0.066 0.00525 0.34 0.071 0.0109 0.76 0.7792 0.9327 2068089 IFLab1_004948 COc1cccc(NC(=O)CC2SC(=N)NC2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A21 compound treatment 0.076 0.0153 0.98 0.069 0.00894 0.62 1.1356 0.9761 1328045 IFLab1_004949 O=C(CSc1nnc2ccccn12)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A22 compound treatment 0.08 0.0193 1.24 0.08 0.0199 1.39 1.861 0.9983 1584108 IFLab1_004950 Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NC4CCSC4=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A23 mock treatment 0.063 0.00225 0.14 0.062 0.00194 0.14 0.1981 0.9994 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 A24 mock treatment 0.075 0.0143 0.92 0.073 0.0129 0.9 1.2877 1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B01 compound treatment 0.07 0.00925 0.6 0.084 0.0239 1.67 1.6035 0.9033 1420417 IFLab1_004951 COc1ccc(cc1)c2nc(NC(=O)C3CC3)sc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B02 compound treatment 0.072 0.0113 0.72 0.065 0.00494 0.34 0.7559 0.9425 1167951 IFLab1_004952 OC(CNC1CCCCC1)COc2ccc(cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B03 compound treatment 0.074 0.0133 0.85 0.072 0.0119 0.83 1.1927 0.9999 1158020 IFLab1_004953 O=C1CCCC2=C1C(c3cccs3)n4ncnc4N2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B04 compound treatment 0.058 -0.00275 -0.18 0.06 -6.25E-5 0.0 -0.1282 -0.7243 1274024 IFLab1_004954 CCN1C(=O)C2ON(C(C2C1=O)c3ccc(cc3)N(C)C)c4ccc(Cl)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B05 compound treatment 0.117 0.0563 3.62 0.125 0.0649 4.54 5.7679 0.9938 2068090 IFLab1_004955 C(c1cccs1)n2c(nc3ccccc23)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B06 compound treatment 0.07 0.00925 0.6 0.064 0.00394 0.28 0.6155 0.9385 2068091 IFLab1_004956 Nn1c(SCC(=O)NC2CCCCC2)nnc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B07 compound treatment 0.059 -0.00175 -0.11 0.06 -6.25E-5 0.0 -0.0827 -0.734 1449826 IFLab1_004957 CC1(C)CC(=C(C(c2c[nH]c3ccccc23)c4ccccn4)C(=O)C1)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B08 compound treatment 0.083 0.0222 1.43 0.072 0.0119 0.83 1.6024 0.9669 2068092 IFLab1_004958 Nc1ccccc1c2nnc(SCC(=O)c3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B09 compound treatment 0.108 0.0473 3.04 0.091 0.0309 2.16 3.6787 0.986 1569512 IFLab1_004959 COc1ccc(cc1OC)c2nn(cc2C(=O)N3CCCCC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B10 compound treatment 0.065 0.00425 0.27 0.063 0.00294 0.21 0.3385 0.99 1733756 IFLab1_004960 OC1=C(C(N(CCN2CCOCC2)C1=O)c3ccccc3F)C(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B11 compound treatment 0.138 0.0772 4.97 0.104 0.0439 3.07 5.6863 0.9731 2068093 IFLab1_004961 COc1ccc(cc1)c2nnc3sc(nn23)c4ccc(Br)o4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B12 compound treatment 0.066 0.00525 0.34 0.06 -6.25E-5 0.0 0.2359 0.6979 2068094 IFLab1_004962 COc1ccc(CCN2C(=O)/C(=C\3/C(=O)N(CC=C)c4ccccc34)/SC2=S)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B13 compound treatment 0.061 2.5E-4 0.02 0.064 0.00394 0.28 0.2059 0.7472 1572398 IFLab1_004963 Cc1cccn2cc(nc12)c3cccc(NC(=O)CCC(=O)O)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B14 compound treatment 0.071 0.0103 0.66 0.068 0.00794 0.55 0.8586 0.9963 1395341 IFLab1_004964 COc1ccc(cc1)S(=O)(=O)Nc2ccc3oc(=O)sc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B15 compound treatment 0.057 -0.00375 -0.24 0.055 -0.00506 -0.35 -0.4208 -0.9827 1573171 IFLab1_004965 CC(NCC(O)COc1ccc(Br)cc1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B16 compound treatment 0.068 0.00725 0.47 0.068 0.00794 0.55 0.7221 0.9963 1281253 IFLab1_004966 CC(=O)Oc1ccc(cc1)N(C(=O)C)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B17 compound treatment 0.447 0.386 24.86 0.319 0.259 18.09 30.3704 0.9878 1373656 IFLab1_004967 Clc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B18 compound treatment 0.064 0.00325 0.21 0.06 -6.25E-5 0.0 0.1448 0.6922 1353522 IFLab1_004968 CCOC(=O)c1sc(NC(=O)CSc2ccc(C)cc2)nc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B19 compound treatment 0.078 0.0173 1.11 0.07 0.00994 0.69 1.276 0.9744 1569733 IFLab1_004969 Cc1c(C)c2ccccc2n1CC(O)CNCC3CCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B20 compound treatment 0.061 2.5E-4 0.02 0.065 0.00494 0.34 0.2553 0.7393 2068095 IFLab1_004970 Cc1nnc(SCc2ccc(cc2)C(=O)c3ccc(F)cc3)nc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B21 compound treatment 0.067 0.00625 0.4 0.069 0.00894 0.62 0.726 0.9774 2068096 IFLab1_004971 Brc1ccc(cc1)n2cnnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B22 compound treatment 0.074 0.0133 0.85 0.068 0.00794 0.55 0.9951 0.9783 1391385 IFLab1_004972 NCC(O)COc1ccc2OCOc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B23 mock treatment 0.065 0.00425 0.27 0.063 0.00294 0.21 0.3385 0.99 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 B24 mock treatment 0.061 2.5E-4 0.02 0.067 0.00694 0.48 0.3541 0.7302 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C01 compound treatment 0.072 0.0113 0.72 0.077 0.0169 1.18 1.3487 0.9722 1252533 IFLab1_004973 COC(=O)CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C02 compound treatment 0.075 0.0143 0.92 0.073 0.0129 0.9 1.2877 1.0 1293687 IFLab1_004974 COc1ccc(cc1OC)S(=O)(=O)NCc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C03 compound treatment 0.073 0.0123 0.79 0.075 0.0149 1.04 1.2954 0.9904 2068097 IFLab1_004975 NC(=O)CSC1=C(C#N)C(C(C(=O)c2cccs2)C(O)(N1)C(F)(F)F)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C04 compound treatment 0.073 0.0123 0.79 0.068 0.00794 0.55 0.9496 0.9852 1523895 IFLab1_004976 C(Sc1nncc(n1)c2ccccc2)c3cn4cccnc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C05 compound treatment 0.528 0.467 30.07 0.461 0.401 28.01 41.0716 0.9994 2068098 IFLab1_004977 COC(=O)c1ccccc1NC(=O)CSc2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C06 compound treatment 0.062 0.00125 0.08 0.066 0.00594 0.41 0.3502 0.8288 1393524 IFLab1_004978 Fc1cccc(NCc2cn3cccnc3n2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C07 compound treatment 0.072 0.0113 0.72 0.061 9.38E-4 0.07 0.5583 0.7679 1541517 IFLab1_004979 CCOC(=O)c1c(NC(=O)CCN2CCOCC2)sc3CC(C)CCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C08 compound treatment 0.07 0.00925 0.6 0.067 0.00694 0.48 0.7637 0.9948 1551454 IFLab1_004980 COC(=O)C1=C(C)NC(=C(C#N)C1c2ccccc2F)SCC(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C09 compound treatment 0.056 -0.00475 -0.31 0.054 -0.00606 -0.42 -0.5157 -0.9872 1392911 IFLab1_004981 Cc1sc2ncnc(NC3CCN(Cc4ccccc4)CC3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C10 compound treatment 0.067 0.00625 0.4 0.07 0.00994 0.69 0.7754 0.9663 1174704 IFLab1_004982 CC1(C)CC(=O)c2cc(C#N)c(SCC(=O)N3CCc4ccccc34)nc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C11 compound treatment 1.383 1.32 85.11 1.42 1.36 95.01 127.3581 0.9985 1400707 IFLab1_004983 Cc1ccc(C)n1n2cnc3scc(c4cccs4)c3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C12 compound treatment 0.068 0.00725 0.47 0.063 0.00294 0.21 0.4751 0.9319 1428542 IFLab1_004984 Cc1ccc(cc1)C2CC(=O)Nc3sc(C(=O)N)c(N)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C13 compound treatment 0.071 0.0103 0.66 0.066 0.00594 0.41 0.7598 0.975 1526230 IFLab1_004985 Cc1ccc(cc1C)S(=O)(=O)NC(Cc2ccccc2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C14 compound treatment 0.067 0.00625 0.4 0.065 0.00494 0.34 0.5284 0.9971 1156965 IFLab1_004986 CCOC(=O)c1sc2nc(cc(c3ccc(OC)cc3)c2c1N)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C15 compound treatment 0.074 0.0133 0.85 0.069 0.00894 0.62 1.0445 0.9883 2068099 IFLab1_004987 Cc1sc2ncnc(SCC(=O)N3CCOCC3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C16 compound treatment 0.059 -0.00175 -0.11 0.063 0.00294 0.21 0.0655 0.2796 1205072 IFLab1_004988 CCC(=O)Oc1ccc2cc(c3nc4ccccc4n3C)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C17 compound treatment 1.083 1.02 65.8 1.004 0.944 65.94 93.1545 1.0 2068100 IFLab1_004989 CCOc1ncnc2sc(cc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C18 compound treatment 0.065 0.00425 0.27 0.069 0.00894 0.62 0.6349 0.9314 1517794 IFLab1_004990 CCN(CC)C(=O)c1c2CCCCc2nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C19 compound treatment 0.064 0.00325 0.21 0.065 0.00494 0.34 0.3918 0.9713 1419018 IFLab1_004991 C1Oc2ccc(Oc3nncc4ccccc34)cc2O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C20 compound treatment 0.065 0.00425 0.27 0.07 0.00994 0.69 0.6843 0.9171 1458982 IFLab1_004992 CCCCN1C(=O)C2ON(C(C2C1=O)c3cccs3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C21 compound treatment 0.075 0.0143 0.92 0.069 0.00894 0.62 1.0901 0.9824 2068101 IFLab1_004993 O=C(CSc1nnc2ccccn12)Nc3sc4CCCc4c3C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C22 compound treatment 0.074 0.0133 0.85 0.069 0.00894 0.62 1.0445 0.9883 1645696 IFLab1_004994 OC(=O)c1ccc(CN2C(=O)CSC2=S)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C23 mock treatment 0.062 0.00125 0.08 0.062 0.00194 0.14 0.1526 0.9691 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 C24 mock treatment 0.07 0.00925 0.6 0.062 0.00194 0.14 0.5167 0.8463 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D01 compound treatment 0.09 0.0293 1.88 0.078 0.0179 1.25 2.2173 0.9804 2068102 IFLab1_004995 CC(=O)Nc1nc(cs1)C2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D02 compound treatment 0.074 0.0133 0.85 0.064 0.00394 0.28 0.7976 0.89 1181293 IFLab1_004996 CCN1CCN(CC(O)COc2ccc(cc2)C(=O)OC)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D03 compound treatment 0.071 0.0103 0.66 0.069 0.00894 0.62 0.908 0.9996 1422173 IFLab1_004997 COc1ccc(cc1)c2nc3ccccc3n2C(=O)c4ccccc4C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D04 compound treatment 0.074 0.0133 0.85 0.073 0.0129 0.9 1.2421 0.9996 1468196 IFLab1_004998 CCOc1ccc(cc1)S(=O)(=O)Nc2cnc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D05 compound treatment 0.083 0.0222 1.43 0.082 0.0219 1.53 2.0963 0.9994 1242970 IFLab1_004999 Cc1ccccc1OCc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D06 compound treatment 0.078 0.0173 1.11 0.067 0.00694 0.48 1.1278 0.9309 2068103 IFLab1_005000 FC(F)(F)c1ccccc1NC(=O)CSc2nnc3CCCCCn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D07 compound treatment 0.062 0.00125 0.08 0.066 0.00594 0.41 0.3502 0.8288 1519864 IFLab1_005001 COc1ccc(cc1OC)C(Nc2ccccn2)c3c(C)[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D08 compound treatment 0.04 -0.0208 -1.34 0.043 -0.0171 -1.19 -1.7873 -0.9984 2068104 IFLab1_005002 CC(C)(C)C1=N/C(=C\c2ccccc2)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D09 compound treatment 0.126 0.0653 4.2 0.111 0.0509 3.56 5.4859 0.9966 2068105 IFLab1_005003 COc1ccc(cc1)c2nn(cc2/C=C\C(=O)N)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D10 compound treatment 0.087 0.0262 1.69 0.084 0.0239 1.67 2.3772 1.0 1480863 IFLab1_005004 COc1ccc(cc1)C(=O)c2oc3ccccc3c2NC(=O)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D11 compound treatment 0.073 0.0123 0.79 0.076 0.0159 1.11 1.3448 0.9857 2068106 IFLab1_005005 OC(=O)CSc1nnc(c2ccco2)n1Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D12 compound treatment 0.074 0.0133 0.85 0.071 0.0109 0.76 1.1433 0.9985 1604864 IFLab1_005006 Cn1c(SCC(=O)NCc2cccnc2)nnc1c3sc4ccccc4c3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D13 compound treatment 0.103 0.0423 2.72 0.081 0.0209 1.46 2.9572 0.9577 1547076 IFLab1_005007 Cc1ccc(cc1)C2SCCN2S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D14 compound treatment 0.062 0.00125 0.08 0.059 -0.00106 -0.07 0.0044 0.0402 1164761 IFLab1_005008 Cc1ccc(c(C)c1)S(=O)(=O)Nc2ccc(O)c(c2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D15 compound treatment 0.057 -0.00375 -0.24 0.053 -0.00706 -0.49 -0.5195 -0.9459 1375016 IFLab1_005009 CN(CC(O)COc1ccc(Br)cc1)C2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D16 compound treatment 0.077 0.0163 1.05 0.068 0.00794 0.55 1.1317 0.956 1437364 IFLab1_005010 CCCC(=O)Oc1ccc(cc1)N(C(=O)CCC)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D17 compound treatment 0.063 0.00225 0.14 0.056 -0.00406 -0.28 -0.0983 -0.3084 1468627 IFLab1_005011 CS(=O)(=O)N1CCN(CC1)c2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D18 compound treatment 0.239 0.178 11.47 0.192 0.132 9.22 14.6302 0.9941 1490534 IFLab1_005012 Cc1ccc(SCC(=O)Nc2ccc(I)cn2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D19 compound treatment 0.066 0.00525 0.34 0.062 0.00194 0.14 0.3347 0.9193 1164764 IFLab1_005013 Cc1c(C)c2ccccc2n1CC(O)CN3CCN(CCO)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D20 compound treatment 0.064 0.00325 0.21 0.065 0.00494 0.34 0.3918 0.9713 1588258 IFLab1_005014 COc1ccc(CCNc2nc3ccccc3s2)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D21 compound treatment 0.054 -0.00675 -0.43 0.055 -0.00506 -0.35 -0.5573 -0.9948 1415637 IFLab1_005015 CCOC(=O)c1ccc(NC(=O)C2(CCC3(C)C(=O)C2)C3(C)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D22 compound treatment 0.062 0.00125 0.08 0.058 -0.00206 -0.14 -0.045 -0.2726 2068107 IFLab1_005016 COc1ccc(CCNC(CC(=O)Nc2ccccc2)C(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D23 mock treatment 0.058 -0.00275 -0.18 0.061 9.38E-4 0.07 -0.0788 -0.4178 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 D24 mock treatment 0.06 -7.5E-4 -0.05 0.06 -6.25E-5 0.0 -0.0372 -0.7679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E01 compound treatment 0.158 0.0973 6.26 0.144 0.0839 5.86 8.5725 0.9995 1645465 IFLab1_005017 CC1(C)CC(=O)c2cc3c(N)c(sc3nc2C1)C(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E02 compound treatment 0.072 0.0113 0.72 0.066 0.00594 0.41 0.8053 0.965 2068108 IFLab1_005018 COc1ccc(OC)c(/C=N/c2sc3CCCc3c2C#N)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E03 compound treatment 0.056 -0.00475 -0.31 0.048 -0.0121 -0.84 -0.8121 -0.9059 1176253 IFLab1_005019 CCOC(=O)C1=C(NC(=O)C(C)(C#N)C21CCCCC2)SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E04 compound treatment 0.076 0.0153 0.98 0.067 0.00694 0.48 1.0368 0.9471 2068109 IFLab1_005020 C(Sc1ncn[nH]1)c2cn3cccnc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E05 compound treatment 0.061 2.5E-4 0.02 0.058 -0.00206 -0.14 -0.0905 -0.6243 2068110 IFLab1_005021 [O-][n+]1ccc(cc1)C(=O)NCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E06 compound treatment 0.086 0.0253 1.63 0.07 0.00994 0.69 1.6401 0.928 2068111 IFLab1_005022 FC(F)(F)c1cccc(NCc2cn3cccnc3n2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E07 compound treatment 0.078 0.0173 1.11 0.072 0.0119 0.83 1.3748 0.99 2068112 IFLab1_005023 O=C(CSc1ncnc2sc(cc12)c3ccccc3)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E08 compound treatment 0.082 0.0213 1.37 0.077 0.0169 1.18 1.8038 0.9974 1645072 IFLab1_005024 COC(=O)C1=C(C)NC(=C(C#N)C1c2ccccc2F)SCC(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E09 compound treatment 0.144 0.0833 5.36 0.136 0.0759 5.3 7.5401 1.0 1256364 IFLab1_005025 COCCn1c(C)cc(C(=O)CSc2ccc(Cl)cc2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E10 compound treatment 0.073 0.0123 0.79 0.071 0.0109 0.76 1.0978 0.9999 1337342 IFLab1_005026 Fc1ccc(cc1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E11 compound treatment 0.123 0.0623 4.01 0.106 0.0459 3.21 5.1024 0.9939 2068113 IFLab1_005027 O=C(CSc1nnc2sc3ccccc3n12)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E12 compound treatment 0.067 0.00625 0.4 0.063 0.00294 0.21 0.4296 0.9512 1434667 IFLab1_005028 COc1ccccc1C2CC(=O)NC(=C2C#N)SCC(=O)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E13 compound treatment 0.066 0.00525 0.34 0.056 -0.00406 -0.28 0.0383 0.0867 2068114 IFLab1_005029 COC(=O)c1cccc(Oc2ncnc3sc(C)c(C)c23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E14 compound treatment 0.113 0.0522 3.36 0.117 0.0569 3.98 5.1907 0.9965 1848330 IFLab1_005030 COc1ccc(cc1)C(=O)CSc2nc3CCCc3cc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E15 compound treatment 0.083 0.0222 1.43 0.077 0.0169 1.18 1.8493 0.9955 2068115 IFLab1_005031 CCN(CC)c1nnc(Cl)c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E16 compound treatment 0.059 -0.00175 -0.11 0.056 -0.00406 -0.28 -0.2803 -0.9181 1353147 IFLab1_005032 COc1ccccc1C(=O)NC2CCS(=O)(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E17 compound treatment 0.079 0.0182 1.17 0.078 0.0179 1.25 1.7167 0.9995 2068116 IFLab1_005033 O=C(CSc1nnc2sc3ccccc3n12)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E18 compound treatment 0.097 0.0362 2.33 0.102 0.0419 2.93 3.7215 0.9936 2068117 IFLab1_005034 COc1ccc(NC2=CC(=O)C=CC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E19 compound treatment 0.054 -0.00675 -0.43 0.061 9.38E-4 0.07 -0.2609 -0.5938 1213918 IFLab1_005035 CC1CCN(CC1)c2nncc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E20 compound treatment 0.085 0.0243 1.56 0.082 0.0219 1.53 2.1874 1.0 1546809 IFLab1_005036 CC(C)N1C(=O)C2ON(C(C2C1=O)c3cccs3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E21 compound treatment 0.061 2.5E-4 0.02 0.062 0.00194 0.14 0.1071 0.7856 1630387 IFLab1_005037 OC(=O)CCCC(=O)Nc1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E22 compound treatment 0.181 0.12 7.74 0.15 0.0899 6.28 9.9157 0.9946 1712984 IFLab1_005038 Cc1nc(SC(C(=O)O)c2ccccc2)cc(n1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E23 mock treatment 0.061 2.5E-4 0.02 0.063 0.00294 0.21 0.1565 0.7602 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 E24 mock treatment 0.071 0.0103 0.66 0.064 0.00394 0.28 0.661 0.9248 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F01 compound treatment 0.069 0.00825 0.53 0.069 0.00894 0.62 0.817 0.9968 1218828 IFLab1_005039 CCC(=O)Nc1nc(cs1)C2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F02 compound treatment 0.06 -7.5E-4 -0.05 0.057 -0.00306 -0.21 -0.1854 -0.8454 1676002 IFLab1_005040 COC(=O)c1ccc(OCC(O)CN2CCC(Cc3ccccc3)CC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F03 compound treatment 0.079 0.0182 1.17 0.075 0.0149 1.04 1.5685 0.9983 1347641 IFLab1_005041 OCCCc1nc2ccccc2n1Cc3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F04 compound treatment 0.086 0.0253 1.63 0.074 0.0139 0.97 1.8377 0.97 1653668 IFLab1_005042 COc1ccc(OC)c(c1)S(=O)(=O)Nc2cnc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F05 compound treatment 0.07 0.00925 0.6 0.069 0.00894 0.62 0.8625 0.9997 1266158 IFLab1_005043 COc1ccccc1OCc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F06 compound treatment 0.077 0.0163 1.05 0.068 0.00794 0.55 1.1317 0.956 2068118 IFLab1_005044 Cc1nnc2SCC(=Nn12)Nc3ccc(Br)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F07 compound treatment 0.048 -0.0127 -0.82 0.05 -0.0101 -0.7 -1.0774 -0.997 1259496 IFLab1_005045 Cc1[nH]c2ccccc2c1C(N3CCC(CC3)C(=O)N)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F08 compound treatment 0.069 0.00825 0.53 0.041 -0.0191 -1.33 -0.5662 -0.3949 2068119 IFLab1_005046 CCC1=N/C(=C\c2ccc(Br)cc2)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F09 compound treatment 0.083 0.0222 1.43 0.068 0.00794 0.55 1.4048 0.9147 2068120 IFLab1_005047 CC(=C)Cn1c(COc2ccc(Cl)cc2)nnc1SCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F10 compound treatment 0.059 -0.00175 -0.11 0.062 0.00194 0.14 0.0161 0.0912 2068121 IFLab1_005048 Cc1ccc(cc1)C(=O)N/C(=C\c2ccco2)/C(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F11 compound treatment 0.072 0.0113 0.72 0.068 0.00794 0.55 0.9041 0.9913 2068122 IFLab1_005049 OC(=O)CSc1nnc(c2ccc(Cl)cc2Cl)n1Cc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F12 compound treatment 0.055 -0.00575 -0.37 0.059 -0.00106 -0.07 -0.3142 -0.8323 1443992 IFLab1_005050 O=C(CSc1nnc(o1)c2ccncc2)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F13 compound treatment 0.076 0.0153 0.98 0.072 0.0119 0.83 1.2838 0.9967 2068123 IFLab1_005051 CS(=O)(=O)N1CCSC1c2ccccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F14 compound treatment 0.071 0.0103 0.66 0.074 0.0139 0.97 1.155 0.982 1714206 IFLab1_005052 OC(=O)c1cc(NS(=O)(=O)c2ccc3ccccc3c2)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F15 compound treatment 0.055 -0.00575 -0.37 0.051 -0.00906 -0.63 -0.7094 -0.9673 1277792 IFLab1_005053 C[N+]1(CC(O)COc2ccc(Br)cc2)CCCCC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F16 compound treatment 0.103 0.0423 2.72 0.094 0.0339 2.37 3.5994 0.9977 1396458 IFLab1_005054 Cc1cc(C)c(cc1C)S(=O)(=O)Nc2cc(SCC(=O)O)c(O)c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F17 compound treatment 0.066 0.00525 0.34 0.07 0.00994 0.69 0.7298 0.9453 1482477 IFLab1_005055 O=S(=O)(N1CCN(CC1)c2ccccn2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F18 compound treatment 0.104 0.0432 2.78 0.09 0.0299 2.09 3.4473 0.9901 1606813 IFLab1_005056 Cc1ccc(cc1)N(C2CS(=O)(=O)C=C2)C(=O)c3ccc(cc3)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F19 compound treatment 0.066 0.00525 0.34 0.071 0.0109 0.76 0.7792 0.9327 2068124 IFLab1_005057 CN(C)S(=O)(=O)n1c(C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F20 compound treatment 0.082 0.0213 1.37 0.084 0.0239 1.67 2.1496 0.995 1446334 IFLab1_005058 CCCCN1C(=O)C2ON(C(C2C1=O)c3cc(Br)ccc3O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F21 compound treatment 0.07 0.00925 0.6 0.063 0.00294 0.21 0.5661 0.8989 2068125 IFLab1_005059 Cc1nc(cs1)/C(=N\O)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F22 compound treatment 0.055 -0.00575 -0.37 0.056 -0.00406 -0.28 -0.4624 -0.9914 2068126 IFLab1_005060 CCc1ccc(NC(=O)CC(NCC2CCCO2)C(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F23 mock treatment 0.058 -0.00275 -0.18 0.058 -0.00206 -0.14 -0.227 -0.9948 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 F24 mock treatment 0.069 0.00825 0.53 0.062 0.00194 0.14 0.4712 0.8599 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G01 compound treatment 0.069 0.00825 0.53 0.07 0.00994 0.69 0.8664 0.9912 1394739 IFLab1_005061 NC(=O)c1sc2nc3CCCC(=O)c3cc2c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G02 compound treatment 0.058 -0.00275 -0.18 0.067 0.00694 0.48 0.2175 0.4216 1739828 IFLab1_005062 Oc1ccccc1NC(=O)c2cc3cc(Br)ccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G03 compound treatment 0.095 0.0343 2.2 0.087 0.0269 1.88 2.8895 0.9969 1309366 IFLab1_005063 Cc1nc2sc(C(=O)N)c(N)c2c(c3ccccc3)c1C(=O)Nc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G04 compound treatment 0.083 0.0222 1.43 0.076 0.0159 1.11 1.7999 0.9923 2068127 IFLab1_005064 C(Oc1ccccc1)c2cn3cccnc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G05 compound treatment 0.065 0.00425 0.27 0.059 -0.00106 -0.07 0.1409 0.4973 1738161 IFLab1_005065 COc1ccccc1NC(=O)c2ccncc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G06 compound treatment 0.099 0.0382 2.46 0.092 0.0319 2.23 3.3185 0.9988 1125229 IFLab1_005066 Clc1ccc(cc1)C2=CC(c3ccco3)n4ncnc4N2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G07 compound treatment 0.07 0.00925 0.6 0.067 0.00694 0.48 0.7637 0.9948 1480927 IFLab1_005067 OC(=O)C(Cc1ccccc1)NC(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G08 compound treatment 0.106 0.0452 2.91 0.102 0.0419 2.93 4.1311 1.0 1631224 IFLab1_005068 CCOc1ccc(cc1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G09 compound treatment 0.056 -0.00475 -0.31 0.061 9.38E-4 0.07 -0.1699 -0.5433 1258870 IFLab1_005069 O=C(CCN1CCCC1)Nc2ccc3OCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G10 compound treatment 0.065 0.00425 0.27 0.061 9.38E-4 0.07 0.2397 0.8523 1121089 IFLab1_005070 Fc1ccc(NC(=O)CSC2=C(C#N)C(CC(=O)N2)c3ccc(F)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G11 compound treatment 0.07 0.00925 0.6 0.069 0.00894 0.62 0.8625 0.9997 2068128 IFLab1_005071 S=c1[nH]cnc2sc(cc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G12 compound treatment 0.071 0.0103 0.66 0.069 0.00894 0.62 0.908 0.9996 1443171 IFLab1_005072 Cc1ccc(NC(=O)CSc2nc3CC(C)(C)CC(=O)c3cc2C#N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G13 compound treatment 0.054 -0.00675 -0.43 0.057 -0.00306 -0.21 -0.4585 -0.9467 1399296 IFLab1_005073 COC(=O)c1ccc(Oc2ncnc3sc(C)c(C)c23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G14 compound treatment 0.085 0.0243 1.56 0.081 0.0209 1.46 2.138 0.9995 1308667 IFLab1_005074 NC(=O)c1sc2nc3CCCCc3cc2c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G15 compound treatment 0.153 0.0922 5.94 0.144 0.0839 5.86 8.3449 1.0 2068129 IFLab1_005075 Cc1ccc(C)n1c2ccc3ncsc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G16 compound treatment 0.064 0.00325 0.21 0.063 0.00294 0.21 0.293 1.0 1462613 IFLab1_005076 COc1ccc(NC2CS(=O)(=O)CC2NCc3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G17 compound treatment 0.393 0.332 21.39 0.268 0.208 14.53 25.3934 0.9822 1717975 IFLab1_005077 Cc1sc2ncnc(NCCc3ccc4OCCOc4c3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G18 compound treatment 0.059 -0.00175 -0.11 0.061 9.38E-4 0.07 -0.0333 -0.2559 1468470 IFLab1_005078 Nc1nc(NS(=O)(=O)c2ccccc2)ns1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G19 compound treatment 0.065 0.00425 0.27 0.068 0.00794 0.55 0.5855 0.947 2068130 IFLab1_005079 COc1cc(cc(OC)c1OC)C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G20 compound treatment 0.064 0.00325 0.21 0.06 -6.25E-5 0.0 0.1448 0.6922 2068131 IFLab1_005080 CNC(=O)CC1Sc2ccc(cc2NC1=O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G21 compound treatment 0.056 -0.00475 -0.31 0.055 -0.00506 -0.35 -0.4663 -0.9974 2068132 IFLab1_005081 Cc1sc(/N=C\c2ccccc2Cl)c(C#N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G22 compound treatment 0.046 -0.0147 -0.95 0.045 -0.0151 -1.05 -1.4154 -0.9987 1338036 IFLab1_005082 OC(=O)CSC(=S)Nc1cccnc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G23 mock treatment 0.055 -0.00575 -0.37 0.057 -0.00306 -0.21 -0.413 -0.9661 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 G24 mock treatment 0.057 -0.00375 -0.24 0.063 0.00294 0.21 -0.0256 -0.0807 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H01 compound treatment 0.7 0.639 41.15 0.645 0.585 40.86 57.9891 1.0 1428215 IFLab1_005083 CC(=O)Nc1nc(COc2ccc3ccccc3c2)cs1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H02 compound treatment 0.072 0.0113 0.72 0.063 0.00294 0.21 0.6571 0.8731 1279006 IFLab1_005084 COC(=O)c1ccc(OCC(O)CNC(C)(C)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H03 compound treatment 0.075 0.0143 0.92 0.072 0.0119 0.83 1.2383 0.9989 1338644 IFLab1_005085 C=CCn1c(nc2ccccc12)C3CN(C(=O)C3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H04 compound treatment 0.071 0.0103 0.66 0.07 0.00994 0.69 0.9574 0.9997 1160276 IFLab1_005086 CC1CN(CC(C)O1)S(=O)(=O)c2ccc(cc2)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H05 compound treatment 0.213 0.152 9.8 0.172 0.112 7.82 12.4589 0.9937 1191645 IFLab1_005087 COc1ccc(cc1)C(=O)c2nccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H06 compound treatment 0.083 0.0222 1.43 0.072 0.0119 0.83 1.6024 0.9669 2068133 IFLab1_005088 Clc1ccc(NC2=Nn3cnnc3SC2)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H07 compound treatment 0.058 -0.00275 -0.18 0.056 -0.00406 -0.28 -0.3258 -0.9742 1557422 IFLab1_005089 COc1ccc(cc1)C(N2CCCC2)c3c(C)[nH]c4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H08 compound treatment 0.049 -0.0118 -0.76 0.049 -0.0111 -0.77 -1.0812 -0.9999 2068134 IFLab1_005090 CCC1=N/C(=C\c2ccc(C)cc2)/C(=O)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H09 compound treatment 0.083 0.0222 1.43 0.077 0.0169 1.18 1.8493 0.9955 2068135 IFLab1_005091 Brc1ccc(cc1)c2nnc3sc(nn23)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H10 compound treatment 0.074 0.0133 0.85 0.065 0.00494 0.34 0.847 0.9206 2068136 IFLab1_005092 Cc1ccc(cc1)C(=O)N/C(=C\c2ccco2)/C(=O)NCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H11 compound treatment 0.057 -0.00375 -0.24 0.057 -0.00306 -0.21 -0.322 -0.9982 2068137 IFLab1_005093 Cc1cccc(Cn2cnc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H12 compound treatment 0.058 -0.00275 -0.18 0.062 0.00194 0.14 -0.0295 -0.1322 1261610 IFLab1_005094 NS(=O)(=O)c1ccc(cc1)N2C(=O)C3C4CC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H13 compound treatment 0.078 0.0173 1.11 0.079 0.0189 1.32 1.7206 0.9962 1525872 IFLab1_005095 CS(=O)(=O)N1CCSC1c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H14 compound treatment 0.065 0.00425 0.27 0.06 -6.25E-5 0.0 0.1903 0.6957 1727653 IFLab1_005096 CC(C)(C)c1ccc(cc1)S(=O)(=O)Nc2ccc(O)c(c2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H15 compound treatment 0.144 0.0833 5.36 0.153 0.0929 6.49 8.3799 0.9955 2068138 IFLab1_005097 CCn1c(SCC(=O)c2ccccc2)nnc1c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H16 compound treatment 0.066 0.00525 0.34 0.073 0.0129 0.9 0.878 0.91 1719595 IFLab1_005098 Cc1cccc(NS(=O)(=O)c2cccs2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H17 compound treatment 0.143 0.0823 5.29 0.117 0.0569 3.98 6.5561 0.9901 1683592 IFLab1_005099 O=C1OCCC1Sc2nc3sc4CCCc4c3c(=O)[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H18 compound treatment 0.572 0.511 32.91 0.458 0.398 27.8 42.9259 0.9965 1873822 IFLab1_005100 CNC1=C(C(=O)c2ccccc2C1=O)n3nnc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H19 compound treatment 0.12 0.0592 3.81 0.11 0.0499 3.49 5.1635 0.999 2068139 IFLab1_005101 CN(C)S(=O)(=O)n1nc(C)c(Br)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H20 compound treatment 0.064 0.00325 0.21 0.059 -0.00106 -0.07 0.0954 0.4299 2068140 IFLab1_005102 Cc1ccc(NC(=O)CC2SC(=N)NC2=O)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H21 compound treatment 0.067 0.00625 0.4 0.066 0.00594 0.41 0.5778 0.9999 1234567 IFLab1_005103 CCOC(=O)N1CCN(CC(O)COc2ccc(cc2)c3ccccc3)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H22 compound treatment 0.053 -0.00775 -0.5 0.056 -0.00406 -0.28 -0.5534 -0.9643 2068141 IFLab1_005104 CCc1ccccc1NC(=O)CC(NCC2CCCO2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H23 mock treatment 0.058 -0.00275 -0.18 0.056 -0.00406 -0.28 -0.3258 -0.9742 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 H24 mock treatment 0.06 -7.5E-4 -0.05 0.063 0.00294 0.21 0.111 0.5264 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I01 compound treatment 0.092 0.0313 2.01 0.099 0.0389 2.72 3.3457 0.989 1217244 IFLab1_005105 Nc1c(sc2nc3CCCC(=O)c3cc12)C(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I02 compound treatment 0.069 0.00825 0.53 0.077 0.0169 1.18 1.2122 0.9346 1614490 IFLab1_005106 COc1ccc(cc1)S(=O)(=O)NCc2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I03 compound treatment 0.078 0.0173 1.11 0.074 0.0139 0.97 1.4736 0.9979 1339718 IFLab1_005107 COC(=O)c1sc2nc3CCCc3c(c4ccc(Cl)cc4)c2c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I04 compound treatment 0.085 0.0243 1.56 0.087 0.0269 1.88 2.4344 0.9957 2068142 IFLab1_005108 Cc1ccc(OCc2cn3cccnc3n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I05 compound treatment 0.062 0.00125 0.08 0.077 0.0169 1.18 0.8936 0.7534 1309285 IFLab1_005109 COc1cccc(NC(=O)c2ccncc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I06 compound treatment 0.061 2.5E-4 0.02 0.074 0.0139 0.97 0.6999 0.7187 1485320 IFLab1_005110 O=C1OCCC1Sc2nc3ccccc3c(=O)[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I07 compound treatment 0.068 0.00725 0.47 0.075 0.0149 1.04 1.0679 0.9342 1583959 IFLab1_005111 CC1CCN(CC1)C(=O)CSc2nnc3sc4ccccc4n23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I08 compound treatment 0.069 0.00825 0.53 0.073 0.0129 0.9 1.0146 0.9679 1227098 IFLab1_005112 CCOc1ccc(cc1)C2CC(=O)NC(=C2C#N)SCC(=O)Nc3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I09 compound treatment 0.076 0.0153 0.98 0.067 0.00694 0.48 1.0368 0.9471 2068143 IFLab1_005113 O=C(CSc1nnc2sc3ccccc3n12)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I10 compound treatment 0.107 0.0462 2.98 0.101 0.0409 2.86 4.1272 0.9998 1167233 IFLab1_005114 Fc1ccccc1C2CC(=O)NC(=C2C#N)SCC(=O)N(c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I11 compound treatment 0.093 0.0323 2.08 0.09 0.0299 2.09 2.9467 1.0 2068144 IFLab1_005115 Cc1nc(Cl)c2cc(sc2n1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I12 compound treatment 0.087 0.0262 1.69 0.083 0.0229 1.6 2.3278 0.9996 2068145 IFLab1_005116 CCSc1nc2CCCC(=O)c2cc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I13 compound treatment 0.056 -0.00475 -0.31 0.063 0.00294 0.21 -0.0711 -0.193 1322641 IFLab1_005117 Cc1nc(NCc2ccco2)c3c4CCCc4sc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I14 compound treatment 0.058 -0.00275 -0.18 0.06 -6.25E-5 0.0 -0.1282 -0.7243 1292254 IFLab1_005118 OC(=O)CCN1C(=O)C2CC=CCC2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I15 compound treatment 0.065 0.00425 0.27 0.061 9.38E-4 0.07 0.2397 0.8523 2068146 IFLab1_005119 O=C(CSc1nnc2sc3ccccc3n12)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I16 compound treatment 0.068 0.00725 0.47 0.066 0.00594 0.41 0.6233 0.9983 1167564 IFLab1_005120 COc1cccc(c1)N(C2CS(=O)(=O)C=C2)C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I17 compound treatment 0.068 0.00725 0.47 0.067 0.00694 0.48 0.6727 0.9998 1709494 IFLab1_005121 OC(=O)C(Cc1ccccc1)NS(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I18 compound treatment 0.062 0.00125 0.08 0.06 -6.25E-5 0.0 0.0538 0.6678 1558129 IFLab1_005122 CC1(C)CC(=O)C=C(C1)NCCO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I19 compound treatment 0.065 0.00425 0.27 0.059 -0.00106 -0.07 0.1409 0.4973 2068147 IFLab1_005123 OC(=O)C(Cc1ccccc1)NS(=O)(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I20 compound treatment 0.06 -7.5E-4 -0.05 0.061 9.38E-4 0.07 0.0122 0.1497 1568157 IFLab1_005124 Cc1onc(c1C(=O)NC2CCSC2=O)c3c(F)cccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I21 compound treatment 0.053 -0.00775 -0.5 0.053 -0.00706 -0.49 -0.7016 -1.0 1387264 IFLab1_005125 OC(=O)c1ccc(NC(=O)C2(CC3CC4CC(C3)C2)C4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I22 compound treatment 0.293 0.232 14.95 0.326 0.266 18.58 23.7072 0.9942 1382446 IFLab1_005126 COC(=O)Cn1c2ccccc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I23 mock treatment 0.056 -0.00475 -0.31 0.058 -0.00206 -0.14 -0.3181 -0.9411 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 I24 mock treatment 0.063 0.00225 0.14 0.058 -0.00206 -0.14 5.0E-4 0.0025 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J01 compound treatment 0.174 0.113 7.29 0.171 0.111 7.75 10.6345 0.9995 1461808 IFLab1_005127 CC(C)(C)C(=O)Nc1nc(COc2ccccc2)cs1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J02 compound treatment 0.064 0.00325 0.21 0.058 -0.00206 -0.14 0.046 0.1812 1562921 IFLab1_005128 COC(=O)c1ccc(OCC(O)CN2C(C)CCCC2C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J03 compound treatment 0.072 0.0113 0.72 0.067 0.00694 0.48 0.8547 0.9809 1570310 IFLab1_005129 CC(C)n1c(nc2ccccc12)c3ccc(cc3)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J04 compound treatment 0.064 0.00325 0.21 0.067 0.00694 0.48 0.4906 0.9294 1422437 IFLab1_005130 COc1ccc(OC)c(c1)S(=O)(=O)N2CCc3ccccc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J05 compound treatment 0.119 0.0583 3.75 0.101 0.0409 2.86 4.6734 0.9911 1611204 IFLab1_005131 OCc1nc(c2ccccc2)n3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J06 compound treatment 0.057 -0.00375 -0.24 0.065 0.00494 0.34 0.0732 0.1739 2068148 IFLab1_005132 C(Sc1ccccc1)c2nnc3CCCCCn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J07 compound treatment 0.189 0.128 8.25 0.175 0.115 8.03 11.5148 0.9999 2068149 IFLab1_005133 O=C/1NC(=S)S\C1=C/c2cn(CCC#N)nc2c3cccc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J08 compound treatment 0.177 0.116 7.48 0.199 0.139 9.71 12.1542 0.9917 2068150 IFLab1_005134 CCn1c(SCC=C)nnc1c2nnc(SCC=C)n2CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J09 compound treatment 0.215 0.154 9.93 0.148 0.0879 6.14 11.3643 0.9734 1657953 IFLab1_005135 Brc1ccc(o1)c2nn3c(Cc4ccccc4)nnc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J10 compound treatment 0.884 0.823 52.99 0.674 0.614 42.89 67.796 0.9945 1610795 IFLab1_005136 CCOC(=O)c1c(C)n(CC)c2ccc(OC(=O)c3ccco3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J11 compound treatment 0.071 0.0103 0.66 0.065 0.00494 0.34 0.7104 0.9543 1654477 IFLab1_005137 COCc1nc2ccccc2n1Cc3ccccc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J12 compound treatment 0.069 0.00825 0.53 0.062 0.00194 0.14 0.4712 0.8599 2068151 IFLab1_005138 CC(C)C(N1C(=O)C2C3CC(C=C3)C2C1=O)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J13 compound treatment 0.098 0.0372 2.4 0.109 0.0489 3.42 4.1128 0.9849 1597313 IFLab1_005139 CS(=O)(=O)N1CCSC1c2cccc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J14 compound treatment 0.094 0.0333 2.14 0.081 0.0209 1.46 2.5476 0.9828 1188701 IFLab1_005140 OC(=O)c1cc(NS(=O)(=O)c2ccc(Br)cc2)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J15 compound treatment 0.057 -0.00375 -0.24 0.063 0.00294 0.21 -0.0256 -0.0807 1570777 IFLab1_005141 CCCS(=O)(=O)N1CCN(CC1)c2ccc(OC)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J16 compound treatment 0.2 0.139 8.96 0.174 0.114 7.96 11.966 0.9982 2068152 IFLab1_005142 Oc1ccc(NS(=O)(=O)c2cccs2)cc1Sc3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J17 compound treatment 0.064 0.00325 0.21 0.066 0.00594 0.41 0.4412 0.9498 1270070 IFLab1_005143 OC(=O)C(CSc1ncccn1)CSc2ncccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J18 compound treatment 0.352 0.291 18.75 0.254 0.194 13.55 22.8358 0.9873 2068153 IFLab1_005144 CC(C)(C)NC1=C(C(=O)c2ccccc2C1=O)n3nnc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J19 compound treatment 0.071 0.0103 0.66 0.06 -6.25E-5 0.0 0.4634 0.7024 1203811 IFLab1_005145 O=S(=O)(N1CCOCC1)n2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J20 compound treatment 0.051 -0.00975 -0.63 0.052 -0.00806 -0.56 -0.842 -0.9985 1711842 IFLab1_005146 CCCCN1C(=O)C2ON(C(C2C1=O)c3ccco3)c4ccccc4C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J21 compound treatment 0.075 0.0143 0.92 0.071 0.0109 0.76 1.1889 0.9959 1201405 IFLab1_005147 CCN1CCN(CC(O)COc2ccc(cc2)c3ccccc3)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J22 compound treatment 0.058 -0.00275 -0.18 0.056 -0.00406 -0.28 -0.3258 -0.9742 2068154 IFLab1_005148 CN(C)C(CC(=O)Nc1ccc(O)cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J23 mock treatment 0.055 -0.00575 -0.37 0.05 -0.0101 -0.7 -0.7588 -0.9551 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 J24 mock treatment 0.062 0.00125 0.08 0.057 -0.00306 -0.21 -0.0944 -0.413 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K01 compound treatment 0.093 0.0323 2.08 0.084 0.0239 1.67 2.6503 0.9943 1253348 IFLab1_005149 Clc1cccc(NC(=O)CSC2=C(C#N)C(C3=C(CCCC3=O)N2)c4ccco4)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K02 compound treatment 0.071 0.0103 0.66 0.065 0.00494 0.34 0.7104 0.9543 1922360 IFLab1_005150 O=C(Oc1ccc2ccccc2c1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K03 compound treatment 0.042 -0.0187 -1.21 0.041 -0.0191 -1.33 -1.795 -0.9988 2068155 IFLab1_005151 c1ccc(nc1)c2ccc(nc2)c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K04 compound treatment 0.091 0.0302 1.95 0.091 0.0309 2.16 2.905 0.9986 1299905 IFLab1_005152 COc1ccc(OCc2cn3cccnc3n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K05 compound treatment 0.063 0.00225 0.14 0.072 0.0119 0.83 0.6921 0.8177 1731573 IFLab1_005153 Cn1c(Cc2ccccc2C(=O)O)nc(=O)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K06 compound treatment 0.051 -0.00975 -0.63 0.054 -0.00606 -0.42 -0.7432 -0.9817 2068156 IFLab1_005154 ONC(=O)c1ccc(cc1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K07 compound treatment 0.07 0.00925 0.6 0.066 0.00594 0.41 0.7143 0.9844 2068157 IFLab1_005155 Cc1[nH]c2ccccc2c1C(=O)CSc3nc(C)cc(C)c3C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K08 compound treatment 0.062 0.00125 0.08 0.066 0.00594 0.41 0.3502 0.8288 2068158 IFLab1_005156 CC(=O)Nc1ccc(NC=C2C(=O)CC(C)(C)CC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K09 compound treatment 0.062 0.00125 0.08 0.06 -6.25E-5 0.0 0.0538 0.6678 1523217 IFLab1_005157 CC(=O)Nc1ccc(OCc2c(C)noc2C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K10 compound treatment 0.084 0.0233 1.5 0.096 0.0359 2.51 2.8334 0.9694 1447953 IFLab1_005158 COC(=O)C1=C(C)NC(=C(C#N)C1c2ccccc2F)SCC(=O)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K11 compound treatment 0.318 0.257 16.56 0.056 -0.00406 -0.28 11.5075 0.6949 1493305 IFLab1_005159 COc1cc(CC=C)ccc1Oc2ncnc3sc(C)c(C)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K12 compound treatment 0.062 0.00125 0.08 0.062 0.00194 0.14 0.1526 0.9691 1190410 IFLab1_005160 NC(=O)CSc1nc2CCCC(=O)c2cc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K13 compound treatment 0.105 0.0442 2.85 0.091 0.0309 2.16 3.5422 0.9907 2068159 IFLab1_005161 Cc1sc2ncnc(SCc3ccco3)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K14 compound treatment 0.062 0.00125 0.08 0.06 -6.25E-5 0.0 0.0538 0.6678 1291239 IFLab1_005162 OC(=O)c1cccc(c1)N2C(=O)C3CC=CCC3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K15 compound treatment 0.168 0.107 6.9 0.16 0.0999 6.98 9.818 1.0 1446192 IFLab1_005163 COc1ccccc1Oc2ncnc3sc(cc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K16 compound treatment 0.081 0.0203 1.3 0.075 0.0149 1.04 1.6595 0.9939 1150502 IFLab1_005164 NC(=O)Cc1nc(cs1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K17 compound treatment 0.059 -0.00175 -0.11 0.057 -0.00306 -0.21 -0.2309 -0.9551 1725286 IFLab1_005165 C(Nc1nnc(c2cccs2)c3ccccc13)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K18 compound treatment 0.069 0.00825 0.53 0.065 0.00494 0.34 0.6194 0.9782 2068160 IFLab1_005166 Oc1ccc(NC(=O)CC2Sc3ccc(cc3NC2=O)C(F)(F)F)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K19 compound treatment 0.218 0.157 10.12 0.175 0.115 8.03 12.8346 0.9934 1568400 IFLab1_005167 COC(=O)c1c(NC(=O)CS(=O)(=O)c2ccccc2)scc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K20 compound treatment 0.634 0.573 36.9 0.552 0.492 34.37 50.3912 0.9994 1538826 IFLab1_005168 CC1CN(CC(C)O1)C(=O)c2cc3c(C)nn(c4ccccc4)c3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K21 compound treatment 0.052 -0.00875 -0.56 0.056 -0.00406 -0.28 -0.5989 -0.9497 1058262 IFLab1_005169 O=C(NCc1ccccc1)c2ccc(cc2)C(=O)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K22 compound treatment 0.061 2.5E-4 0.02 0.053 -0.00706 -0.49 -0.3375 -0.6837 1631849 IFLab1_005170 Oc1cccc(c1)N2C(=O)C3CC=CCC3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K23 mock treatment 0.06 -7.5E-4 -0.05 0.059 -0.00106 -0.07 -0.0866 -0.9783 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 K24 mock treatment 0.061 2.5E-4 0.02 0.06 -6.25E-5 0.0 0.0083 0.4973 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L01 compound treatment 0.075 0.0143 0.92 0.077 0.0169 1.18 1.4852 0.9921 1672084 IFLab1_005171 CC(C)(C)C(=O)NCC1(CC2CC3CC(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L02 compound treatment 0.067 0.00625 0.4 0.067 0.00694 0.48 0.6272 0.9957 1326538 IFLab1_005172 COC(=O)c1ccc(OCC(O)CN2CC(C)CC(C)C2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L03 compound treatment 0.061 2.5E-4 0.02 0.058 -0.00206 -0.14 -0.0905 -0.6243 2068161 IFLab1_005173 CC(=C)CSCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L04 compound treatment 0.055 -0.00575 -0.37 0.057 -0.00306 -0.21 -0.413 -0.9661 2068162 IFLab1_005174 Fc1ccc(Cn2cnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L05 compound treatment 0.076 0.0153 0.98 0.077 0.0169 1.18 1.5308 0.9957 1595692 IFLab1_005175 OC(=O)CCn1c(cc2C(=O)CCCc21)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L06 compound treatment 0.081 0.0203 1.3 0.078 0.0179 1.25 1.8077 0.9998 2068163 IFLab1_005176 Cc1ccc(cc1)c2nnc(SCC(=O)Nc3cc(C)ccc3C)n2N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L07 compound treatment 0.071 0.0103 0.66 0.072 0.0119 0.83 1.0562 0.9933 1438323 IFLab1_005177 Cc1ccc(cc1)c2nn(CCC#N)cc2CO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L08 compound treatment 0.452 0.391 25.18 0.341 0.281 19.63 31.6848 0.9924 1379123 IFLab1_005178 Clc1cccc(c1)N2CCN(CC2)S(=O)(=O)c3cccc4cccnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L09 compound treatment 0.5 0.439 28.27 0.326 0.266 18.58 33.1284 0.9793 2068164 IFLab1_005179 Brc1ccccc1c2nnc3sc(nn23)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L10 compound treatment 0.071 0.0103 0.66 0.062 0.00194 0.14 0.5622 0.8348 1415537 IFLab1_005180 CN(C)CCCN1C(C(=C(O)C1=O)C(=O)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L11 compound treatment 0.057 -0.00375 -0.24 0.057 -0.00306 -0.21 -0.322 -0.9982 1282291 IFLab1_005181 Cc1cccc(Cn2c(CO)nc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L12 compound treatment 0.067 0.00625 0.4 0.062 0.00194 0.14 0.3802 0.8957 2068165 IFLab1_005182 OC(=O)C(Cc1c[nH]c2ccccc12)N3C(=O)C4CC=CCC4C3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L13 compound treatment 0.268 0.207 13.34 0.152 0.0919 6.42 13.9741 0.9439 2068166 IFLab1_005183 COc1ccc(cc1Br)C2SCCN2S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L14 compound treatment 0.074 0.0133 0.85 0.069 0.00894 0.62 1.0445 0.9883 2068167 IFLab1_005184 Oc1ccc(NS(=O)(=O)c2cccs2)cc1c3c(O)ccc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L15 compound treatment 0.083 0.0222 1.43 0.074 0.0139 0.97 1.7012 0.9823 1298159 IFLab1_005185 CCCS(=O)(=O)N1CCN(CC1)c2cccc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L16 compound treatment 0.057 -0.00375 -0.24 0.062 0.00194 0.14 -0.075 -0.2709 2068168 IFLab1_005186 O=C1C=CC(=NS(=O)(=O)c2cccs2)C=C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L17 compound treatment 0.088 0.0273 1.75 0.081 0.0209 1.46 2.2745 0.9959 1504417 IFLab1_005187 COc1ccc(cc1)c2cc3ccccc3n2CC(O)CNCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L18 compound treatment 0.074 0.0133 0.85 0.067 0.00694 0.48 0.9457 0.9641 1328135 IFLab1_005188 O=C(C1Cc2ccccc2CN1S(=O)(=O)c3cccs3)N4CCCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L19 compound treatment 0.827 0.766 49.32 0.728 0.668 46.66 67.8693 0.9996 2068169 IFLab1_005189 C/C(=N\O)/c1ccc2c(c1)n(C)c3ccccc32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L20 compound treatment 0.07 0.00925 0.6 0.071 0.0109 0.76 0.9613 0.9924 1508288 IFLab1_005190 O=C1NC(=O)C2C(N(OC21)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L21 compound treatment 0.059 -0.00175 -0.11 0.056 -0.00406 -0.28 -0.2803 -0.9181 1173425 IFLab1_005191 COc1ccc(cc1)N2CCN(CC(O)COc3ccc(cc3)c4ccccc4)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L22 compound treatment 0.056 -0.00475 -0.31 0.057 -0.00306 -0.21 -0.3675 -0.9848 2068170 IFLab1_005192 Cc1ccc(NC(=O)CC(NCCC2=CCCCC2)C(=O)O)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L23 mock treatment 0.059 -0.00175 -0.11 0.056 -0.00406 -0.28 -0.2803 -0.9181 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 L24 mock treatment 0.054 -0.00675 -0.43 0.056 -0.00406 -0.28 -0.5079 -0.9787 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M01 compound treatment 0.078 0.0173 1.11 0.071 0.0109 0.76 1.3254 0.9834 2068171 IFLab1_005193 CC1(C)CC(=O)C(=CNc2ccc(F)c(F)c2)C(=O)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M02 compound treatment 0.069 0.00825 0.53 0.064 0.00394 0.28 0.57 0.9531 1453382 IFLab1_005194 COc1ccc(OC)c(c1)S(=O)(=O)n2ccnc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M03 compound treatment 0.079 0.0182 1.17 0.076 0.0159 1.11 1.6179 0.9996 2068172 IFLab1_005195 OC(=O)CSc1nnc(c2cccs2)n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M04 compound treatment 0.154 0.0933 6.0 0.251 0.191 13.34 13.6761 0.935 1656648 IFLab1_005196 Cc1cc(OCc2cn3cccnc3n2)ccc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M05 compound treatment 0.07 0.00925 0.6 0.06 -6.25E-5 0.0 0.4179 0.7019 1134171 IFLab1_005197 COC(=O)c1ccccc1Cc2nc(=O)c3ccccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M06 compound treatment 0.065 0.00425 0.27 0.06 -6.25E-5 0.0 0.1903 0.6957 2068173 IFLab1_005198 ONC(=O)c1ccccc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M07 compound treatment 0.699 0.638 41.08 0.617 0.557 38.91 56.5604 0.9996 1336083 IFLab1_005199 Cc1cc(N)n(n1)c2ncnc3sc4CCCc4c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M08 compound treatment 0.095 0.0343 2.2 0.084 0.0239 1.67 2.7413 0.9907 2068174 IFLab1_005200 COc1cc(NC=C2C(=O)CC(C)(C)CC2=O)c(OC)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M09 compound treatment 1.045 0.984 63.35 0.955 0.895 62.52 89.0045 1.0 2068175 IFLab1_005201 CCOC(=O)c1cnn(c1N)c2ccc(Cl)c(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M10 compound treatment 0.068 0.00725 0.47 0.06 -6.25E-5 0.0 0.3269 0.7005 2068176 IFLab1_005202 Fc1ccccc1C2CC(=O)NC(=C2C#N)SCC(=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M11 compound treatment 0.054 -0.00675 -0.43 0.048 -0.0121 -0.84 -0.9031 -0.9525 1492077 IFLab1_005203 CC1CN(CC(C)O1)S(=O)(=O)c2c(C)c(C)cc(C)c2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M12 compound treatment 0.064 0.00325 0.21 0.064 0.00394 0.28 0.3424 0.9909 1200931 IFLab1_005204 Clc1ccc(CSc2nc3CCCC(=O)c3cc2C#N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M13 compound treatment 0.579 0.518 33.36 0.487 0.427 29.83 44.6771 0.9984 1284362 IFLab1_005205 CCOC(=O)c1nn(cc1O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M14 compound treatment 0.074 0.0133 0.85 0.052 -0.00806 -0.56 0.2048 0.2004 1334392 IFLab1_005206 Cc1oc2ccc(OCc3cccc(F)c3)cc2c1C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M15 compound treatment 0.058 -0.00275 -0.18 0.065 0.00494 0.34 0.1187 0.3063 2068177 IFLab1_005207 Cc1sc2ncn(n3cccc3)c(=O)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M16 compound treatment 0.089 0.0283 1.82 0.086 0.0259 1.81 2.567 1.0 1013035 IFLab1_005208 O=S(=O)(Nc1ccccc1)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M17 compound treatment 0.736 0.675 43.46 0.787 0.727 50.78 66.6421 0.997 1517837 IFLab1_005209 Cc1nc2scc(c3cccs3)c2c(=O)n1n4cccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M18 compound treatment 0.067 0.00625 0.4 0.065 0.00494 0.34 0.5284 0.9971 1197592 IFLab1_005210 OC(=O)c1ccccc1SC2CC(=O)NC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M19 compound treatment 0.06 -7.5E-4 -0.05 0.06 -6.25E-5 0.0 -0.0372 -0.7679 1657419 IFLab1_005211 COc1cc(cc(OC)c1OC)c2nc3sc4CCCCc4c3c(=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M20 compound treatment 0.534 0.473 30.46 0.411 0.351 24.52 38.8747 0.9942 1188518 IFLab1_005212 Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M21 compound treatment 0.062 0.00125 0.08 0.057 -0.00306 -0.21 -0.0944 -0.413 2068178 IFLab1_005213 N#Cc1c(/N=C/c2cccs2)sc3CCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M22 compound treatment 0.058 -0.00275 -0.18 0.057 -0.00306 -0.21 -0.2764 -0.9956 2068179 IFLab1_005214 C(Sc1nnc(o1)c2ccncc2)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M23 mock treatment 0.058 -0.00275 -0.18 0.058 -0.00206 -0.14 -0.227 -0.9948 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 M24 mock treatment 0.058 -0.00275 -0.18 0.059 -0.00106 -0.07 -0.1776 -0.9255 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N01 compound treatment 0.084 0.0233 1.5 0.078 0.0179 1.25 1.9443 0.9961 1500866 IFLab1_005215 CCOC(=O)c1c(NC(=O)CSc2nc(C)cc(C)n2)sc3CCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N02 compound treatment 0.076 0.0153 0.98 0.066 0.00594 0.41 0.9874 0.9266 1253630 IFLab1_005216 O=C(CSc1nc2sc3CCCCc3c2c(=O)[nH]1)Nc4nccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N03 compound treatment 0.057 -0.00375 -0.24 0.067 0.00694 0.48 0.172 0.3177 1287593 IFLab1_005217 Oc1cccc(c1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N04 compound treatment 0.064 0.00325 0.21 0.062 0.00194 0.14 0.2436 0.9778 1370978 IFLab1_005218 CC(O)c1nc2ccccc2n1CCC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N05 compound treatment 0.658 0.597 38.44 0.574 0.514 35.9 52.5702 0.9994 1740639 IFLab1_005219 Cc1[nH]c2ccccc2c1Sc3ccccc3N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N06 compound treatment 0.163 0.102 6.58 0.131 0.0709 4.96 8.1579 0.9902 2068180 IFLab1_005220 COc1ccc(cc1)C2Nn3c(C)nnc3SC2C(=O)c4ccc(Cl)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N07 compound treatment 0.151 0.0902 5.81 0.161 0.101 7.05 9.0937 0.9954 1304164 IFLab1_005221 CCN(CC)C(=O)c1cn(nc1c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N08 compound treatment 0.07 0.00925 0.6 0.064 0.00394 0.28 0.6155 0.9385 2068181 IFLab1_005222 Cn1c(COc2cccc3cccnc23)nnc1SCC(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N09 compound treatment 0.191 0.13 8.38 0.155 0.0949 6.63 10.6178 0.9933 2068182 IFLab1_005223 Clc1ccc(cc1)c2nnc3sc(nn23)c4ccc(Br)o4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N10 compound treatment 0.066 0.00525 0.34 0.067 0.00694 0.48 0.5816 0.9845 1264894 IFLab1_005224 OC1=C(C(N(CCN2CCOCC2)C1=O)c3ccc(F)cc3)C(=O)c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N11 compound treatment 0.058 -0.00275 -0.18 0.062 0.00194 0.14 -0.0295 -0.1322 1308561 IFLab1_005225 CC(=O)Nc1cccc(c1)c2cn3c(C)cccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N12 compound treatment 0.075 0.0143 0.92 0.077 0.0169 1.18 1.4852 0.9921 1550936 IFLab1_005226 O=c1oc2ccc(NS(=O)(=O)c3ccccc3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N13 compound treatment 0.059 -0.00175 -0.11 0.063 0.00294 0.21 0.0655 0.2796 1731231 IFLab1_005227 CC(C)NCC(O)COc1ccc(Br)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N14 compound treatment 0.213 0.152 9.8 0.227 0.167 11.66 15.1758 0.9963 1257153 IFLab1_005228 CC(C)OC(=O)c1c(C)oc2ccc(NS(=O)(=O)c3cccs3)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N15 compound treatment 0.068 0.00725 0.47 0.069 0.00894 0.62 0.7715 0.9897 2068183 IFLab1_005229 CCn1c(SCC(=O)c2ccccc2)nnc1c3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N16 compound treatment 0.061 2.5E-4 0.02 0.057 -0.00306 -0.21 -0.1399 -0.6521 1305541 IFLab1_005230 CN(C(=O)COc1ccccc1)C2(C)CCS(=O)(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N17 compound treatment 0.07 0.00925 0.6 0.073 0.0129 0.9 1.0601 0.9795 1720348 IFLab1_005231 COc1ccc(cc1)c2cc3ccccc3n2CC(O)CN4CCN(CCO)CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N18 compound treatment 0.077 0.0163 1.05 0.079 0.0189 1.32 1.6751 0.9932 1581419 IFLab1_005232 CC(C)(C)NC(=O)C1Cc2ccccc2CN1S(=O)(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N19 compound treatment 0.064 0.00325 0.21 0.066 0.00594 0.41 0.4412 0.9498 1309428 IFLab1_005233 OC(CNC1CCCC1)Cn2c3ccccc3c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N20 compound treatment 0.058 -0.00275 -0.18 0.066 0.00594 0.41 0.1681 0.3728 1180231 IFLab1_005234 CCCCN1C(=O)C2ON(C(C2C1=O)c3ccccc3)c4ccc(Cl)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N21 compound treatment 0.057 -0.00375 -0.24 0.055 -0.00506 -0.35 -0.4208 -0.9827 1341724 IFLab1_005235 OC(COc1ccc(cc1)c2ccccc2)CN3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N22 compound treatment 0.055 -0.00575 -0.37 0.053 -0.00706 -0.49 -0.6106 -0.99 2068184 IFLab1_005236 Cc1ccc(C)c(NC(=O)CC(NC2CCCCC2)C(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N23 mock treatment 0.061 2.5E-4 0.02 0.054 -0.00606 -0.42 -0.2881 -0.6798 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 N24 mock treatment 0.058 -0.00275 -0.18 0.06 -6.25E-5 0.0 -0.1282 -0.7243 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O01 compound treatment 0.075 0.0143 0.92 0.077 0.0169 1.18 1.4852 0.9921 2068185 IFLab1_005237 CCOc1ccc(NC=C2C(=O)CC(C)(C)CC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O02 compound treatment 0.062 0.00125 0.08 0.06 -6.25E-5 0.0 0.0538 0.6678 2068186 IFLab1_005238 Clc1ccc(cc1)C(=O)COC(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O03 compound treatment 0.103 0.0423 2.72 0.101 0.0409 2.86 3.9452 0.9997 2068187 IFLab1_005239 Cc1cc(C)n(n1)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O04 compound treatment 0.09 0.0293 1.88 0.077 0.0169 1.18 2.1679 0.975 1213491 IFLab1_005240 Brc1ccc(OCc2cn3cccnc3n2)c(Br)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O05 compound treatment 0.062 0.00125 0.08 0.214 0.154 10.75 7.6612 0.7124 1246967 IFLab1_005241 COc1ccc(cc1)N2C(=O)Cc3ccccc3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O06 compound treatment 0.059 -0.00175 -0.11 0.061 9.38E-4 0.07 -0.0333 -0.2559 2068188 IFLab1_005242 ONC(=O)c1cccc(c1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O07 compound treatment 0.09 0.0293 1.88 0.082 0.0219 1.53 2.4149 0.9948 1473061 IFLab1_005243 CCN1CCN(CC1)c2nnc(c3ccccc3)c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O08 compound treatment 0.061 2.5E-4 0.02 0.063 0.00294 0.21 0.1565 0.7602 2068189 IFLab1_005244 O=C(CSC1=C(C#N)C(CC(=O)N1)c2cccs2)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O09 compound treatment 0.099 0.0382 2.46 0.058 -0.00206 -0.14 1.639 0.6646 1692380 IFLab1_005245 O=C(CCN1CCOCC1)Nc2sc3CCCCCc3c2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O10 compound treatment 0.099 0.0382 2.46 0.088 0.0279 1.95 3.1209 0.9934 1138453 IFLab1_005246 CC1(C)CC(=O)c2cc3c(N)c(sc3nc2C1)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O11 compound treatment 0.058 -0.00275 -0.18 0.064 0.00394 0.28 0.0693 0.212 1583395 IFLab1_005247 CCC(CO)Nc1nc(C)nc2sc3CCCCc3c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O12 compound treatment 0.056 -0.00475 -0.31 0.057 -0.00306 -0.21 -0.3675 -0.9848 1562432 IFLab1_005248 COC(=O)CSc1nc2CCCC(=O)c2cc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O13 compound treatment 0.591 0.53 34.13 0.598 0.538 37.58 50.7064 0.9988 1570944 IFLab1_005249 CCOC(=O)c1nn(cc1O)c2ccc(OCC)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O14 compound treatment 0.064 0.00325 0.21 0.058 -0.00206 -0.14 0.046 0.1812 1568943 IFLab1_005250 CN(C)Cc1c(O)ccc2cc(c3nc4ccccc4o3)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O15 compound treatment 0.063 0.00225 0.14 0.061 9.38E-4 0.07 0.1487 0.9357 1742097 IFLab1_005251 CC1(C)C2CCC1(CS(=O)(=O)Nc3ccc(F)c(Cl)c3)C(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O16 compound treatment 0.075 0.0143 0.92 0.066 0.00594 0.41 0.9419 0.9357 1736528 IFLab1_005252 CN(C)C(=O)c1c2CCCCc2nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O17 compound treatment 0.102 0.0413 2.66 0.099 0.0389 2.72 3.8009 0.9999 2068190 IFLab1_005253 Cc1sc2ncn3nnnc3c2c1c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O18 compound treatment 0.061 2.5E-4 0.02 0.061 9.38E-4 0.07 0.0577 0.8554 1596620 IFLab1_005254 NC(=O)CC1Nc2ccccc2NC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O19 compound treatment 0.075 0.0143 0.92 0.083 0.0229 1.6 1.7816 0.965 2068191 IFLab1_005255 Cc1sc2ncn3cnnc3c2c1c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O20 compound treatment 0.062 0.00125 0.08 0.063 0.00294 0.21 0.202 0.9164 1363821 IFLab1_005256 Cc1nn(c2ccccc2)c3sc(cc13)C(=O)NCCN4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O21 compound treatment 0.057 -0.00375 -0.24 0.053 -0.00706 -0.49 -0.5195 -0.9459 1457538 IFLab1_005257 CC(C)(C)c1ccc(cc1)C(=O)NCc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O22 compound treatment 0.063 0.00225 0.14 0.063 0.00294 0.21 0.2475 0.9854 1553347 IFLab1_005258 CCOC(=O)c1sc(NC(=O)c2cc(=O)c3ccccc3o2)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O23 mock treatment 0.058 -0.00275 -0.18 0.063 0.00294 0.21 0.0199 0.0736 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 O24 mock treatment 0.059 -0.00175 -0.11 0.059 -0.00106 -0.07 -0.1321 -0.9795 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P01 compound treatment 0.073 0.0123 0.79 0.073 0.0129 0.9 1.1966 0.9977 1639695 IFLab1_005259 CC1=C(C(c2ccccc2F)n3ncnc3N1)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P02 compound treatment 0.073 0.0123 0.79 0.068 0.00794 0.55 0.9496 0.9852 1677121 IFLab1_005260 CCCCN1C(=O)C2ON(C(C2C1=O)c3ccc(OC)cc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P03 compound treatment 0.067 0.00625 0.4 0.068 0.00794 0.55 0.6766 0.9876 2068192 IFLab1_005261 OC(=O)C1CN(CC=C)C(=O)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P04 compound treatment 0.063 0.00225 0.14 0.064 0.00394 0.28 0.2969 0.9551 1651615 IFLab1_005262 OCc1nc2ccccc2n1CCC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P05 compound treatment 0.055 -0.00575 -0.37 0.058 -0.00206 -0.14 -0.3636 -0.9155 1149352 IFLab1_005263 CC(C)(C)N1COc2c(C1)cc(Cl)c3cccnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P06 compound treatment 0.076 0.0153 0.98 0.078 0.0179 1.25 1.5802 0.9927 2068193 IFLab1_005264 Cc1ccc(NC(=O)CSc2nnc([nH]2)c3ccc(Br)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P07 compound treatment 0.355 0.294 18.94 0.36 0.3 20.95 28.2086 0.9987 1327405 IFLab1_005265 O=C(Nc1nccs1)c2cn(nc2c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P08 compound treatment 0.064 0.00325 0.21 0.077 0.0169 1.18 0.9846 0.8194 2068194 IFLab1_005266 OC(=O)CC(Sc1nnc[nH]1)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P09 compound treatment 0.077 0.0163 1.05 0.08 0.0199 1.39 1.7245 0.99 2068195 IFLab1_005267 Brc1ccc(cc1)c2nn3c(nnc3s2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P10 compound treatment 0.065 0.00425 0.27 0.061 9.38E-4 0.07 0.2397 0.8523 1670029 IFLab1_005268 COC(=O)CC1N(CCNC1=O)C(=O)c2sc3ccccc3c2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P11 compound treatment 0.064 0.00325 0.21 0.062 0.00194 0.14 0.2436 0.9778 1739671 IFLab1_005269 CC(=O)Nc1cccc(c1)c2cn3cccc(C)c3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P12 compound treatment 0.1 0.0393 2.53 0.093 0.0329 2.3 3.4134 0.9989 1451858 IFLab1_005270 Cc1ccc(c(C)c1)S(=O)(=O)Nc2ccc3oc(=O)sc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P13 compound treatment 0.063 0.00225 0.14 0.059 -0.00106 -0.07 0.0499 0.3067 1280369 IFLab1_005271 CC(C)(C)NCC(O)COc1ccc(Br)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P14 compound treatment 0.064 0.00325 0.21 0.065 0.00494 0.34 0.3918 0.9713 1431576 IFLab1_005272 O=C1CCCc2oc3ccc(NS(=O)(=O)c4cccs4)cc3c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P15 compound treatment 0.063 0.00225 0.14 0.065 0.00494 0.34 0.3463 0.9257 2068196 IFLab1_005273 Clc1cccc(c1)N2CCN(CC2)S(=O)(=O)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P16 compound treatment 0.066 0.00525 0.34 0.064 0.00394 0.28 0.4334 0.9948 1406246 IFLab1_005274 CN(C1CCS(=O)(=O)C1)C(=O)CSc2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P17 compound treatment 0.068 0.00725 0.47 0.074 0.0139 0.97 1.0185 0.9433 1689228 IFLab1_005275 Cc1c(C)c2ccccc2n1CC(O)CNC3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P18 compound treatment 0.058 -0.00275 -0.18 0.068 0.00794 0.55 0.2669 0.4586 1602093 IFLab1_005276 CC1(C)CC(=O)C2=C(C1)Nc3nc(O)nc(O)c3C2c4ccc(Br)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P19 compound treatment 0.063 0.00225 0.14 0.065 0.00494 0.34 0.3463 0.9257 1649149 IFLab1_005277 COC(=O)CCc1nc2c(ccc3ccccc23)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P20 compound treatment 0.057 -0.00375 -0.24 0.059 -0.00106 -0.07 -0.2232 -0.8837 1654002 IFLab1_005278 NCC(O)COCC1COc2ccccc2O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P21 compound treatment 0.073 0.0123 0.79 0.059 -0.00106 -0.07 0.505 0.6377 2068197 IFLab1_005279 BrCC1(CC2CC3CC(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P22 compound treatment 0.055 -0.00575 -0.37 0.057 -0.00306 -0.21 -0.413 -0.9661 2068198 IFLab1_005280 Cc1ccc(NC(=O)CC(NCc2ccco2)C(=O)O)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P23 mock treatment 0.061 2.5E-4 0.02 0.062 0.00194 0.14 0.1071 0.7856 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1426 P24 mock treatment 0.058 -0.00275 -0.18 0.057 -0.00306 -0.21 -0.2764 -0.9956 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A01 compound treatment 0.044 -0.0553 -3.56 0.045 -0.0396 -2.77 -4.4719 -0.9922 2068199 IFLab1_005281 [O-]/[N+](=C\c1ccncc1)/c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A02 compound treatment 0.154 0.0547 3.52 0.131 0.0464 3.24 4.7828 0.9991 2068200 IFLab1_005282 O=C(Nc1cccc(c1)c2nc3ccccc3s2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A03 compound treatment 0.089 -0.0103 -0.66 0.079 -0.00559 -0.39 -0.7443 -0.9684 1985810 IFLab1_005283 C(Sc1nc2ccccc2[nH]1)Sc3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A04 compound treatment 0.172 0.0727 4.68 0.13 0.0454 3.17 5.5526 0.982 2068201 IFLab1_005284 O=C(Nc1nc-2c(Cc3ccccc23)s1)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A05 compound treatment 0.572 0.473 30.43 0.524 0.439 30.7 43.2207 1.0 1436032 IFLab1_005285 COc1ccccc1NCC(O)COc2ccc(Cl)cc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A06 compound treatment 0.094 -0.00528 -0.34 0.075 -0.00959 -0.67 -0.7143 -0.9505 2068202 IFLab1_005286 O=C(Nc1ccc(cc1)c2nc3ccccc3[nH]2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A07 compound treatment 0.104 0.00472 0.3 0.084 -5.94E-4 -0.04 0.1854 0.6049 1590898 IFLab1_005287 OC(=O)c1ccccc1c2ccccc2C(=O)Nc3nccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A08 compound treatment 0.097 -0.00228 -0.15 0.081 -0.00359 -0.25 -0.2814 -0.9674 2068203 IFLab1_005288 NS(=O)(=O)c1ccc(NC(=O)c2ccc(s2)c3nc4ccccc4s3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A09 compound treatment 0.076 -0.0233 -1.5 0.069 -0.0156 -1.09 -1.8299 -0.9877 2068204 IFLab1_005289 Cc1ccc(cc1)C2=CSc3nnc(c4ccccc4Br)n3N2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A10 compound treatment 0.244 0.145 9.31 0.188 0.103 7.22 11.6947 0.9921 2068205 IFLab1_005290 Oc1c(CN2CCOCC2)ccc3cccnc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A11 compound treatment 0.082 -0.0173 -1.11 0.071 -0.0136 -0.95 -1.458 -0.9969 1873703 IFLab1_005291 CC(=O)Nc1ccc(OCC(O)CN2CCc3ccccc3C2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A12 compound treatment 0.102 0.00272 0.17 0.078 -0.00659 -0.46 -0.202 -0.4099 2068206 IFLab1_005292 COc1ccc(NC(=O)CSc2nc3ccccc3nc2O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A13 compound treatment 0.109 0.00972 0.63 0.082 -0.00259 -0.18 0.3142 0.4825 2068207 IFLab1_005293 CCOc1cccc2sc(=NC(=O)c3ccc(C#N)cc3)n(CC)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A14 compound treatment 0.092 -0.00728 -0.47 0.084 -5.94E-4 -0.04 -0.3607 -0.7667 2068208 IFLab1_005294 Cc1ccc2n(CC(O)CNCc3ccccc3)c4C(=O)CCCc4c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A15 compound treatment 0.105 0.00572 0.37 0.085 4.06E-4 0.03 0.2803 0.7594 2068209 IFLab1_005295 CC(=O)N1CCc2c(C#N)c(NC(=O)/C=C/c3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A16 compound treatment 0.123 0.0237 1.53 0.095 0.0104 0.73 1.5936 0.9424 2068210 IFLab1_005296 FC(F)(F)c1cccc(NC2=NC(=O)CS2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A17 compound treatment 0.137 0.0377 2.43 0.138 0.0534 3.73 4.3549 0.9783 2068211 IFLab1_005297 COC(=O)c1ccc2nc(NC(=O)C3CC3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A18 compound treatment 0.105 0.00572 0.37 0.077 -0.00759 -0.53 -0.1148 -0.1779 1511336 IFLab1_005298 CN(C)S(=O)(=O)c1ccc-2c(Cc3cc(ccc32)S(=O)(=O)N(C)C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A19 compound treatment 0.091 -0.00828 -0.53 0.099 0.0144 1.01 0.3347 0.2939 2068212 IFLab1_005299 CC(=O)Nc1nc(cs1)c2ccc3OCCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A20 compound treatment 0.096 -0.00328 -0.21 0.094 0.00941 0.66 0.3153 0.4568 1245578 IFLab1_005300 CC1CN(CC(C)O1)C(=O)c2cccc3C(=O)c4ccccc4-c32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A21 compound treatment 0.177 0.0777 5.0 0.139 0.0544 3.8 6.2248 0.9908 2068213 IFLab1_005301 CC1(C)CC(=O)c2sc(NC(=O)C3=COCCO3)nc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A22 compound treatment 0.074 -0.0253 -1.63 0.065 -0.0196 -1.37 -2.1185 -0.9963 2068214 IFLab1_005302 COCCn1c(COc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A23 mock treatment 0.081 -0.0183 -1.18 0.089 0.00441 0.31 -0.6144 -0.5051 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 A24 mock treatment 0.096 -0.00328 -0.21 0.077 -0.00759 -0.53 -0.5245 -0.9185 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B01 compound treatment 0.77 0.671 43.17 0.605 0.52 36.36 56.2336 0.9963 2068215 IFLab1_005303 COC(=O)c1ccsc1NC(=O)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B02 compound treatment 0.072 -0.0273 -1.76 0.072 -0.0126 -0.88 -1.8638 -0.9489 2068216 IFLab1_005304 O=C(Nc1nnc(o1)c2ccccc2)/C=C/c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B03 compound treatment 0.103 0.00372 0.24 0.103 0.0184 1.29 1.0785 0.8246 2068217 IFLab1_005305 NC(=O)c1ccsc1NC(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B04 compound treatment 0.048 -0.0513 -3.3 0.05 -0.0346 -2.42 -4.0428 -0.9883 2068218 IFLab1_005306 O=C(Nc1nnc(o1)c2cccs2)c3ccc4CCCCc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B05 compound treatment 0.126 0.0267 1.72 0.085 4.06E-4 0.03 1.2361 0.7187 2068219 IFLab1_005307 NC(=O)c1ccsc1NC(=O)C2CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B06 compound treatment 0.085 -0.0143 -0.92 0.069 -0.0156 -1.09 -1.4203 -0.9964 2068220 IFLab1_005308 CCCC(=O)N=c1sc2cc(Cl)ccc2n1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B07 compound treatment 1.184 1.08 69.82 0.951 0.866 60.53 92.1677 0.9975 2068221 IFLab1_005309 CNC(=O)c1ccsc1NC(=O)c2cc3ccccc3cc2OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B08 compound treatment 0.172 0.0727 4.68 0.102 0.0174 1.22 4.1695 0.8622 2068222 IFLab1_005310 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B09 compound treatment 0.088 -0.0113 -0.73 0.069 -0.0156 -1.09 -1.2837 -0.9806 2068223 IFLab1_005311 COCCn1c(=NC(=O)c2ccccc2)sc3cc(ccc13)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B10 compound treatment 0.195 0.0957 6.16 0.128 0.0434 3.03 6.5006 0.9467 2068224 IFLab1_005312 O=C(Nc1sccc1C#N)c2coc3ccccc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B11 compound treatment 0.106 0.00672 0.43 0.084 -5.94E-4 -0.04 0.2765 0.6364 2068225 IFLab1_005313 CN(C)C(=O)CSc1nnc2cc(C)c3ccccc3n12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B12 compound treatment 0.063 -0.0363 -2.34 0.06 -0.0246 -1.72 -2.8662 -0.9886 2068226 IFLab1_005314 CC(C)Oc1ccc(cc1)C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B13 compound treatment 0.1 7.19E-4 0.05 0.074 -0.0106 -0.74 -0.4906 -0.6616 2068227 IFLab1_005315 CC(C)OC(=O)CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B14 compound treatment 0.076 -0.0233 -1.5 0.061 -0.0236 -1.65 -2.2251 -0.9989 2068228 IFLab1_005316 COc1cc2CCNC(COc3cc(C)cc(C)c3)c2cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B15 compound treatment 0.099 -2.81E-4 -0.02 0.082 -0.00259 -0.18 -0.1409 -0.7739 2068229 IFLab1_005317 CC(=O)Nc1ccc2n(CC=C)c(=NC(=O)/C=C/c3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B16 compound treatment 0.085 -0.0143 -0.92 0.089 0.00441 0.31 -0.4323 -0.446 2068230 IFLab1_005318 NCCSc1c[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B17 compound treatment 0.101 0.00172 0.11 0.079 -0.00559 -0.39 -0.1981 -0.4878 2068231 IFLab1_005319 OC(=O)c1cnccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B18 compound treatment 0.095 -0.00428 -0.28 0.088 0.00341 0.24 -0.0266 -0.073 2068232 IFLab1_005320 COc1ccc(cc1)c2cnnn2c3ccc(N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B19 compound treatment 0.116 0.0167 1.08 0.105 0.0204 1.43 1.769 0.9904 2068233 IFLab1_005321 COC(=O)c1ccccc1S(=O)(=O)NC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B20 compound treatment 0.046 -0.0533 -3.43 0.046 -0.0386 -2.7 -4.3315 -0.9929 2068234 IFLab1_005322 OC1=C(C(=O)c2cccs2)C(=O)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B21 compound treatment 0.169 0.0697 4.49 0.128 0.0434 3.03 5.3173 0.9818 2068235 IFLab1_005323 CCCC(=O)Nc1nnc(o1)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B22 compound treatment 0.671 0.572 36.8 0.533 0.448 31.33 48.1711 0.9968 2068236 IFLab1_005324 Cc1ccc2n(CC(=O)O)c3nc4ccccc4nc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B23 mock treatment 0.099 -2.81E-4 -0.02 0.085 4.06E-4 0.03 0.0073 0.2159 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 B24 mock treatment 0.083 -0.0163 -1.05 0.087 0.00241 0.17 -0.6221 -0.5862 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C01 compound treatment 0.082 -0.0173 -1.11 0.069 -0.0156 -1.09 -1.5568 -0.9999 2068237 IFLab1_005325 Cc1ccc(NC(=O)CC(NCc2cccnc2)C(=O)O)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C02 compound treatment 0.154 0.0547 3.52 0.11 0.0254 1.77 3.7454 0.9497 2068238 IFLab1_005326 O=C(Nc1ccccc1c2nc3ccccc3s2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C03 compound treatment 0.084 -0.0153 -0.98 0.074 -0.0106 -0.74 -1.2188 -0.9902 2068239 IFLab1_005327 CCS(=O)c1nc2c(Br)cccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C04 compound treatment 0.16 0.0607 3.91 0.084 -5.94E-4 -0.04 2.7342 0.6996 2068240 IFLab1_005328 O=C(N1CCCc2ccccc12)C3=COCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C05 compound treatment 0.566 0.467 30.04 0.483 0.398 27.83 40.9223 0.9993 1579979 IFLab1_005329 OC(COc1ccc(Cl)cc1Cl)CN2C(=O)c3ccccc3S2(=O)=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C06 compound treatment 0.068 -0.0313 -2.01 0.064 -0.0206 -1.44 -2.441 -0.9864 2068241 IFLab1_005330 O=C(Nc1cccc(c1)c2nc3ccccc3[nH]2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C07 compound treatment 0.107 0.00772 0.5 0.078 -0.00659 -0.46 0.0256 0.0378 1462746 IFLab1_005331 Cc1cccc(n1)N2C(=O)c3cccc4cccc(C2=O)c34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C08 compound treatment 0.087 -0.0123 -0.79 0.073 -0.0116 -0.81 -1.1317 -0.9999 1554162 IFLab1_005332 OC(=O)CSc1cccc2cccnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C09 compound treatment 0.053 -0.0463 -2.98 0.053 -0.0316 -2.21 -3.6671 -0.9891 2068242 IFLab1_005333 CC(C)(C)c1nnc(SCC(=O)Nc2ccc(Br)cc2)n1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C10 compound treatment 0.158 0.0587 3.78 0.099 0.0144 1.01 3.3841 0.8652 2068243 IFLab1_005334 CCN1CCN(Cc2ccc3cccnc3c2O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C11 compound treatment 0.094 -0.00528 -0.34 0.067 -0.0176 -1.23 -1.1095 -0.87 1873690 IFLab1_005335 CC(=O)Nc1ccc(OCC(O)CN2CCN(CC2)c3ccc(F)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C12 compound treatment 1.102 1.0 64.54 1.002 0.917 64.09 90.955 1.0 2068244 IFLab1_005336 Cc1nc2ccccc2nc1SCC(=O)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C13 compound treatment 0.156 0.0567 3.65 0.121 0.0364 2.54 4.3798 0.9844 2068245 IFLab1_005337 CCOC(=O)N1CCc2c(C#N)c(NC(=O)c3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C14 compound treatment 0.112 0.0127 0.82 0.084 -5.94E-4 -0.04 0.5495 0.6704 2068246 IFLab1_005338 Cc1nccn1CC(O)Cn2c3C(=O)CCCc3c4cc(C)ccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C15 compound treatment 0.045 -0.0543 -3.49 0.045 -0.0396 -2.77 -4.4264 -0.9933 2068247 IFLab1_005339 CC(=O)N1CCc2c(C#N)c(NC(=O)c3ccc(C#N)cc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C16 compound treatment 0.902 0.803 51.67 0.793 0.708 49.49 71.5282 0.9998 2068248 IFLab1_005340 Cc1ccc(cc1)n2nnnc2c3ccc4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C17 compound treatment 0.603 0.504 32.42 0.516 0.431 30.14 44.2365 0.9993 2068249 IFLab1_005341 COC(=O)c1ccc2nc(NC(=O)C(C)C)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C18 compound treatment 0.088 -0.0113 -0.73 0.074 -0.0106 -0.74 -1.0368 -1.0 1623824 IFLab1_005342 CC(=O)Nc1ccccc1NS(=O)(=O)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C19 compound treatment 0.203 0.104 6.68 0.372 0.287 20.08 18.9179 0.8941 2068250 IFLab1_005343 O=C(Nc1nc(cs1)c2ccc3OCCOc3c2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C20 compound treatment 0.099 -2.81E-4 -0.02 0.084 -5.94E-4 -0.04 -0.0421 -0.9309 1274031 IFLab1_005344 CC(C)(CO)NCC(O)Cn1c2ccccc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C21 compound treatment 0.086 -0.0133 -0.85 0.078 -0.00659 -0.46 -0.9302 -0.9579 2068251 IFLab1_005345 O=C(Nc1nc2CCCCc2s1)C3=COCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C22 compound treatment 0.157 0.0577 3.72 0.101 0.0164 1.15 3.4374 0.8841 1711097 IFLab1_005346 Clc1sc(Nc2ccccc2N3CCOCC3)nc1S(=O)(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C23 mock treatment 0.104 0.00472 0.3 0.087 0.00241 0.17 0.3336 0.9611 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 C24 mock treatment 0.114 0.0147 0.95 0.083 -0.00159 -0.11 0.5912 0.6197 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D01 compound treatment 0.123 0.0237 1.53 0.101 0.0164 1.15 1.89 0.99 2068252 IFLab1_005347 COC(=O)c1ccsc1NC(=O)c2ccc(cc2)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D02 compound treatment 0.103 0.00372 0.24 0.09 0.00541 0.38 0.4363 0.9758 2068253 IFLab1_005348 Clc1cc(C(=O)Nc2nnc(o2)c3ccccc3)c(Cl)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D03 compound treatment 0.195 0.0957 6.16 0.112 0.0274 1.91 5.7103 0.8851 2068254 IFLab1_005349 NC(=O)c1ccsc1NC(=O)c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D04 compound treatment 0.079 -0.0203 -1.31 0.06 -0.0246 -1.72 -2.1379 -0.9908 2068255 IFLab1_005350 CCC(=O)Nc1nnc(o1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D05 compound treatment 0.04 -0.0593 -3.82 0.041 -0.0436 -3.05 -4.8515 -0.9938 2068256 IFLab1_005351 CC(C)(C)c1ccc(cc1)C(=O)Nc2sccc2C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D06 compound treatment 0.098 -0.00128 -0.08 0.077 -0.00759 -0.53 -0.4334 -0.8073 2068257 IFLab1_005352 CCn1c(=NC(=O)c2ccc(cc2)N(C)C)sc3cc(Cl)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D07 compound treatment 0.098 -0.00128 -0.08 0.074 -0.0106 -0.74 -0.5816 -0.7811 2068258 IFLab1_005353 COCCn1c(=NC(=O)c2ccc(cc2)C(=O)OC)sc3cc(C)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D08 compound treatment 0.045 -0.0543 -3.49 0.043 -0.0416 -2.91 -4.5252 -0.9958 2068259 IFLab1_005354 O=C(Nc1sccc1C#N)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D09 compound treatment 0.129 0.0297 1.91 0.093 0.00841 0.59 1.7678 0.8835 2068260 IFLab1_005355 COCCn1c(=NC(=O)c2ccccc2)sc3cc(NC(=O)C)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D10 compound treatment 0.071 -0.0283 -1.82 0.054 -0.0306 -2.14 -2.7984 -0.9968 2068261 IFLab1_005356 O=C(Nc1sccc1C#N)C2CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D11 compound treatment 0.089 -0.0103 -0.66 0.078 -0.00659 -0.46 -0.7936 -0.9843 2068262 IFLab1_005357 OC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D12 compound treatment 0.094 -0.00528 -0.34 0.074 -0.0106 -0.74 -0.7637 -0.9377 2068263 IFLab1_005358 CCCCN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D13 compound treatment 0.085 -0.0143 -0.92 0.071 -0.0136 -0.95 -1.3215 -0.9999 2068264 IFLab1_005359 Cc1ccc(cc1)C(=O)CSC2=C(C#N)C(C3=C(CCCC3=O)N2)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D14 compound treatment 0.078 -0.0213 -1.37 0.066 -0.0186 -1.3 -1.8871 -0.9996 2068265 IFLab1_005360 CCOC(=O)c1ccc(OCC2NCCc3cc(OC)c(OC)cc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D15 compound treatment 0.354 0.255 16.39 0.215 0.13 9.11 18.0348 0.9615 2068266 IFLab1_005361 COC(=O)Cn1c(=NC(=O)C(C)C)sc2cc(Cl)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D16 compound treatment 0.132 0.0327 2.11 0.121 0.0364 2.54 3.2875 0.9956 2068267 IFLab1_005362 Cc1ccc(cc1)c2[nH]c3ccccc3c2SCCN 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D17 compound treatment 0.091 -0.00828 -0.53 0.072 -0.0126 -0.88 -0.999 -0.9712 2068268 IFLab1_005363 CC1(C)C2(C)CCC1(CC2=O)C(=O)Nc3ncc(Cl)cc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D18 compound treatment 0.052 -0.0473 -3.04 0.047 -0.0376 -2.63 -4.009 -0.9973 2068269 IFLab1_005364 S=C(NCC1CCCO1)SCc2cn3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D19 compound treatment 0.09 -0.00928 -0.6 0.071 -0.0136 -0.95 -1.0939 -0.975 2068270 IFLab1_005365 COc1ccccc1c2nnc(NC(=O)c3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D20 compound treatment 0.562 0.463 29.78 0.392 0.307 21.48 36.245 0.9871 2068271 IFLab1_005366 CS(=O)(=O)c1ccc(COC(=O)c2ccccc2O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D21 compound treatment 0.098 -0.00128 -0.08 0.078 -0.00659 -0.46 -0.384 -0.8207 2068272 IFLab1_005367 Clc1ccc(cc1)c2nnc(NC(=O)c3ccc4ncsc4c3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D22 compound treatment 0.101 0.00172 0.11 0.088 0.00341 0.24 0.2465 0.9393 2068273 IFLab1_005368 CN1CCN(CC1)C(c2c(NC(=O)C)sc3CCCCc23)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D23 mock treatment 0.095 -0.00428 -0.28 0.084 -5.94E-4 -0.04 -0.2242 -0.8045 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 D24 mock treatment 0.082 -0.0173 -1.11 0.074 -0.0106 -0.74 -1.3098 -0.9804 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E01 compound treatment 0.078 -0.0213 -1.37 0.083 -0.00159 -0.11 -1.0473 -0.7621 2068274 IFLab1_005369 CN1CCN(CC1)C(CC(=O)Nc2ccc(C)c(Cl)c2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E02 compound treatment 0.21 0.111 7.13 0.126 0.0414 2.89 7.0845 0.9211 2068275 IFLab1_005370 O=C(Nc1cccc(c1)c2nc3ccccc3o2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E03 compound treatment 0.061 -0.0383 -2.46 0.054 -0.0306 -2.14 -3.2536 -0.9975 1920161 IFLab1_005371 CCOc1ccc2[nH]c(SCC)nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E04 compound treatment 0.132 0.0327 2.11 0.079 -0.00559 -0.39 1.2128 0.5662 2068276 IFLab1_005372 CN(C(=O)C1=COCCO1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E05 compound treatment 0.086 -0.0133 -0.85 0.067 -0.0176 -1.23 -1.4736 -0.9843 1499088 IFLab1_005373 Clc1ccc(cc1)S(=O)(=O)NC2OC(=O)c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E06 compound treatment 0.135 0.0357 2.3 0.096 0.0114 0.8 2.1891 0.8997 2068277 IFLab1_005374 O=C(Nc1nccs1)c2ccc(s2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E07 compound treatment 0.373 0.274 17.62 0.33 0.245 17.14 24.5804 0.9999 2068278 IFLab1_005375 CN1/C(=C/C(=O)c2ccccc2)/Sc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E08 compound treatment 0.575 0.476 30.62 0.392 0.307 21.48 36.8367 0.9849 1867541 IFLab1_005376 CC1(C)C2(C)CCC1(CC2=O)C(=O)Nc3cccc4cccnc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E09 compound treatment 0.109 0.00972 0.63 0.093 0.00841 0.59 0.8576 0.9995 2068279 IFLab1_005377 Nn1c(SCC(=O)NC2CCCCC2)nnc1c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E10 compound treatment 0.104 0.00472 0.3 0.083 -0.00159 -0.11 0.136 0.4205 1417146 IFLab1_005378 CC1CCN(Cc2ccc(O)c3ncccc23)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E11 compound treatment 0.065 -0.0343 -2.21 0.06 -0.0246 -1.72 -2.7751 -0.9923 1873699 IFLab1_005379 CC(=O)Nc1ccc(OCC(O)Cn2cnc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E12 compound treatment 0.097 -0.00228 -0.15 0.079 -0.00559 -0.39 -0.3801 -0.9106 2068280 IFLab1_005380 O=C(CSc1cnc2ccccc2n1)NC3CCS(=O)(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E13 compound treatment 0.161 0.0617 3.97 0.104 0.0194 1.36 3.7676 0.8976 2068281 IFLab1_005381 CCOC(=O)N1CCc2c(C#N)c(NC(=O)/C=C/c3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E14 compound treatment 0.116 0.0167 1.08 0.079 -0.00559 -0.39 0.4846 0.4233 2068282 IFLab1_005382 CC(C)(C)NC(=O)C1C2CC(C)(Oc3ccccc23)N(CC=C)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E15 compound treatment 0.114 0.0147 0.95 0.08 -0.00459 -0.32 0.443 0.4429 2068283 IFLab1_005383 CC(C)C(=O)Nc1sc2CN(CCc2c1C#N)C(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E16 compound treatment 0.126 0.0267 1.72 0.097 0.0124 0.87 1.8289 0.9497 2068284 IFLab1_005384 Cn1cnnc1SC2C(NS(=O)(=O)C)c3cccc4cccc2c34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E17 compound treatment 0.699 0.6 38.6 0.681 0.596 41.66 56.7564 0.9993 2068285 IFLab1_005385 COC(=O)c1ccc2nc(NC(=O)Cc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E18 compound treatment 0.234 0.135 8.67 0.182 0.0974 6.8 10.9431 0.9928 1633840 IFLab1_005386 OC(CN1CCNCC1)Cn2c3ccccc3c4cc(Br)ccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E19 compound treatment 0.329 0.23 14.79 0.28 0.195 13.65 20.1079 0.9992 2068286 IFLab1_005387 O=C(Nc1nc(cs1)c2ccc3OCCOc3c2)/C=C/c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E20 compound treatment 0.18 0.0807 5.2 0.138 0.0534 3.73 6.3119 0.9868 1060202 IFLab1_005388 CC(C)(C)NC(=O)c1cccc2C(=O)c3ccccc3-c21 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E21 compound treatment 0.105 0.00572 0.37 0.082 -0.00259 -0.18 0.1321 0.3221 2068287 IFLab1_005389 Cc1nc2ccc3nc(NC(=O)C4=COCCO4)sc3c2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E22 compound treatment 0.14 0.0407 2.62 0.112 0.0274 1.91 3.2071 0.9881 2068288 IFLab1_005390 Cn1sc(=Nc2ccccc2)nc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E23 mock treatment 0.092 -0.00728 -0.47 0.086 0.00141 0.1 -0.2619 -0.547 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 E24 mock treatment 0.097 -0.00228 -0.15 0.099 0.0144 1.01 0.6078 0.5976 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F01 compound treatment 0.699 0.6 38.6 0.595 0.51 35.66 52.5082 0.9992 2068289 IFLab1_005391 CCOC(=O)c1ccsc1NC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F02 compound treatment 0.142 0.0427 2.75 0.093 0.00841 0.59 2.3595 0.8392 2068290 IFLab1_005392 CC(C)(C)C(=O)Nc1nnc(o1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F03 compound treatment 0.128 0.0287 1.85 0.107 0.0224 1.57 2.4139 0.9966 2068291 IFLab1_005393 NC(=O)c1ccsc1NC(=O)c2ccc(Br)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F04 compound treatment 0.059 -0.0403 -2.59 0.049 -0.0356 -2.49 -3.5916 -0.9998 2068292 IFLab1_005394 Fc1ccc(/C=C/C(=O)Nc2ccon2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F05 compound treatment 0.191 0.0917 5.9 0.124 0.0394 2.75 6.121 0.9397 2068293 IFLab1_005395 NC(=O)c1ccsc1NC(=O)C2COc3ccccc3O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F06 compound treatment 0.056 -0.0433 -2.79 0.048 -0.0366 -2.56 -3.7775 -0.9991 2068294 IFLab1_005396 CCn1c(=NC(=O)c2ccccc2OC)sc3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F07 compound treatment 0.18 0.0807 5.2 0.101 0.0164 1.15 4.4842 0.8428 2068295 IFLab1_005397 COCCn1c(=NC(=O)c2cccs2)sc3cc(ccc13)C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F08 compound treatment 0.146 0.0467 3.01 0.114 0.0294 2.05 3.5789 0.9827 2068296 IFLab1_005398 O=C(Nc1sccc1C#N)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F09 compound treatment 0.153 0.0537 3.46 0.095 0.0104 0.73 2.9589 0.8375 2068297 IFLab1_005399 COCCn1c(=NC(=O)c2ccc(Br)s2)sc3cc(NC(=O)C)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F10 compound treatment 0.056 -0.0433 -2.79 0.052 -0.0326 -2.28 -3.5799 -0.995 2068298 IFLab1_005400 CCC(=O)Nc1sccc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F11 compound treatment 0.123 0.0237 1.53 0.077 -0.00759 -0.53 0.7044 0.4358 1260669 IFLab1_005401 Cc1cc(NCCN2CCOCC2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F12 compound treatment 0.133 0.0337 2.17 0.093 0.00841 0.59 1.9499 0.8673 2068299 IFLab1_005402 CN(C1CCCCC1)S(=O)(=O)c2ccc(cc2)C(=O)Nc3sccc3C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F13 compound treatment 0.253 0.154 9.89 0.192 0.107 7.5 12.3019 0.9907 2068300 IFLab1_005403 COc1ccc(cc1)C2C(=C(NC3=C2C(=O)CC(C)(C)C3)SC)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F14 compound treatment 0.068 -0.0313 -2.01 0.06 -0.0246 -1.72 -2.6386 -0.9969 2068301 IFLab1_005404 NC(=N)Sc1cn(Cc2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F15 compound treatment 0.433 0.334 21.48 0.355 0.27 18.89 28.5461 0.9979 2068302 IFLab1_005405 COC(=O)Cn1c(=NC(=O)C)sc2cc(Br)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F16 compound treatment 0.138 0.0387 2.49 0.106 0.0214 1.5 2.8196 0.9702 2068303 IFLab1_005406 COc1ccc(cc1)n2cc(c3ccccc3)c4c(O)ncnc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F17 compound treatment 0.495 0.396 25.47 0.372 0.287 20.08 32.2077 0.9931 2068304 IFLab1_005407 FC(F)(F)c1nn(c2CCCCc12)c3ccc(cc3)C(=O)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F18 compound treatment 0.123 0.0237 1.53 0.099 0.0144 1.01 1.7912 0.9796 2068305 IFLab1_005408 NCc1ccc2[nH]c3CCCCc3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F19 compound treatment 0.175 0.0757 4.87 0.116 0.0314 2.19 4.9976 0.9351 2068306 IFLab1_005409 COc1ccccc1c2nnc(NC(=O)CCSc3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F20 compound treatment 0.054 -0.0453 -2.91 0.047 -0.0376 -2.63 -3.918 -0.9986 2068307 IFLab1_005410 OC1=C(C(=O)/C=C/c2ccco2)C(=O)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F21 compound treatment 0.054 -0.0453 -2.91 0.05 -0.0346 -2.42 -3.7698 -0.9957 2068308 IFLab1_005411 Clc1ccc(cc1)c2nnc(NC(=O)COc3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F22 compound treatment 0.112 0.0127 0.82 0.097 0.0124 0.87 1.1917 0.9996 2068309 IFLab1_005412 CC(=O)Nc1sc2CCCCc2c1C(N3CCN(CCO)CC3)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F23 mock treatment 0.099 -2.81E-4 -0.02 0.074 -0.0106 -0.74 -0.5361 -0.7242 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 F24 mock treatment 0.09 -0.00928 -0.6 0.085 4.06E-4 0.03 -0.4023 -0.6728 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G01 compound treatment 0.074 -0.0253 -1.63 0.07 -0.0146 -1.02 -1.8715 -0.9746 2068310 IFLab1_005413 CN(C)C(CC(=O)Nc1cc(Cl)ccc1C)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G02 compound treatment 0.135 0.0357 2.3 0.101 0.0164 1.15 2.4361 0.9483 2068311 IFLab1_005414 CSc1nc2ccc3nc(NC(=O)C4=COCCO4)sc3c2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G03 compound treatment 0.073 -0.0263 -1.69 0.064 -0.0206 -1.44 -2.2134 -0.9968 1231753 IFLab1_005415 CCOc1ccc2[nH]c(SCCN(C)C)nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G04 compound treatment 0.143 0.0437 2.81 0.078 -0.00659 -0.46 1.664 0.5836 2068312 IFLab1_005416 O=C(N1CCN(CC1)c2ccccc2)C3=COCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G05 compound treatment 0.099 -2.81E-4 -0.02 0.066 -0.0186 -1.3 -0.9313 -0.7169 2068313 IFLab1_005417 CN1C(=O)/C(=C\C=C\c2ccccc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G06 compound treatment 0.17 0.0707 4.55 0.112 0.0274 1.91 4.5724 0.926 2068314 IFLab1_005418 O=C(NCc1ccccc1)c2ccc(s2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G07 compound treatment 0.091 -0.00828 -0.53 0.067 -0.0176 -1.23 -1.246 -0.9301 2068315 IFLab1_005419 C1Cn2cc(nc2S1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G08 compound treatment 0.195 0.0957 6.16 0.112 0.0274 1.91 5.7103 0.8851 1873796 IFLab1_005420 CC1(C)C2CCC(C2)(C(=O)Nc3ccc(Br)cn3)C1=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G09 compound treatment 0.114 0.0147 0.95 0.076 -0.00859 -0.6 0.2454 0.2188 1708050 IFLab1_005421 Cc1nnc(SCC(=O)N2c3ccccc3Sc4ccccc24)n1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G10 compound treatment 0.116 0.0167 1.08 0.105 0.0204 1.43 1.769 0.9904 2068316 IFLab1_005422 FC(F)(F)c1cc(NC(=O)CC2SC(=N)NC2=O)ccc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G11 compound treatment 0.128 0.0287 1.85 0.086 0.00141 0.1 1.3765 0.7436 2068317 IFLab1_005423 COC(=O)/C=C/1\SC(=N)NC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G12 compound treatment 0.994 0.895 57.59 0.794 0.709 49.56 75.7647 0.9972 2068318 IFLab1_005424 Fc1ccc(cc1)N2CCN(CC2)C(=O)CSc3cnc4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G13 compound treatment 0.182 0.0827 5.32 0.129 0.0444 3.1 5.9584 0.9669 2068319 IFLab1_005425 CC(=O)N1CCc2c(C(=O)N)c(NC(=O)c3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G14 compound treatment 0.192 0.0927 5.97 0.14 0.0554 3.87 6.9569 0.978 2068320 IFLab1_005426 CC1(CC2C(C(=O)Nc3ccccc3)C(=O)N1CC=C)Oc4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G15 compound treatment 0.099 -2.81E-4 -0.02 0.076 -0.00859 -0.6 -0.4373 -0.7281 2068321 IFLab1_005427 CC(=O)N1CCc2c(C#N)c(NC(=O)Cc3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G16 compound treatment 0.054 -0.0453 -2.91 0.051 -0.0336 -2.35 -3.7204 -0.9942 2068322 IFLab1_005428 COc1ccc(cc1)c2ccc(o2)C3C(=C(N)OC4=C3C(=O)CCC4)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G17 compound treatment 0.069 -0.0303 -1.95 0.063 -0.0216 -1.51 -2.4449 -0.992 2068323 IFLab1_005429 CCOC(=O)c1ccc2nc(NC(=O)c3ccco3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G18 compound treatment 1.254 1.15 74.32 1.034 0.949 66.33 99.4537 0.9984 2068324 IFLab1_005430 COC(=O)c1cccc2/C(=N\O)/c3ccccc3-c21 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G19 compound treatment 0.083 -0.0163 -1.05 0.071 -0.0136 -0.95 -1.4125 -0.9988 2068325 IFLab1_005431 O=C(Nc1nc(cs1)c2ccc3OCCOc3c2)C4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G20 compound treatment 0.11 0.0107 0.69 0.093 0.00841 0.59 0.9031 0.9968 1424207 IFLab1_005432 Cc1ccc(cc1)S(=O)(=O)NCC(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G21 compound treatment 0.063 -0.0363 -2.34 0.054 -0.0306 -2.14 -3.1625 -0.999 2068326 IFLab1_005433 O=C(Nc1nc(cs1)c2ccccc2)C3=COCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G22 compound treatment 0.082 -0.0173 -1.11 0.064 -0.0206 -1.44 -1.8038 -0.9919 2068327 IFLab1_005434 C[N+](=c1nc(c2ccccc2)n(C)s1)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G23 mock treatment 0.093 -0.00628 -0.4 0.076 -0.00859 -0.6 -0.7104 -0.9815 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 G24 mock treatment 0.104 0.00472 0.3 0.08 -0.00459 -0.32 -0.0122 -0.0275 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H01 compound treatment 0.633 0.534 34.35 0.463 0.378 26.44 42.9837 0.9916 2068328 IFLab1_005435 CCOC(=O)c1ccsc1NC(=O)c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H02 compound treatment 0.382 0.283 18.2 0.285 0.2 14.0 22.7671 0.9916 2068329 IFLab1_005436 COc1ccccc1C(=O)Nc2nnc(o2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H03 compound treatment 0.215 0.116 7.45 0.131 0.0464 3.24 7.5591 0.9306 2068330 IFLab1_005437 Cc1ccc(cc1C)C(=O)Nc2sccc2C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H04 compound treatment 0.106 0.00672 0.43 0.07 -0.0146 -1.02 -0.4151 -0.3748 2068331 IFLab1_005438 Cc1cc(C)n(n1)C(=O)c2ccc(cc2)S(=O)(=O)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H05 compound treatment 0.187 0.0877 5.65 0.147 0.0624 4.36 7.0751 0.9918 2068332 IFLab1_005439 NC(=O)c1ccsc1NC(=O)c2ccc3ncsc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H06 compound treatment 0.132 0.0327 2.11 0.09 0.00541 0.38 1.7562 0.8208 2068333 IFLab1_005440 CCn1c(=NC(=O)Cc2ccccc2)sc3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H07 compound treatment 0.147 0.0477 3.07 0.087 0.00241 0.17 2.2907 0.7447 2068334 IFLab1_005441 COCCn1c(=NC(=O)C)sc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H08 compound treatment 0.123 0.0237 1.53 0.082 -0.00259 -0.18 0.9514 0.6188 2068335 IFLab1_005442 CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H09 compound treatment 0.169 0.0697 4.49 0.123 0.0384 2.68 5.0703 0.9698 2068336 IFLab1_005443 COCCn1c(=NC(=O)CCc2ccccc2)sc3cc(NC(=O)C)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H10 compound treatment 0.114 0.0147 0.95 0.082 -0.00259 -0.18 0.5418 0.5617 2068337 IFLab1_005444 CC(C)C(=O)Nc1sccc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H11 compound treatment 0.123 0.0237 1.53 0.089 0.00441 0.31 1.2972 0.8329 2068338 IFLab1_005445 CN(C)C(=O)CSc1nnc2sc3ccccc3n12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H12 compound treatment 0.555 0.456 29.33 0.346 0.261 18.26 33.6541 0.974 2068339 IFLab1_005446 O=C(Nc1sccc1C#N)c2ccc3ncsc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H13 compound treatment 0.044 -0.0553 -3.56 0.042 -0.0426 -2.98 -4.6201 -0.996 1571330 IFLab1_005447 c1ccc2[nH]c(nc2c1)c3nc4ccccc4o3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H14 compound treatment 0.082 -0.0173 -1.11 0.063 -0.0216 -1.51 -1.8532 -0.9888 2068340 IFLab1_005448 Cn1cc(SC(=N)N)c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H15 compound treatment 0.108 0.00872 0.56 0.086 0.00141 0.1 0.4663 0.8184 2068341 IFLab1_005449 COC(=O)Cn1c(=NC(=O)/C=C/c2cccs2)sc3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H16 compound treatment 0.571 0.472 30.36 0.435 0.35 24.48 38.7788 0.9943 2068342 IFLab1_005450 Cc1cccc(c1)n2cc(c3ccccc3)c4c(O)ncnc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H17 compound treatment 0.37 0.271 17.42 0.224 0.139 9.74 19.2076 0.9622 1867614 IFLab1_005451 CC1(C)C2(C)CCC1(OC2=O)C(=O)Nc3ccc(Br)cn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H18 compound treatment 0.065 -0.0343 -2.21 0.062 -0.0226 -1.58 -2.6763 -0.9865 2068343 IFLab1_005452 Cc1[nH]c2ccccc2c1C(Nc3ccccn3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H19 compound treatment 0.079 -0.0203 -1.31 0.062 -0.0226 -1.58 -2.0392 -0.9955 1574318 IFLab1_005453 COc1ccc(cc1)c2nnc(NC(=O)C)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H20 compound treatment 0.04 -0.0593 -3.82 0.038 -0.0466 -3.26 -4.9997 -0.9969 2068344 IFLab1_005454 COc1ccc(cc1)C(=O)C2=C(O)c3ccccc3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H21 compound treatment 0.042 -0.0573 -3.69 0.043 -0.0416 -2.91 -4.6617 -0.9931 2068345 IFLab1_005455 O=C(Nc1nnc(o1)c2ccccc2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H22 compound treatment 0.096 -0.00328 -0.21 0.074 -0.0106 -0.74 -0.6727 -0.874 2068346 IFLab1_005456 CC(=O)Nc1sc2CCCCc2c1C(N3CCOCC3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H23 mock treatment 0.116 0.0167 1.08 0.08 -0.00459 -0.32 0.534 0.4755 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 H24 mock treatment 0.087 -0.0123 -0.79 0.09 0.00541 0.38 -0.2919 -0.3332 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I01 compound treatment 0.082 -0.0173 -1.11 0.082 -0.00259 -0.18 -0.9146 -0.8116 2068347 IFLab1_005457 Cc1ccc(Cl)cc1NC(=O)CC(N2CCNCC2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I02 compound treatment 0.06 -0.0393 -2.53 0.056 -0.0286 -2.0 -3.2003 -0.9932 2068348 IFLab1_005458 COc1cccc2sc(=NC(=O)C3=COCCO3)n(C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I03 compound treatment 0.089 -0.0103 -0.66 0.081 -0.00359 -0.25 -0.6455 -0.9119 1869881 IFLab1_005459 CCOc1ccc2nc3SCC(O)Cn3c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I04 compound treatment 0.238 0.139 8.93 0.127 0.0424 2.96 8.4083 0.8938 2068349 IFLab1_005460 Cc1cc(NC(=O)C2=COCCO2)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I05 compound treatment 0.112 0.0127 0.82 0.078 -0.00659 -0.46 0.2531 0.2695 2068350 IFLab1_005461 CN1C(=O)/C(=C\c2ccc(Cl)cc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I06 compound treatment 0.18 0.0807 5.2 0.085 4.06E-4 0.03 3.6938 0.711 2068351 IFLab1_005462 O=C(N1CCOCC1)c2ccc(s2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I07 compound treatment 0.148 0.0487 3.14 0.107 0.0224 1.57 3.3242 0.9485 555 IFLab1_005463 Cc1cc2ncc(nc2cc1C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I08 compound treatment 0.073 -0.0263 -1.69 0.065 -0.0196 -1.37 -2.164 -0.9945 1868510 IFLab1_005464 OC(=O)Cc1coc2ccc3ccccc3c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I09 compound treatment 0.062 -0.0373 -2.4 0.064 -0.0206 -1.44 -2.7141 -0.9701 1177865 IFLab1_005465 CCc1nnc(SCC(=O)N2c3ccccc3Sc4ccccc24)n1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I10 compound treatment 0.146 0.0467 3.01 0.08 -0.00459 -0.32 1.8994 0.6281 2068352 IFLab1_005466 CN(C)c1ccc(NC(=O)CC2SC(=N)NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I11 compound treatment 0.107 0.00772 0.5 0.078 -0.00659 -0.46 0.0256 0.0378 2068353 IFLab1_005467 FC(F)(F)c1cc(NC2OC(=O)c3ccccc23)ccc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I12 compound treatment 0.265 0.166 10.67 0.161 0.0764 5.34 11.3167 0.9488 2068354 IFLab1_005468 Fc1ccc(NC(=O)CSc2cnc3ccccc3n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I13 compound treatment 0.105 0.00572 0.37 0.076 -0.00859 -0.6 -0.1642 -0.2332 2068355 IFLab1_005469 CC(=O)N1CCc2c(C(=O)N)c(NC(=O)/C=C/c3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I14 compound treatment 0.136 0.0367 2.36 0.093 0.00841 0.59 2.0864 0.8568 2068356 IFLab1_005470 CCC(CC)NC(=O)C1C2CC(C)(Oc3ccccc23)N(C)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I15 compound treatment 0.269 0.17 10.92 0.176 0.0914 6.39 12.2397 0.9673 2068357 IFLab1_005471 CC(C)C(=O)Nc1sc2CN(CCc2c1c3nc4ccccc4s3)C(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I16 compound treatment 0.134 0.0347 2.23 0.091 0.00641 0.45 1.8966 0.8322 2068358 IFLab1_005472 N/C(=N\S(=O)(=O)c1ccc(Cl)s1)/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I17 compound treatment 0.856 0.757 48.71 0.772 0.687 48.02 68.3972 1.0 2068359 IFLab1_005473 CCOC(=O)c1ccc2nc(NC(=O)C(C)C)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I18 compound treatment 0.11 0.0107 0.69 0.078 -0.00659 -0.46 0.1621 0.1954 3177232 IFLab1_005474 CCN(CC)CC(O)Cn1c2ccccc2c3ccccc13.OC(=O)c1ccco1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I19 compound treatment 0.06 -0.0393 -2.53 0.056 -0.0286 -2.0 -3.2003 -0.9932 2068360 IFLab1_005475 CCC(=O)Nc1nc(cs1)c2ccc3OCCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I20 compound treatment 0.092 -0.00728 -0.47 0.083 -0.00159 -0.11 -0.4101 -0.8514 1190658 IFLab1_005476 CCC(NS(=O)(=O)c1ccc(C)cc1)C(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I21 compound treatment 0.044 -0.0553 -3.56 0.044 -0.0406 -2.84 -4.5213 -0.9937 2068361 IFLab1_005477 Clc1ccc(s1)c2csc(NC(=O)C3=COCCO3)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I22 compound treatment 0.646 0.547 35.19 0.647 0.562 39.29 52.6647 0.9985 2068362 IFLab1_005478 Cc1ccc(cc1)S(=O)(=O)c2nc(Nc3nccs3)sc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I23 mock treatment 0.094 -0.00528 -0.34 0.082 -0.00259 -0.18 -0.3685 -0.9566 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 I24 mock treatment 0.109 0.00972 0.63 0.083 -0.00159 -0.11 0.3636 0.5723 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J01 compound treatment 0.274 0.175 11.25 0.203 0.118 8.27 13.801 0.9886 2068363 IFLab1_005479 CCOC(=O)c1ccsc1NC(=O)C2CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J02 compound treatment 0.123 0.0237 1.53 0.102 0.0174 1.22 1.9393 0.9936 2068364 IFLab1_005480 O=C(CCc1ccccc1)Nc2nnc(o2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J03 compound treatment 0.15 0.0507 3.26 0.11 0.0254 1.77 3.5634 0.959 2068365 IFLab1_005481 NC(=O)c1ccsc1NC(=O)c2cc(nc3ccccc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J04 compound treatment 0.357 0.258 16.59 0.198 0.113 7.92 17.3316 0.9428 2068366 IFLab1_005482 Fc1cccc(/C=C/C(=O)Nc2ccc3OCOc3c2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J05 compound treatment 0.143 0.0437 2.81 0.081 -0.00359 -0.25 1.8122 0.6415 2068367 IFLab1_005483 NC(=O)c1ccsc1NC(=O)C2=COCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J06 compound treatment 0.096 -0.00328 -0.21 0.062 -0.0226 -1.58 -1.2654 -0.7946 2068368 IFLab1_005484 CCn1c(=NC(=O)c2ccc(Br)s2)sc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J07 compound treatment 0.141 0.0417 2.69 0.093 0.00841 0.59 2.314 0.8419 2068369 IFLab1_005485 COCCn1c(=NC(=O)C2COc3ccccc3O2)sc4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J08 compound treatment 0.06 -0.0393 -2.53 0.062 -0.0226 -1.58 -2.9039 -0.9743 2068370 IFLab1_005486 O=C(Nc1sccc1C#N)c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J09 compound treatment 0.824 0.725 46.65 0.735 0.65 45.44 65.1131 0.9999 2068371 IFLab1_005487 COCCn1c(=NC(=O)c2ccccc2OC)sc3cc(OC)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J10 compound treatment 0.414 0.315 20.26 0.342 0.257 17.98 27.0392 0.9982 2068372 IFLab1_005488 COc1ccccc1C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J11 compound treatment 0.139 0.0397 2.56 0.083 -0.00159 -0.11 1.729 0.6757 2068373 IFLab1_005489 O=c1[nH]c(CN2CCOCC2)nc3sc4CCCCc4c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J12 compound treatment 0.233 0.134 8.61 0.159 0.0744 5.2 9.7615 0.9708 2068374 IFLab1_005490 O=C(CCSc1ccccc1)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J13 compound treatment 0.159 0.0597 3.84 0.096 0.0114 0.8 3.2814 0.8359 2068375 IFLab1_005491 COC(=O)c1ccc2n(CC=C)c(=NC(=O)c3ccc(F)cc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J14 compound treatment 0.097 -0.00228 -0.15 0.072 -0.0126 -0.88 -0.7259 -0.8139 2068376 IFLab1_005492 CCn1cc(SC(=N)N)c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J15 compound treatment 0.204 0.105 6.74 0.117 0.0324 2.26 6.3669 0.8954 2068377 IFLab1_005493 CCOC(=O)Cn1c(=NC(=O)c2ccccc2Br)sc3cc(C)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J16 compound treatment 0.062 -0.0373 -2.4 0.077 -0.00759 -0.53 -2.0719 -0.8431 2068378 IFLab1_005494 Oc1ncnc2n(cc(c3ccccc3)c12)c4ccc(F)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J17 compound treatment 0.239 0.14 8.99 0.197 0.112 7.85 11.9117 0.9977 2068379 IFLab1_005495 OC(=O)c1ccc(cc1)n2nc(c3CCCCc32)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J18 compound treatment 0.055 -0.0443 -2.85 0.053 -0.0316 -2.21 -3.576 -0.992 2068380 IFLab1_005496 Cc1[nH]c2ccccc2c1C(N3CCCC3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J19 compound treatment 0.09 -0.00928 -0.6 0.08 -0.00459 -0.32 -0.6493 -0.9575 2068381 IFLab1_005497 COc1ccc(cc1)c2nnc(NC(=O)/C=C/c3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J20 compound treatment 0.051 -0.0483 -3.11 0.044 -0.0406 -2.84 -4.2027 -0.999 2068382 IFLab1_005498 CN(C)c1ccc(/C=C/C(=O)C2=C(O)c3ccccc3C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J21 compound treatment 0.108 0.00872 0.56 0.084 -5.94E-4 -0.04 0.3675 0.6531 2068383 IFLab1_005499 FC(F)(F)c1cccc(c1)C(=O)Nc2nnc(o2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J22 compound treatment 0.133 0.0337 2.17 0.095 0.0104 0.73 2.0487 0.8951 2068384 IFLab1_005500 CC(=O)Nc1sc2CCCCc2c1CN3CCc4ccccc4C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J23 mock treatment 0.116 0.0167 1.08 0.095 0.0104 0.73 1.275 0.9818 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 J24 mock treatment 0.101 0.00172 0.11 0.076 -0.00859 -0.6 -0.3463 -0.5673 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K01 compound treatment 0.065 -0.0343 -2.21 0.06 -0.0246 -1.72 -2.7751 -0.9923 2068385 IFLab1_005501 Cc1ccc(Cl)cc1NC(=O)CC(NCC2CCCO2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K02 compound treatment 0.114 0.0147 0.95 0.092 0.00741 0.52 1.0357 0.9595 2068386 IFLab1_005502 O=C(Nc1ccc(cc1)c2nc3ccccc3s2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K03 compound treatment 0.081 -0.0183 -1.18 0.063 -0.0216 -1.51 -1.8987 -0.9924 1869885 IFLab1_005503 CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(=O)CCN2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K04 compound treatment 0.162 0.0627 4.04 0.107 0.0224 1.57 3.9613 0.9149 2068387 IFLab1_005504 O=C(Nc1ccccc1c2nc3ccccc3[nH]2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K05 compound treatment 0.659 0.56 36.03 0.53 0.445 31.12 47.4768 0.9973 2068388 IFLab1_005505 CN1C(=O)/C(=C\c2ccc(O)cc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K06 compound treatment 0.18 0.0807 5.2 0.118 0.0334 2.33 5.324 0.9348 2068389 IFLab1_005506 O=C(N1CCCCC1)c2ccc(s2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K07 compound treatment 0.091 -0.00828 -0.53 0.072 -0.0126 -0.88 -0.999 -0.9712 1005966 IFLab1_005507 COc1ccccc1OCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K08 compound treatment 0.233 0.134 8.61 0.162 0.0774 5.41 9.9097 0.9749 2068390 IFLab1_005508 COC(=O)CSc1nnc(c2cccs2)n1c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K09 compound treatment 0.106 0.00672 0.43 0.076 -0.00859 -0.6 -0.1187 -0.1605 1873702 IFLab1_005509 CCN(CC)CC(O)COc1ccc(NC(=O)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K10 compound treatment 0.119 0.0197 1.27 0.084 -5.94E-4 -0.04 0.8681 0.6836 2068391 IFLab1_005510 CC(C)OCC(O)CN1CCN(Cc2ccccc2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K11 compound treatment 0.073 -0.0263 -1.69 0.061 -0.0236 -1.65 -2.3616 -0.9999 2068392 IFLab1_005511 Cc1c(Cl)cccc1NC2OC(=O)c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K12 compound treatment 0.259 0.16 10.28 0.176 0.0914 6.39 11.7846 0.9738 2068393 IFLab1_005512 O=C(CSc1nc2ccccc2nc1c3ccccc3)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K13 compound treatment 0.136 0.0367 2.36 0.093 0.00841 0.59 2.0864 0.8568 2068394 IFLab1_005513 CC(C)C(=O)Nc1sc2CN(CCc2c1C(=O)N)C(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K14 compound treatment 0.162 0.0627 4.04 0.102 0.0174 1.22 3.7144 0.881 2068395 IFLab1_005514 CCN(CC)C(=O)C1C2CC(C)(NC1=O)Oc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K15 compound treatment 0.178 0.0787 5.07 0.132 0.0474 3.31 5.9245 0.9788 2068396 IFLab1_005515 COC(=O)c1ccc2nc(NC(=O)C)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K16 compound treatment 0.116 0.0167 1.08 0.101 0.0164 1.15 1.5714 0.9995 2068397 IFLab1_005516 O=S(=O)(/N=C(\NC#N)/c1ccccc1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K17 compound treatment 0.214 0.115 7.38 0.165 0.0804 5.62 9.1931 0.9909 2068398 IFLab1_005517 CCCC(=O)Nc1nc2ccc(cc2s1)C(=O)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K18 compound treatment 0.111 0.0117 0.75 0.094 0.00941 0.66 0.998 0.9976 1453602 IFLab1_005518 OCCN(CCO)CC(O)Cn1c2ccccc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K19 compound treatment 0.35 0.251 16.14 0.283 0.198 13.86 21.2119 0.9971 2068399 IFLab1_005519 Cc1nc2ccc(NC(=O)C3=COCCO3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K20 compound treatment 0.079 -0.0203 -1.31 0.064 -0.0206 -1.44 -1.9404 -0.9988 1142721 IFLab1_005520 COc1ccccc1N(CC(O)CN2CCCCC2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K21 compound treatment 0.481 0.382 24.57 0.467 0.382 26.71 36.2634 0.9991 2068400 IFLab1_005521 CC(C)(C)c1csc(NC(=O)C2=COCCO2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K22 compound treatment 0.916 0.817 52.57 0.908 0.823 57.52 77.8462 0.999 2068401 IFLab1_005522 Clc1sc(nc1S(=O)(=O)c2ccc(Cl)cc2)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K23 mock treatment 0.102 0.00272 0.17 0.082 -0.00259 -0.18 -0.0044 -0.0174 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 K24 mock treatment 0.103 0.00372 0.24 0.092 0.00741 0.52 0.5351 0.9386 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L01 compound treatment 0.237 0.138 8.86 0.219 0.134 9.39 12.9074 0.9996 2068402 IFLab1_005523 CCOC(=O)c1ccsc1NC(=O)CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L02 compound treatment 0.094 -0.00528 -0.34 0.078 -0.00659 -0.46 -0.5661 -0.9888 2068403 IFLab1_005524 O=C(Cc1ccccc1)Nc2nnc(o2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L03 compound treatment 0.126 0.0267 1.72 0.088 0.00341 0.24 1.3843 0.7974 2068404 IFLab1_005525 NC(=O)c1ccsc1NC(=O)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L04 compound treatment 0.115 0.0157 1.01 0.073 -0.0116 -0.81 0.1427 0.1101 2068405 IFLab1_005526 Cn1c(=NC(=O)c2ccc(Cl)s2)sc3cccc(Cl)c13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L05 compound treatment 0.26 0.161 10.34 0.157 0.0724 5.06 10.8915 0.9458 2068406 IFLab1_005527 NC(=O)c1ccsc1NC(=O)c2sc3ccccc3c2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L06 compound treatment 0.048 -0.0513 -3.3 0.042 -0.0426 -2.98 -4.438 -0.9987 1067560 IFLab1_005528 COc1ccc(CCN2C(=O)C=CC2=O)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L07 compound treatment 0.12 0.0207 1.33 0.072 -0.0126 -0.88 0.3209 0.2008 2068407 IFLab1_005529 COCCn1c(=NC(=O)c2cccc(OC)c2)sc3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L08 compound treatment 0.046 -0.0533 -3.43 0.045 -0.0396 -2.77 -4.3809 -0.9943 2068408 IFLab1_005530 Brc1ccc(s1)C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L09 compound treatment 0.365 0.266 17.1 0.225 0.14 9.81 19.0295 0.9652 2068409 IFLab1_005531 COCCn1c(=NC(=O)c2c(F)cccc2F)sc3cc(OC)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L10 compound treatment 0.277 0.178 11.44 0.228 0.143 10.02 15.1725 0.9978 2068410 IFLab1_005532 CCOc1ccc(cc1)C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L11 compound treatment 0.349 0.25 16.07 0.177 0.0924 6.46 15.9301 0.9197 2068411 IFLab1_005533 Fc1ccccc1NC(=O)CSC2=C(C#N)C(C3=C(CCCC3=O)N2)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L12 compound treatment 0.073 -0.0263 -1.69 0.064 -0.0206 -1.44 -2.2134 -0.9968 2068412 IFLab1_005534 COc1ccc(cc1)n2ncc3c(O)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L13 compound treatment 0.122 0.0227 1.46 0.087 0.00241 0.17 1.1529 0.7832 2068413 IFLab1_005535 CS(=O)(=O)c1ccc2n(CC=C)c(=NC(=O)/C=C/c3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L14 compound treatment 0.117 0.0177 1.14 0.075 -0.00959 -0.67 0.3325 0.2514 2068414 IFLab1_005536 NC(=N)Sc1cn(CCNC(=O)c2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L15 compound treatment 0.133 0.0337 2.17 0.095 0.0104 0.73 2.0487 0.8951 1867568 IFLab1_005537 CCN1CCN(CC1)C(=O)C2(CCC3(C)C(=O)O2)C3(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L16 compound treatment 0.105 0.00572 0.37 0.093 0.00841 0.59 0.6755 0.9747 1032585 IFLab1_005538 CCN(CC)S(=O)(=O)c1ccc(cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L17 compound treatment 0.153 0.0537 3.46 0.098 0.0134 0.94 3.1071 0.8674 1475400 IFLab1_005539 Oc1ccccc1C(=O)NS(=O)(=O)c2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L18 compound treatment 0.201 0.102 6.55 0.147 0.0624 4.36 7.7123 0.9805 2068415 IFLab1_005540 OCCCc1nc2NC(=CC(c3ccccc3)n2n1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L19 compound treatment 0.05 -0.0493 -3.17 0.046 -0.0386 -2.7 -4.1494 -0.9967 2068416 IFLab1_005541 COc1ccc(cc1)C(=O)Nc2nnc(o2)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L20 compound treatment 0.165 0.0657 4.23 0.105 0.0204 1.43 3.9991 0.8959 2068417 IFLab1_005542 CCOC(=O)c1sc2nc3CCCc3c(c4ccc(OC)cc4)c2c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L21 compound treatment 0.206 0.107 6.87 0.136 0.0514 3.59 7.3965 0.9542 2068418 IFLab1_005543 O=C(Nc1nnc(o1)c2ccccc2)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L22 compound treatment 0.103 0.00372 0.24 0.078 -0.00659 -0.46 -0.1565 -0.3014 2068419 IFLab1_005544 Cc1sc(NC(=O)c2ccco2)c(C(N3CCCCC3)c4cccnc4)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L23 mock treatment 0.106 0.00672 0.43 0.083 -0.00159 -0.11 0.2271 0.5085 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 L24 mock treatment 0.096 -0.00328 -0.21 0.083 -0.00159 -0.11 -0.2281 -0.9553 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M01 compound treatment 0.067 -0.0323 -2.08 0.063 -0.0216 -1.51 -2.5359 -0.9876 2068420 IFLab1_005545 OC(=O)C(CC(=O)Nc1ccc(Cl)cc1Cl)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M02 compound treatment 0.132 0.0327 2.11 0.099 0.0144 1.01 2.2008 0.9429 2068421 IFLab1_005546 O=C(Nc1ccc(cc1)c2nc3ccccc3o2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M03 compound treatment 0.123 0.0237 1.53 0.072 -0.0126 -0.88 0.4574 0.2596 1635497 IFLab1_005547 OC(=O)c1cccnc1SCCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M04 compound treatment 0.097 -0.00228 -0.15 0.076 -0.00859 -0.6 -0.5283 -0.8549 2068422 IFLab1_005548 NC(=O)c1c(NC(=O)C2=COCCO2)sc3CCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M05 compound treatment 0.113 0.0137 0.88 0.088 0.00341 0.24 0.7926 0.8667 2068423 IFLab1_005549 COc1ccc(/C=C\2/SC(=S)N(C)C2=O)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M06 compound treatment 0.527 0.428 27.53 0.369 0.284 19.87 33.5159 0.9872 2068424 IFLab1_005550 CN(C(=O)c1ccc(s1)c2nc3ccccc3s2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M07 compound treatment 0.124 0.0247 1.59 0.073 -0.0116 -0.81 0.5523 0.3094 1517122 IFLab1_005551 COc1ccc(C(=O)CNc2cc(C)ccc2C)c(F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M08 compound treatment 0.137 0.0377 2.43 0.102 0.0174 1.22 2.5765 0.9489 1635494 IFLab1_005552 OC(c1c[nH]c2ccccc12)c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M09 compound treatment 0.099 -2.81E-4 -0.02 0.072 -0.0126 -0.88 -0.6349 -0.7215 1873677 IFLab1_005553 CC1CCCC(C)N1CC(O)COc2ccc(NC(=O)C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M10 compound treatment 0.086 -0.0133 -0.85 0.074 -0.0106 -0.74 -1.1278 -0.9974 2068425 IFLab1_005554 CC(C)OCC(O)CN1CCN(CC1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M11 compound treatment 0.135 0.0357 2.3 0.075 -0.00959 -0.67 1.1517 0.481 2068426 IFLab1_005555 Cc1ccc(NC2OC(=O)c3ccccc23)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M12 compound treatment 0.12 0.0207 1.33 0.086 0.00141 0.1 1.0124 0.7571 2068427 IFLab1_005556 O=C(CSc1nccc2ccccc12)N3CCN(CC3)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M13 compound treatment 0.138 0.0387 2.49 0.101 0.0164 1.15 2.5726 0.9379 2068428 IFLab1_005557 CC(=O)N1CCc2c(C(=O)N)c(NC(=O)Cc3ccccc3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M14 compound treatment 0.142 0.0427 2.75 0.077 -0.00759 -0.53 1.5691 0.5603 2068429 IFLab1_005558 CCN(CC)C(=O)C1C2C3CCCCC3(NC1=O)Oc4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M15 compound treatment 0.05 -0.0493 -3.17 0.046 -0.0386 -2.7 -4.1494 -0.9967 2068430 IFLab1_005559 COC(=O)c1ccc2nc(NC(=O)c3ccco3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M16 compound treatment 0.175 0.0757 4.87 0.105 0.0204 1.43 4.4542 0.8772 2068431 IFLab1_005560 CC(C)(C)c1ccc(OCc2nc3ccccc3[nH]2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M17 compound treatment 0.07 -0.0293 -1.88 0.072 -0.0126 -0.88 -1.9548 -0.9398 2068432 IFLab1_005561 CCC(=O)Nc1nc2c(C)c(C)ccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M18 compound treatment 0.126 0.0267 1.72 0.083 -0.00159 -0.11 1.1373 0.6599 1186605 IFLab1_005562 CC1CC(C)CN(CC(O)Cn2c3ccccc3c4ccccc24)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M19 compound treatment 0.295 0.196 12.6 0.287 0.202 14.14 18.9063 0.9983 2068433 IFLab1_005563 CSc1nc2ccc(NC(=O)C3=COCCO3)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M20 compound treatment 0.113 0.0137 0.88 0.081 -0.00359 -0.25 0.4469 0.4868 1636064 IFLab1_005564 Cc1ccc(cc1)S(=O)(=O)Nc2cccc(c2)C(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M21 compound treatment 0.193 0.0937 6.03 0.148 0.0634 4.43 7.3976 0.9885 2068434 IFLab1_005565 O=C(Nc1sc2CCCc2c1C#N)C3=COCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M22 compound treatment 0.104 0.00472 0.3 0.085 4.06E-4 0.03 0.2348 0.7698 2068435 IFLab1_005566 Cc1cccc(/N=C\2/NC(=O)C(Cc3cccc(c3)C(F)(F)F)S2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M23 mock treatment 0.085 -0.0143 -0.92 0.075 -0.00959 -0.67 -1.1239 -0.988 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 M24 mock treatment 0.105 0.00572 0.37 0.094 0.00941 0.66 0.7249 0.9625 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N01 compound treatment 0.854 0.755 48.58 0.765 0.68 47.53 67.9604 0.9999 2068436 IFLab1_005567 NC(=O)c1ccsc1NC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N02 compound treatment 0.096 -0.00328 -0.21 0.082 -0.00259 -0.18 -0.2775 -0.9971 2068437 IFLab1_005568 CC(=O)Nc1nnc(o1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N03 compound treatment 0.158 0.0587 3.78 0.096 0.0114 0.8 3.2359 0.8378 2068438 IFLab1_005569 NC(=O)c1ccsc1NC(=O)c2ccc3OCCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N04 compound treatment 0.175 0.0757 4.87 0.11 0.0254 1.77 4.7012 0.9064 2068439 IFLab1_005570 CCn1c(=NC(=O)c2cccs2)sc3cc(Cl)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N05 compound treatment 1.321 1.22 78.64 1.158 1.07 74.99 108.6285 0.9997 2068440 IFLab1_005571 CNC(=O)c1ccsc1NC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N06 compound treatment 0.049 -0.0503 -3.24 0.048 -0.0366 -2.56 -4.0961 -0.9932 2068441 IFLab1_005572 COC(=O)c1c(sc2CC(C)CCc12)N3C(=O)C=CC3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N07 compound treatment 0.115 0.0157 1.01 0.078 -0.00659 -0.46 0.3897 0.3505 2068442 IFLab1_005573 COCCn1c(=NC(=O)/C=C/c2cccs2)sc3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N08 compound treatment 0.115 0.0157 1.01 0.078 -0.00659 -0.46 0.3897 0.3505 2068443 IFLab1_005574 O=C(CCOc1ccccc1)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N09 compound treatment 0.149 0.0497 3.2 0.093 0.00841 0.59 2.6781 0.8231 2068444 IFLab1_005575 CCN(CC)c1ccc(cc1)C(=O)N=c2sc3cc(OC)ccc3n2CCOC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N10 compound treatment 0.066 -0.0333 -2.14 0.067 -0.0176 -1.23 -2.3838 -0.9652 2068445 IFLab1_005576 CCCC(=O)Nc1sccc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N11 compound treatment 0.135 0.0357 2.3 0.091 0.00641 0.45 1.9421 0.8292 2068446 IFLab1_005577 FC(F)(F)c1ccccc1NC(=O)CSC2=C(C#N)C(C3=C(CCCC3=O)N2)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N12 compound treatment 0.091 -0.00828 -0.53 0.078 -0.00659 -0.46 -0.7026 -0.9974 2068447 IFLab1_005578 Cc1ccc(c(C)c1)n2ncc3c(O)ncnc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N13 compound treatment 0.121 0.0217 1.4 0.096 0.0114 0.8 1.5519 0.9645 2068448 IFLab1_005579 NS(=O)(=O)c1ccc2n(CC=C)c(=NC(=O)c3cccs3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N14 compound treatment 0.12 0.0207 1.33 0.081 -0.00359 -0.25 0.7654 0.5641 2068449 IFLab1_005580 COc1ccccc1C(=O)NCCn2cc(SC(=N)N)c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N15 compound treatment 0.074 -0.0253 -1.63 0.065 -0.0196 -1.37 -2.1185 -0.9963 1867574 IFLab1_005581 CC1(C)C2(C)CCC1(OC2=O)C(=O)N3CCN(Cc4ccccc4)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N16 compound treatment 0.192 0.0927 5.97 0.157 0.0724 5.06 7.7966 0.9966 2068450 IFLab1_005582 Nc1nc(cs1)c2ccc(C#N)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N17 compound treatment 0.124 0.0247 1.59 0.086 0.00141 0.1 1.1945 0.7493 2068451 IFLab1_005583 Clc1ccc(s1)S(=O)(=O)NC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N18 compound treatment 0.102 0.00272 0.17 0.082 -0.00259 -0.18 -0.0044 -0.0174 1725012 IFLab1_005584 CC(=O)Nc1ccccc1OCC(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N19 compound treatment 0.051 -0.0483 -3.11 0.05 -0.0346 -2.42 -3.9063 -0.9923 2068452 IFLab1_005585 Clc1ccc(cc1)c2nnc(NC(=O)c3ccco3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N20 compound treatment 0.21 0.111 7.13 0.157 0.0724 5.06 8.6159 0.9859 2068453 IFLab1_005586 CCOC(=O)c1cc(C(=O)N)c(SCC=C)[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N21 compound treatment 0.06 -0.0393 -2.53 0.059 -0.0256 -1.79 -3.0521 -0.9856 2068454 IFLab1_005587 Cc1ccc(cc1C)C(=O)Nc2nnc(o2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N22 compound treatment 0.095 -0.00428 -0.28 0.077 -0.00759 -0.53 -0.57 -0.9534 2068455 IFLab1_005588 Cc1sc(NC(=O)c2ccco2)c(C(N3CCOCC3)c4ccncc4)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N23 mock treatment 0.107 0.00772 0.5 0.1 0.0154 1.08 1.1123 0.9384 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 N24 mock treatment 0.093 -0.00628 -0.4 0.088 0.00341 0.24 -0.1176 -0.2507 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O01 compound treatment 0.091 -0.00828 -0.53 0.075 -0.00959 -0.67 -0.8508 -0.9936 2068456 IFLab1_005589 COc1ccc(Cl)cc1NC(=O)CC(NCCc2ccccc2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O02 compound treatment 0.113 0.0137 0.88 0.075 -0.00959 -0.67 0.1505 0.1357 2068457 IFLab1_005590 O=C(N1CCN(CC1)c2nc3ccccc3s2)C4=COCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O03 compound treatment 0.32 0.221 14.21 0.181 0.0964 6.73 14.8079 0.9418 2068458 IFLab1_005591 Cn1c(SCC(=O)c2ccccc2)nnc1c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O04 compound treatment 0.108 0.00872 0.56 0.069 -0.0156 -1.09 -0.3735 -0.3048 2068459 IFLab1_005592 NC(=O)c1c(NC(=O)C2=COCCO2)sc3CCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O05 compound treatment 0.099 -2.81E-4 -0.02 0.066 -0.0186 -1.3 -0.9313 -0.7169 1306646 IFLab1_005593 CCC(=O)OC1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O06 compound treatment 0.104 0.00472 0.3 0.075 -0.00959 -0.67 -0.2592 -0.3522 2068460 IFLab1_005594 Cc1cc(NC(=O)c2ccc(s2)c3nc4ccccc4s3)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O07 compound treatment 0.1 7.19E-4 0.05 0.073 -0.0116 -0.81 -0.54 -0.6656 2068461 IFLab1_005595 Cc1nnc(SCC(=O)O)n1/N=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O08 compound treatment 0.276 0.177 11.37 0.164 0.0794 5.55 11.9655 0.9455 1616098 IFLab1_005596 CCN(CC)c1ccc2nc(C)c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O09 compound treatment 0.103 0.00372 0.24 0.071 -0.0136 -0.95 -0.5023 -0.5128 1873681 IFLab1_005597 CC(=O)Nc1ccc(OCC(O)CN2CCCC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O10 compound treatment 0.093 -0.00628 -0.4 0.071 -0.0136 -0.95 -0.9574 -0.9276 2068462 IFLab1_005598 CN1CCN(CC1)C(=O)c2cc3ccccc3nc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O11 compound treatment 0.128 0.0287 1.85 0.086 0.00141 0.1 1.3765 0.7436 2068463 IFLab1_005599 Cc1ccc(cc1)c2csc(NC3OC(=O)c4ccccc34)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O12 compound treatment 0.138 0.0387 2.49 0.102 0.0174 1.22 2.622 0.9456 2068464 IFLab1_005600 COC(=O)c1ccccc1NC(=O)CSc2nc3ccccc3nc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O13 compound treatment 0.12 0.0207 1.33 0.085 4.06E-4 0.03 0.963 0.722 2068465 IFLab1_005601 COC(=O)c1c(NC(=O)c2ccc(Cl)s2)sc3CN(CCc13)C(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O14 compound treatment 0.272 0.173 11.12 0.174 0.0894 6.25 12.2775 0.9628 2068466 IFLab1_005602 FC(F)(F)c1ccccc1NC2=NC(=O)CS2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O15 compound treatment 0.06 -0.0393 -2.53 0.057 -0.0276 -1.93 -3.1509 -0.991 2068467 IFLab1_005603 COC(=O)c1ccc2nc(NC(=O)CCOc3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O16 compound treatment 0.279 0.18 11.57 0.184 0.0994 6.94 13.09 0.9702 2068468 IFLab1_005604 COC(=O)CSc1nnc(o1)c2ccc(OC)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O17 compound treatment 0.131 0.0317 2.04 0.129 0.0444 3.1 3.6372 0.9794 2068469 IFLab1_005605 CC(C)C(=O)Nc1nc2c(C)c(C)ccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O18 compound treatment 0.098 -0.00128 -0.08 0.075 -0.00959 -0.67 -0.5322 -0.7882 1446160 IFLab1_005606 CC1CCN(CC(O)Cn2c3ccccc3c4ccccc24)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O19 compound treatment 0.284 0.185 11.89 0.247 0.162 11.35 16.4297 0.9997 2068470 IFLab1_005607 O=C(Nc1nc2ccccc2s1)C3=COCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O20 compound treatment 0.087 -0.0123 -0.79 0.074 -0.0106 -0.74 -1.0823 -0.9995 2068471 IFLab1_005608 CNC(=O)c1cccc(NS(=O)(=O)c2ccc(C)cc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O21 compound treatment 0.266 0.167 10.73 0.263 0.178 12.46 16.4008 0.9972 2068472 IFLab1_005609 O=C(Nc1sc2CCCCc2c1C#N)C3=COCCO3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O22 compound treatment 0.137 0.0377 2.43 0.11 0.0254 1.77 2.9717 0.9881 2068473 IFLab1_005610 COC(=O)c1ccsc1NC(=O)CCOc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O23 mock treatment 0.089 -0.0103 -0.66 0.086 0.00141 0.1 -0.3985 -0.5956 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 O24 mock treatment 0.107 0.00772 0.5 0.085 4.06E-4 0.03 0.3714 0.7463 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P01 compound treatment 0.256 0.157 10.09 0.232 0.147 10.3 14.4144 0.9999 2068474 IFLab1_005611 COc1ccc(C(=O)Nc2sccc2C(=O)N)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P02 compound treatment 0.047 -0.0523 -3.37 0.048 -0.0366 -2.56 -4.1871 -0.9908 2068475 IFLab1_005612 O=C(Nc1nnc(o1)c2cccs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P03 compound treatment 0.146 0.0467 3.01 0.109 0.0244 1.71 3.3319 0.9639 2068476 IFLab1_005613 NC(=O)c1ccsc1NC(=O)c2ccc3CCCCc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P04 compound treatment 0.527 0.428 27.53 0.36 0.275 19.24 33.0713 0.9847 2068477 IFLab1_005614 CCn1c(=NC(=O)C2CC2)sc3cc(Cl)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P05 compound treatment 0.418 0.319 20.51 0.359 0.274 19.17 28.061 0.9994 2068478 IFLab1_005615 CNC(=O)c1ccsc1NC(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P06 compound treatment 0.198 0.0987 6.35 0.136 0.0514 3.59 7.0324 0.9635 2068479 IFLab1_005616 O=C(Nc1sccc1C#N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P07 compound treatment 0.117 0.0177 1.14 0.084 -5.94E-4 -0.04 0.7771 0.6809 2068480 IFLab1_005617 COCCn1c(=NC(=O)C)sc2cc(ccc12)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P08 compound treatment 0.119 0.0197 1.27 0.08 -0.00459 -0.32 0.6705 0.5122 2068481 IFLab1_005618 COC(=O)c1ccc(cc1)C(=O)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P09 compound treatment 0.103 0.00372 0.24 0.077 -0.00759 -0.53 -0.2059 -0.3537 2068482 IFLab1_005619 OC(=O)CCNS(=O)(=O)c1cccc(c1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P10 compound treatment 0.233 0.134 8.61 0.165 0.0804 5.62 10.0579 0.9786 2068483 IFLab1_005620 O=C(CCc1ccccc1)Nc2sccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P11 compound treatment 0.138 0.0387 2.49 0.089 0.00441 0.31 1.9799 0.7885 2068484 IFLab1_005621 CC(C)(C)NC(=O)CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P12 compound treatment 0.128 0.0287 1.85 0.079 -0.00559 -0.39 1.0308 0.5456 1199381 IFLab1_005622 Cc1ccccc1c2nnc(N)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P13 compound treatment 0.196 0.0967 6.23 0.139 0.0544 3.8 7.0895 0.972 2068485 IFLab1_005623 NS(=O)(=O)c1ccc2n(CC=C)c(=NC(=O)/C=C/c3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P14 compound treatment 0.113 0.0137 0.88 0.076 -0.00859 -0.6 0.1999 0.1872 2068486 IFLab1_005624 Cc1nn(c(O)c1Sc2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P15 compound treatment 0.131 0.0317 2.04 0.071 -0.0136 -0.95 0.7721 0.3429 1175473 IFLab1_005625 CC(=O)N1CCc2ccccc2C1CC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P16 compound treatment 0.093 -0.00628 -0.4 0.066 -0.0186 -1.3 -1.2044 -0.8853 1719186 IFLab1_005626 Nc1nc2ccc(cc2s1)S(=O)(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P17 compound treatment 0.12 0.0207 1.33 0.078 -0.00659 -0.46 0.6172 0.4375 2068487 IFLab1_005627 O=C(NS(=O)(=O)c1ccc2OCCOc2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P18 compound treatment 0.043 -0.0563 -3.62 0.043 -0.0416 -2.91 -4.6162 -0.994 2068488 IFLab1_005628 CSC(C)C(=O)C1=C(O)c2ccccc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P19 compound treatment 0.126 0.0267 1.72 0.098 0.0134 0.94 1.8783 0.9592 2068489 IFLab1_005629 Clc1ccc(cc1)c2nnc(NC(=O)CCOc3ccccc3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P20 compound treatment 1.24 1.14 73.42 1.128 1.04 72.89 103.46 1.0 2068490 IFLab1_005630 C=CCn1c2ccccc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P21 compound treatment 0.097 -0.00228 -0.15 0.07 -0.0146 -1.02 -0.8247 -0.8007 2068491 IFLab1_005631 Clc1c(sc2ccccc12)C(=O)Nc3nnc(o3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P22 compound treatment 0.102 0.00272 0.17 0.08 -0.00459 -0.32 -0.1032 -0.2823 2068492 IFLab1_005632 Cc1sc(NC(=O)c2ccco2)c(CN3CCN(CC3)c4ccccn4)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P23 mock treatment 0.12 0.0207 1.33 0.085 4.06E-4 0.03 0.963 0.722 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1427 P24 mock treatment 0.112 0.0127 0.82 0.082 -0.00259 -0.18 0.4507 0.5376 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A01 compound treatment 0.065 -0.0101 -0.65 0.063 -0.00755 -0.53 -0.8323 -0.9946 2068493 IFLab1_005633 Cc1sc(NC(=O)c2ccco2)c(CN3CCc4ccccc4C3)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A02 compound treatment 0.221 0.146 9.39 0.25 0.179 12.54 15.5052 0.9899 1875154 IFLab1_005634 CC(Oc1ccc(F)cc1)C(=O)Nc2ccccc2Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A03 compound treatment 0.088 0.0129 0.83 0.095 0.0245 1.71 1.7953 0.9451 2068494 IFLab1_005635 Fc1cccc(/C=C/C(=O)Nc2ccon2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A04 compound treatment 0.079 0.00391 0.25 0.069 -0.00155 -0.11 0.1013 0.3701 2068495 IFLab1_005636 CCN1C(=O)/C(=C/2\SC(=S)N(C3CCCC3)C2=O)/c4cc(Br)ccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A05 compound treatment 0.068 -0.00709 -0.46 0.067 -0.00355 -0.25 -0.4981 -0.9588 2068496 IFLab1_005637 Cc1ccc(o1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A06 compound treatment 0.101 0.0259 1.67 0.082 0.0115 0.8 1.7448 0.9434 2068497 IFLab1_005638 Cc1ccc(cc1)c2nc3sc(=Cc4cccs4)c(=O)n3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A07 compound treatment 0.066 -0.00909 -0.59 0.062 -0.00855 -0.6 -0.8362 -0.9999 1873189 IFLab1_005639 CC(C)c1cc(NCCN(C)C)n2c3ccccc3nc2c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A08 compound treatment 0.083 0.00791 0.51 0.063 -0.00755 -0.53 -0.013 -0.0178 2068498 IFLab1_005640 CCSc1nnc(c2ccco2)n1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A09 compound treatment 0.072 -0.00309 -0.2 0.08 0.00945 0.66 0.3261 0.4728 2068499 IFLab1_005641 CCC(C)Nc1ncnc2n(Cc3ccc(Cl)cc3)ncc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A10 compound treatment 0.072 -0.00309 -0.2 0.068 -0.00255 -0.18 -0.2667 -0.9984 2068500 IFLab1_005642 FC(F)(F)c1ccccc1NC(=O)CSc2nc3sc4CCCc4c3c(=O)[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A11 compound treatment 0.078 0.00291 0.19 0.071 4.52E-4 0.03 0.1546 0.8149 2068501 IFLab1_005643 Cc1ccc(cc1C)N2CCN(CC2)C(=O)c3ccc(Br)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A12 compound treatment 0.126 0.0509 3.28 0.124 0.0535 3.73 4.9573 0.9979 2068502 IFLab1_005644 CCOc1ccccc1Cn2c(=O)oc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A13 compound treatment 0.069 -0.00609 -0.39 0.068 -0.00255 -0.18 -0.4032 -0.9361 2068503 IFLab1_005645 COc1ccc(cc1OC)C2=N/C(=C/c3cccnc3)/C(=O)O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A14 compound treatment 0.068 -0.00709 -0.46 0.066 -0.00455 -0.32 -0.5475 -0.9843 2068504 IFLab1_005646 Cc1cccc(OCC(O)CN2CCc3ccccc3C2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A15 compound treatment 0.153 0.0779 5.01 0.128 0.0575 4.01 6.3838 0.9939 2068505 IFLab1_005647 CN(C)C(=O)CSc1nc(nc2CCCCc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A16 compound treatment 0.077 0.00191 0.12 0.071 4.52E-4 0.03 0.1091 0.8609 2068506 IFLab1_005648 OC(COc1ccccc1Br)CN2CCN(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A17 compound treatment 0.126 0.0509 3.28 0.125 0.0545 3.8 5.0067 0.9972 2068507 IFLab1_005649 CCNc1c2-c3ccccc3C(=O)c4cccc(n(C)c1=O)c42 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A18 compound treatment 0.062 -0.0131 -0.84 0.064 -0.00655 -0.46 -0.9194 -0.9588 2068508 IFLab1_005650 CCN1CCN(CCC(=O)Nc2sc3CCCCCc3c2C#N)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A19 compound treatment 0.083 0.00791 0.51 0.081 0.0105 0.73 0.8761 0.9844 2068509 IFLab1_005651 CCCC(=O)Nc1nc2ccc(cc2s1)S(=O)(=O)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A20 compound treatment 0.078 0.00291 0.19 0.073 0.00245 0.17 0.2534 0.999 2068510 IFLab1_005652 COc1ccccc1Oc2ccc(cc2)S(=O)(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A21 compound treatment 0.08 0.00491 0.32 0.076 0.00545 0.38 0.4926 0.9957 2068511 IFLab1_005653 O=C(Nc1nc2ccc(cc2s1)S(=O)(=O)N3CCCC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A22 compound treatment 0.073 -0.00209 -0.13 0.072 0.00145 0.1 -0.0236 -0.1398 2068512 IFLab1_005654 CC1CN(CC(C)O1)S(=O)(=O)c2ccc(Oc3ccccc3C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A23 mock treatment 0.074 -0.00109 -0.07 0.073 0.00245 0.17 0.0713 0.3852 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 A24 mock treatment 0.071 -0.00409 -0.26 0.067 -0.00355 -0.25 -0.3616 -0.9995 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B01 compound treatment 0.077 0.00191 0.12 0.063 -0.00755 -0.53 -0.2861 -0.5285 2068513 IFLab1_005655 Cc1nnc(SCC(=O)NCc2ccc3OCOc3c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B02 compound treatment 0.062 -0.0131 -0.84 0.054 -0.0165 -1.16 -1.4134 -0.9879 2068514 IFLab1_005656 COc1cccc2cc(C(=O)NCCc3c(C)[nH]c4c(C)cccc34)c(=O)oc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B03 compound treatment 0.076 9.06E-4 0.06 0.073 0.00245 0.17 0.1624 0.8973 1438875 IFLab1_005657 Cc1sc(NC(=O)C(c2ccccc2)c3ccccc3)c(C(=O)N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B04 compound treatment 0.065 -0.0101 -0.65 0.061 -0.00955 -0.67 -0.9311 -0.9999 2068515 IFLab1_005658 COc1ccc(cc1C)S(=O)(=O)N2CCN(C/C=C/c3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B05 compound treatment 0.226 0.151 9.71 0.178 0.107 7.51 12.1761 0.9919 2068516 IFLab1_005659 Cn1cc(C(=O)Cc2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B06 compound treatment 0.061 -0.0141 -0.91 0.061 -0.00955 -0.67 -1.1131 -0.9886 2068517 IFLab1_005660 Cc1ccc(cc1)C(=O)COC(=O)c2cc3cc(Br)ccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B07 compound treatment 0.249 0.174 11.19 0.178 0.107 7.51 13.2229 0.9811 2068518 IFLab1_005661 O=C(Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2)/C=C/c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B08 compound treatment 0.071 -0.00409 -0.26 0.063 -0.00755 -0.53 -0.5592 -0.9486 2068519 IFLab1_005662 Cc1cccc(c1)N2C(=O)CC(Sc3ncccc3C(=O)O)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B09 compound treatment 0.077 0.00191 0.12 0.084 0.0135 0.94 0.7512 0.7927 1480619 IFLab1_005663 Cc1cc(Br)ccc1OCC(=O)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B10 compound treatment 0.063 -0.0121 -0.78 0.058 -0.0125 -0.88 -1.1703 -0.9982 2068520 IFLab1_005664 Fc1ccccc1C2CC(=O)NC(=C2C#N)SCC(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B11 compound treatment 0.467 0.392 25.23 0.404 0.333 23.29 34.3088 0.9992 2068521 IFLab1_005665 Cc1ccc(/C=C/C(=O)N2CCCc3ccccc23)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B12 compound treatment 0.094 0.0189 1.22 0.087 0.0165 1.15 1.6732 0.9996 2068522 IFLab1_005666 CN1C(=O)/C(=C/c2c[nH]c3ccccc23)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B13 compound treatment 0.056 -0.0191 -1.23 0.051 -0.0195 -1.37 -1.8347 -0.9986 1860959 IFLab1_005667 CCC(=O)Nc1ccc(cc1)C(=O)n2ccc(C)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B14 compound treatment 0.086 0.0109 0.7 0.082 0.0115 0.8 1.0621 0.9979 2068523 IFLab1_005668 O=C(Nc1ccccc1)c2cc3ccccc3c(=O)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B15 compound treatment 0.059 -0.0161 -1.04 0.065 -0.00555 -0.39 -1.0066 -0.9101 1172781 IFLab1_005669 C(NCc1ccccc1)C2CCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B16 compound treatment 0.069 -0.00609 -0.39 0.061 -0.00955 -0.67 -0.749 -0.968 1295216 IFLab1_005670 COc1ccc(cc1)C(=O)N2CCn3c2nc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B17 compound treatment 0.052 -0.0231 -1.49 0.059 -0.0115 -0.81 -1.6215 -0.9588 1983615 IFLab1_005671 COC(=O)CCC(=O)N1CCc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B18 compound treatment 0.431 0.356 22.91 0.327 0.256 17.92 28.8666 0.9926 2068524 IFLab1_005672 O=C(Nc1ccc2[nH]c3CCCCc3c2c1)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B19 compound treatment 0.092 0.0169 1.09 0.084 0.0135 0.94 1.4339 0.9973 1183336 IFLab1_005673 O=C(COc1ccccc1)Nc2ccc(cc2)S(=O)(=O)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B20 compound treatment 0.077 0.00191 0.12 0.076 0.00545 0.38 0.3561 0.8899 2068525 IFLab1_005674 CN1CCN(CC1)C(c2c(C)c(C)sc2NC(=O)c3ccco3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B21 compound treatment 0.176 0.101 6.49 0.126 0.0555 3.87 7.3318 0.9695 1726674 IFLab1_005675 COC(=O)CCC(=O)Nc1sc2CCCCc2c1C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B22 compound treatment 0.082 0.00691 0.44 0.087 0.0165 1.15 1.127 0.9146 2068526 IFLab1_005676 COc1cc(c(OC)cc1Cl)S(=O)(=O)N(C)C2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B23 mock treatment 0.084 0.00891 0.57 0.059 -0.0115 -0.81 -0.1651 -0.1668 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 B24 mock treatment 0.069 -0.00609 -0.39 0.07 -5.48E-4 -0.04 -0.3044 -0.7725 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C01 compound treatment 0.144 0.0689 4.44 0.132 0.0615 4.29 6.1717 0.9999 1530278 IFLab1_005677 O=c1oc(nc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C02 compound treatment 0.081 0.00591 0.38 0.079 0.00845 0.59 0.6863 0.9773 2068527 IFLab1_005678 CCCN1C(=O)/C(=C/2\SC(=S)NC2=O)/c3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C03 compound treatment 0.069 -0.00609 -0.39 0.07 -5.48E-4 -0.04 -0.3044 -0.7725 2068528 IFLab1_005679 O=C1CC(SC(=N1)N2CCc3ccccc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C04 compound treatment 0.072 -0.00309 -0.2 0.069 -0.00155 -0.11 -0.2173 -0.9589 2068529 IFLab1_005680 CCN1C(=O)/C(=C/2\SC(=S)NC2=O)/c3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C05 compound treatment 0.071 -0.00409 -0.26 0.076 0.00545 0.38 0.083 0.1792 2068530 IFLab1_005681 COc1ccc(cc1O)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C06 compound treatment 0.179 0.104 6.69 0.154 0.0835 5.83 8.8514 0.9977 2068531 IFLab1_005682 CCC1CCCCN1S(=O)(=O)c2ccc(NC(=O)/C=C/c3ccco3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C07 compound treatment 0.068 -0.00709 -0.46 0.143 0.0725 5.06 3.2561 0.6407 1873195 IFLab1_005683 CC(C)c1cc(NCCN2CCOCC2)n3c4ccccc4nc3c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C08 compound treatment 0.076 9.06E-4 0.06 0.057 -0.0135 -0.95 -0.628 -0.6623 2068532 IFLab1_005684 Cc1ccsc1C=c2sc3nc(nn3c2=O)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C09 compound treatment 0.109 0.0339 2.18 0.1 0.0295 2.06 2.998 0.9996 2068533 IFLab1_005685 Cc1ccc(Cn2ncc3c(ncnc23)N4CCOCC4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C10 compound treatment 0.078 0.00291 0.19 0.074 0.00345 0.24 0.3028 0.9921 1650368 IFLab1_005686 Cc1ccc(cc1)S(=O)(=O)c2nc(NC3CCS(=O)(=O)C3)sc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C11 compound treatment 0.72 0.645 41.51 0.276 0.205 14.35 39.5005 0.8994 2068534 IFLab1_005687 CCOc1ccc(cc1)S(=O)(=O)N2CCc3ccccc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C12 compound treatment 0.958 0.883 56.83 0.959 0.888 62.07 84.0717 0.999 2068535 IFLab1_005688 O=c1oc2ccccc2n1CCCOc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C13 compound treatment 0.067 -0.00809 -0.52 0.059 -0.0115 -0.81 -0.9388 -0.9776 2068536 IFLab1_005689 CC1CN(CC(C)O1)S(=O)(=O)CC2(CCC3CC2=O)C3(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C14 compound treatment 0.074 -0.00109 -0.07 0.059 -0.0115 -0.81 -0.6203 -0.7659 2068537 IFLab1_005690 Cc1cccc(OCC(O)CN2C(C)(C)CC(O)CC2(C)C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C15 compound treatment 0.083 0.00791 0.51 0.079 0.00845 0.59 0.7773 0.9973 2068538 IFLab1_005691 O=C(CSc1nc(nc2CCCCc12)c3ccccc3)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C16 compound treatment 0.069 -0.00609 -0.39 0.061 -0.00955 -0.67 -0.749 -0.968 2068539 IFLab1_005692 CC1(C)CCCC(C)(C)N1CC(O)COc2ccccc2Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C17 compound treatment 0.1 0.0249 1.6 0.086 0.0155 1.08 1.8968 0.9815 1204795 IFLab1_005693 CNc1c2-c3ccccc3C(=O)c4cccc(n(C)c1=O)c42 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C18 compound treatment 0.096 0.0209 1.35 0.081 0.0105 0.73 1.4678 0.9587 1592072 IFLab1_005694 Cc1nc(N2CCCC2)c3ccsc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C19 compound treatment 0.08 0.00491 0.32 0.076 0.00545 0.38 0.4926 0.9957 2068540 IFLab1_005695 CN(C)S(=O)(=O)c1ccc2nc(NC(=O)/C=C/c3ccccc3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C20 compound treatment 0.728 0.653 42.02 0.647 0.576 40.27 58.1914 0.9998 2068541 IFLab1_005696 COc1ccccc1Oc2ccc(cc2)S(=O)(=O)NCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C21 compound treatment 0.076 9.06E-4 0.06 0.075 0.00445 0.31 0.2611 0.8253 1193718 IFLab1_005697 OC(=O)CCN1C(=O)C2C3CC(C=C3)C2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C22 compound treatment 0.078 0.00291 0.19 0.071 4.52E-4 0.03 0.1546 0.8149 2068542 IFLab1_005698 CC1CN(CC(C)O1)S(=O)(=O)c2ccc(cc2)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C23 mock treatment 0.071 -0.00409 -0.26 0.072 0.00145 0.1 -0.1146 -0.4059 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 C24 mock treatment 0.071 -0.00409 -0.26 0.073 0.00245 0.17 -0.0652 -0.2075 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D01 compound treatment 0.118 0.0429 2.76 0.088 0.0175 1.22 2.8149 0.9324 2068543 IFLab1_005699 CCOC(=O)c1c(NC(=O)CSc2nnc(C)s2)sc3CCCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D02 compound treatment 0.081 0.00591 0.38 0.071 4.52E-4 0.03 0.2911 0.7632 2068544 IFLab1_005700 COc1ccc(cc1)C(=O)C(C)OC(=O)c2cc(C)nc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D03 compound treatment 0.094 0.0189 1.22 0.077 0.00645 0.45 1.1792 0.9087 2068545 IFLab1_005701 CCOC(=O)c1c(NC(=O)COc2ccccc2OC)sc3CCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D04 compound treatment 0.067 -0.00809 -0.52 0.063 -0.00755 -0.53 -0.7412 -1.0 2068546 IFLab1_005702 COc1cc(C)c(cc1C)S(=O)(=O)N2CCN(CC2)c3cccc(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D05 compound treatment 0.065 -0.0101 -0.65 0.055 -0.0155 -1.09 -1.2275 -0.9698 1984307 IFLab1_005703 CNCCn1ccc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D06 compound treatment 0.079 0.00391 0.25 0.072 0.00145 0.1 0.2495 0.9203 2068547 IFLab1_005704 CC(OC(=O)c1cc2ccccc2oc1=O)C(=O)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D07 compound treatment 0.078 0.00291 0.19 0.07 -5.48E-4 -0.04 0.1052 0.5509 2068548 IFLab1_005705 CN(C(=O)C)c1ccc(NC(=O)/C=C/c2ccco2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D08 compound treatment 0.069 -0.00609 -0.39 0.065 -0.00555 -0.39 -0.5514 -1.0 2068549 IFLab1_005706 CCOc1ccc(cc1)N(C2CS(=O)(=O)C=C2)C(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D09 compound treatment 0.389 0.314 20.2 0.511 0.44 30.77 36.0444 0.9792 1587778 IFLab1_005707 Cc1cc(C)n(n1)C(=O)c2ccc(NC(=O)C3CCCCC3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D10 compound treatment 0.073 -0.00209 -0.13 0.064 -0.00655 -0.46 -0.4188 -0.8781 2068550 IFLab1_005708 Cc1nc(cs1)c2ccc(NS(=O)(=O)C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D11 compound treatment 0.255 0.18 11.58 0.235 0.164 11.49 16.3117 1.0 2068551 IFLab1_005709 CCOC(=O)c1ccc(NC(=O)/C=C/c2ccc(C)o2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D12 compound treatment 0.148 0.0729 4.69 0.152 0.0815 5.69 7.3418 0.9954 1727105 IFLab1_005710 Cc1cc(C)c(cc1C)S(=O)(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D13 compound treatment 0.054 -0.0211 -1.36 0.052 -0.0185 -1.3 -1.8763 -0.9997 1860982 IFLab1_005711 Cc1ccn(n1)C(=O)c2ccc(NC(=O)C3CC3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D14 compound treatment 0.093 0.0179 1.15 0.087 0.0165 1.15 1.6276 1.0 2068552 IFLab1_005712 CCOC(=O)c1ccc(NC(=O)c2cc3ccccc3c(=O)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D15 compound treatment 0.099 0.0239 1.54 0.087 0.0165 1.15 1.9007 0.9897 2068553 IFLab1_005713 Cc1cc([nH]n1)C(=O)n2nc(C)cc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D16 compound treatment 0.081 0.00591 0.38 0.068 -0.00255 -0.18 0.1429 0.3405 1527441 IFLab1_005714 O=C(N1CCn2c1nc3ccccc23)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D17 compound treatment 0.081 0.00591 0.38 0.077 0.00645 0.45 0.5875 0.9964 2068554 IFLab1_005715 CC(=O)N/C(=C\c1ccccc1)/C(=O)NCC2CCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D18 compound treatment 0.169 0.0939 6.04 0.158 0.0875 6.11 8.5939 1.0 2068555 IFLab1_005716 O=C(Nc1ccc2[nH]c3CCCCc3c2c1)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D19 compound treatment 0.102 0.0269 1.73 0.092 0.0215 1.5 2.2843 0.9974 1515305 IFLab1_005717 COC(=O)CCC(=O)Nc1nc(cs1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D20 compound treatment 0.064 -0.0111 -0.71 0.063 -0.00755 -0.53 -0.8778 -0.9889 2068556 IFLab1_005718 CC1(C)CC(CC(C)(C)N1)NS(=O)(=O)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D21 compound treatment 0.157 0.0819 5.27 0.128 0.0575 4.01 6.5658 0.9909 1351356 IFLab1_005719 Cc1ccc(OCC(=O)N2CCCc3ccccc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D22 compound treatment 0.063 -0.0121 -0.78 0.06 -0.0105 -0.74 -1.0715 -0.9996 2068557 IFLab1_005720 COc1ccc(c(C)c1C)S(=O)(=O)N2CCN(C)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D23 mock treatment 0.074 -0.00109 -0.07 0.071 4.52E-4 0.03 -0.0275 -0.3561 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 D24 mock treatment 0.07 -0.00509 -0.33 0.073 0.00245 0.17 -0.1107 -0.2993 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E01 compound treatment 0.059 -0.0161 -1.04 0.058 -0.0125 -0.88 -1.3523 -0.9966 2068558 IFLab1_005721 COC(=O)c1ccc(/C=N/n2cnnc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E02 compound treatment 0.072 -0.00309 -0.2 0.066 -0.00455 -0.32 -0.3655 -0.9747 2068559 IFLab1_005722 Oc1nc(cc(n1)C(F)(F)F)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E03 compound treatment 0.089 0.0139 0.9 0.066 -0.00455 -0.32 0.4082 0.4298 2068560 IFLab1_005723 O=C(N1CCc2ccccc12)c3ccc(cc3)S(=O)(=O)NCC4CCCO4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E04 compound treatment 0.089 0.0139 0.9 0.095 0.0245 1.71 1.8408 0.9545 2068561 IFLab1_005724 CC(C)N1C(=O)/C(=C\2/C(=O)N(CC(=O)O)c3ccc(Br)cc23)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E05 compound treatment 0.063 -0.0121 -0.78 0.061 -0.00955 -0.67 -1.0221 -0.997 2068562 IFLab1_005725 O=C1CCCC2=C1C(C3=C(CCCC3=O)O2)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E06 compound treatment 0.078 0.00291 0.19 0.068 -0.00255 -0.18 0.0064 0.0247 2068563 IFLab1_005726 CC(C)Oc1ccc(cc1)C(=O)NC2CCS(=O)(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E07 compound treatment 0.065 -0.0101 -0.65 0.061 -0.00955 -0.67 -0.9311 -0.9999 1016316 IFLab1_005727 Oc1ncnc2n(Cc3ccccc3)ncc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E08 compound treatment 0.073 -0.00209 -0.13 0.058 -0.0125 -0.88 -0.7152 -0.8063 2068564 IFLab1_005728 CC(=O)Nc1c(nc2ncccn12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E09 compound treatment 0.546 0.471 30.31 0.345 0.274 19.17 34.9898 0.9756 2068565 IFLab1_005729 Cc1ccc(Cn2ncc3c(Nc4ccc(C)cc4)ncnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E10 compound treatment 0.105 0.0299 1.92 0.083 0.0125 0.87 1.9762 0.9356 1470713 IFLab1_005730 Cc1ccc(cc1)S(=O)(=O)c2nc(NN)sc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E11 compound treatment 0.068 -0.00709 -0.46 0.065 -0.00555 -0.39 -0.5969 -0.9967 1264560 IFLab1_005731 COC(=O)c1cc(Br)ccc1NC(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E12 compound treatment 0.063 -0.0121 -0.78 0.062 -0.00855 -0.6 -0.9727 -0.9914 1050406 IFLab1_005732 Cc1cccc(OCC(O)CN2CCCCC2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E13 compound treatment 0.079 0.00391 0.25 0.067 -0.00355 -0.25 0.0025 0.0071 2068566 IFLab1_005733 CC(C)(C)N/C(=N/S(=O)(=O)c1cccs1)/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E14 compound treatment 0.071 -0.00409 -0.26 0.062 -0.00855 -0.6 -0.6086 -0.9324 1051147 IFLab1_005734 Cc1cccc(OCC(O)CN2CCN(CC2)c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E15 compound treatment 0.064 -0.0111 -0.71 0.06 -0.0105 -0.74 -1.026 -0.9999 2068567 IFLab1_005735 FC(F)(F)c1ccc2SC(CC(=O)NC3CCCCC3)C(=O)Nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E16 compound treatment 0.092 0.0169 1.09 0.086 0.0155 1.08 1.5327 1.0 2068568 IFLab1_005736 COc1ccc2c(Cl)c(sc2c1)c3nnc(SCC(=O)N)n3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E17 compound treatment 0.086 0.0109 0.7 0.082 0.0115 0.8 1.0621 0.9979 1229014 IFLab1_005737 CCOC(=O)c1c2-c3ccccc3C(=O)c4cccc([nH]c1=O)c42 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E18 compound treatment 0.23 0.155 9.97 0.21 0.139 9.74 13.9389 0.9999 1465443 IFLab1_005738 COC(=O)c1c(N)sc2CCCCCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E19 compound treatment 0.055 -0.0201 -1.29 0.054 -0.0165 -1.16 -1.732 -0.9984 2068569 IFLab1_005739 CN(C)S(=O)(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E20 compound treatment 0.132 0.0569 3.66 0.094 0.0235 1.64 3.7484 0.9342 2068570 IFLab1_005740 COc1cccc(c1)S(=O)(=O)NCc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E21 compound treatment 0.112 0.0369 2.38 0.104 0.0335 2.34 3.3322 1.0 2068571 IFLab1_005741 COC(=O)C1Sc2[nH]c(=O)sc2C(C1C(=O)OC)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E22 compound treatment 0.062 -0.0131 -0.84 0.054 -0.0165 -1.16 -1.4134 -0.9879 2068572 IFLab1_005742 CCN1CCN(CC1)S(=O)(=O)c2ccc(Oc3ccccc3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E23 mock treatment 0.072 -0.00309 -0.2 0.062 -0.00855 -0.6 -0.5631 -0.8945 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 E24 mock treatment 0.078 0.00291 0.19 0.074 0.00345 0.24 0.3028 0.9921 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F01 compound treatment 0.08 0.00491 0.32 0.071 4.52E-4 0.03 0.2456 0.7739 1258274 IFLab1_005743 Cc1nnc(SCC(=O)Nc2ccc3OCCOc3c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F02 compound treatment 0.06 -0.0151 -0.97 0.056 -0.0145 -1.02 -1.4056 -0.9997 2068573 IFLab1_005744 COc1ccc(cc1)C(=O)C(C)OC(=O)c2ccc3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F03 compound treatment 0.07 -0.00509 -0.33 0.07 -5.48E-4 -0.04 -0.2589 -0.7844 1243591 IFLab1_005745 O=C(Cc1ccccc1)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F04 compound treatment 0.066 -0.00909 -0.59 0.059 -0.0115 -0.81 -0.9844 -0.9876 2068574 IFLab1_005746 COc1cc(Cl)ccc1S(=O)(=O)N2CCN(CC2)c3ccc(C)c(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F05 compound treatment 0.068 -0.00709 -0.46 0.066 -0.00455 -0.32 -0.5475 -0.9843 1223953 IFLab1_005747 O=C(Nc1ccc(cc1)S(=O)(=O)N2CCCCC2)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F06 compound treatment 0.049 -0.0261 -1.68 0.049 -0.0215 -1.51 -2.2521 -0.9985 2068575 IFLab1_005748 CCC(=O)c1ccc(OC(=O)c2cc3cc(Br)ccc3oc2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F07 compound treatment 0.154 0.0789 5.08 0.119 0.0485 3.38 5.9847 0.9806 2068576 IFLab1_005749 O=C(Nc1ccc(Oc2ccccc2)cc1)/C=C/c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F08 compound treatment 0.136 0.0609 3.92 0.139 0.0685 4.78 6.1534 0.9951 2068577 IFLab1_005750 CCOc1cc(ccc1OC)C(C#N)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F09 compound treatment 0.195 0.12 7.72 0.181 0.11 7.72 10.9134 1.0 2068578 IFLab1_005751 O=C(C1CC1)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F10 compound treatment 0.326 0.251 16.15 0.388 0.317 22.18 27.1011 0.9879 2068579 IFLab1_005752 Clc1ccc(cc1)S(=O)(=O)N2CCSC2c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F11 compound treatment 0.093 0.0179 1.15 0.08 0.00945 0.66 1.2819 0.9651 2068580 IFLab1_005753 O=C(/C=C/c1ccco1)N2CCCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F12 compound treatment 0.071 -0.00409 -0.26 0.072 0.00145 0.1 -0.1146 -0.4059 1372844 IFLab1_005754 Cc1cc(C)c(cc1C)S(=O)(=O)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F13 compound treatment 0.068 -0.00709 -0.46 0.061 -0.00955 -0.67 -0.7945 -0.9829 2068581 IFLab1_005755 O=C(C1CC1)N2CCNC(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F14 compound treatment 0.065 -0.0101 -0.65 0.065 -0.00555 -0.39 -0.7335 -0.9695 2068582 IFLab1_005756 COc1cccc(CC2(O)C(=O)Nc3ccccc32)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F15 compound treatment 0.056 -0.0191 -1.23 0.073 0.00245 0.17 -0.7479 -0.6027 2068583 IFLab1_005757 CC(C)(C)OC(=O)N1CCNC(=O)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F16 compound treatment 0.062 -0.0131 -0.84 0.057 -0.0135 -0.95 -1.2652 -0.9983 2068584 IFLab1_005758 CS(=O)(=O)N1CCn2c1nc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F17 compound treatment 0.042 -0.0331 -2.13 0.045 -0.0255 -1.78 -2.7682 -0.9961 1136002 IFLab1_005759 O=C(Nc1ccc(cc1)C(=O)c2ccccc2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F18 compound treatment 0.068 -0.00709 -0.46 0.101 0.0305 2.13 1.1814 0.543 2068585 IFLab1_005760 Cc1ccn2cc(CSc3ncccn3)nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F19 compound treatment 0.073 -0.00209 -0.13 0.077 0.00645 0.45 0.2234 0.4749 1450947 IFLab1_005761 Cc1ccc(OCC(=O)Nc2sc3CCCCc3c2C(=O)N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F20 compound treatment 0.083 0.00791 0.51 0.075 0.00445 0.31 0.5797 0.9721 2068586 IFLab1_005762 CCOc1ccc(c2ccccc12)S(=O)(=O)NC3CC(C)(C)NC(C)(C)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F21 compound treatment 0.094 0.0189 1.22 0.077 0.00645 0.45 1.1792 0.9087 1520384 IFLab1_005763 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F22 compound treatment 0.181 0.106 6.82 0.144 0.0735 5.13 8.4485 0.9902 2068587 IFLab1_005764 CCOc1ccc(Cl)cc1S(=O)(=O)N2CCCC(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F23 mock treatment 0.059 -0.0161 -1.04 0.065 -0.00555 -0.39 -1.0066 -0.9101 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 F24 mock treatment 0.072 -0.00309 -0.2 0.071 4.52E-4 0.03 -0.1185 -0.5877 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G01 compound treatment 0.053 -0.0221 -1.42 0.05 -0.0205 -1.44 -2.0206 -1.0 1241260 IFLab1_005765 CCOC(=O)c1ccc(NC(=O)c2ccccc2OC(=O)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G02 compound treatment 0.069 -0.00609 -0.39 0.061 -0.00955 -0.67 -0.749 -0.968 2068588 IFLab1_005766 CCCN1C(=O)/C(=C/2\SC(=S)N(CC=C)C2=O)/c3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G03 compound treatment 0.073 -0.00209 -0.13 0.066 -0.00455 -0.32 -0.32 -0.9271 1357017 IFLab1_005767 O=S(=O)(N1CCCC1)c2ccc(cc2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G04 compound treatment 0.049 -0.0261 -1.68 0.049 -0.0215 -1.51 -2.2521 -0.9985 2068589 IFLab1_005768 CC(Oc1ccc(F)cc1)C(=O)Oc2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G05 compound treatment 0.062 -0.0131 -0.84 0.066 -0.00455 -0.32 -0.8206 -0.9111 1551594 IFLab1_005769 Oc1ccc(cc1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G06 compound treatment 0.322 0.247 15.89 0.264 0.193 13.51 20.7936 0.9967 2068590 IFLab1_005770 CC(C)Oc1ccc(cc1)C(=O)NCc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G07 compound treatment 0.15 0.0749 4.82 0.159 0.0885 6.18 7.7786 0.9925 2068591 IFLab1_005771 Clc1ccc(Cn2ncc3c(ncnc23)N4CCCCC4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G08 compound treatment 0.052 -0.0231 -1.49 0.048 -0.0225 -1.58 -2.1649 -0.9996 2068592 IFLab1_005772 Cc1cc(C)n(n1)C(=O)CNC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G09 compound treatment 0.137 0.0619 3.98 0.124 0.0535 3.73 5.458 0.9995 2068593 IFLab1_005773 CC1CCN(CC1)c2ncnc3n(Cc4ccc(C)cc4)ncc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G10 compound treatment 0.125 0.0499 3.21 0.11 0.0395 2.76 4.2202 0.9971 1741156 IFLab1_005774 Cc1ccc(cc1)c2nnnn2CS(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G11 compound treatment 0.074 -0.00109 -0.07 0.071 4.52E-4 0.03 -0.0275 -0.3561 1719877 IFLab1_005775 COc1ccccc1N(CC(O)CN2C(C)CCCC2C)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G12 compound treatment 0.062 -0.0131 -0.84 0.061 -0.00955 -0.67 -1.0676 -0.9933 2068594 IFLab1_005776 CC1CC(C)CN(CC(O)COc2cccc(C)c2)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G13 compound treatment 0.068 -0.00709 -0.46 0.068 -0.00255 -0.18 -0.4487 -0.9157 2068595 IFLab1_005777 CN(C)C(=O)CSc1nc(N)cc(O)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G14 compound treatment 0.071 -0.00409 -0.26 0.059 -0.0115 -0.81 -0.7568 -0.8917 2068596 IFLab1_005778 CCN1CCN(CC(O)COc2cccc(C)c2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G15 compound treatment 0.06 -0.0151 -0.97 0.062 -0.00855 -0.6 -1.1092 -0.9727 2068597 IFLab1_005779 OC(=O)c1ccccc1SC2CC(=O)N(C3CCCCC3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G16 compound treatment 0.098 0.0229 1.47 0.105 0.0345 2.41 2.7444 0.9723 2068598 IFLab1_005780 CCOC(=O)N1CCN(CC1)C(=O)c2sc3cc(F)ccc3c2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G17 compound treatment 0.503 0.428 27.54 0.542 0.471 32.94 42.7642 0.996 1874324 IFLab1_005781 COC(=O)c1c2C(=O)c3ccccc3C(=O)c2n4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G18 compound treatment 0.059 -0.0161 -1.04 0.062 -0.00855 -0.6 -1.1547 -0.9658 2068599 IFLab1_005782 C(Nc1ncnc2sccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G19 compound treatment 0.058 -0.0171 -1.1 0.059 -0.0115 -0.81 -1.3485 -0.9884 2068600 IFLab1_005783 CCN(CC)S(=O)(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G20 compound treatment 0.369 0.294 18.92 0.303 0.232 16.24 24.8593 0.9971 2068601 IFLab1_005784 COc1ccccc1Oc2ccc(cc2)S(=O)(=O)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G21 compound treatment 0.117 0.0419 2.7 0.101 0.0305 2.13 3.4115 0.9931 1874958 IFLab1_005785 COc1ccc(cc1)C(=O)Nc2sc3CCCCc3c2C(=O)NCc4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G22 compound treatment 0.074 -0.00109 -0.07 0.068 -0.00255 -0.18 -0.1757 -0.9176 2068602 IFLab1_005786 FC(F)(F)c1cc(ccc1Cl)S(=O)(=O)N2CCN(CC2)C(=O)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G23 mock treatment 0.072 -0.00309 -0.2 0.066 -0.00455 -0.32 -0.3655 -0.9747 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 G24 mock treatment 0.072 -0.00309 -0.2 0.064 -0.00655 -0.46 -0.4643 -0.9306 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H01 compound treatment 0.077 0.00191 0.12 0.06 -0.0105 -0.74 -0.4343 -0.5814 2068603 IFLab1_005787 Cc1cc2ccccc2n3c(SCC(=O)NCC4CCCO4)nnc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H02 compound treatment 0.054 -0.0211 -1.36 0.05 -0.0205 -1.44 -1.9751 -0.9996 1436799 IFLab1_005788 Clc1ccc(cc1Cl)C(=O)COC(=O)c2ccc3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H03 compound treatment 0.042 -0.0331 -2.13 0.042 -0.0285 -1.99 -2.9164 -0.9995 1430777 IFLab1_005789 COC(=O)CCC(=O)Nc1sc(C)c(C)c1C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H04 compound treatment 0.058 -0.0171 -1.1 0.065 -0.00555 -0.39 -1.0521 -0.9019 2068604 IFLab1_005790 Nc1nc(cs1)c2cccc(NS(=O)(=O)c3ccccc3)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H05 compound treatment 1.079 1.0 64.62 1.068 0.997 69.68 94.9632 0.9993 2068605 IFLab1_005791 COC(=O)c1c(NC(=O)C2CC2)sc3CCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H06 compound treatment 0.063 -0.0121 -0.78 0.058 -0.0125 -0.88 -1.1703 -0.9982 2068606 IFLab1_005792 NC(=O)C1CCN(CC1)C(=O)c2cc3cc(Br)ccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H07 compound treatment 0.044 -0.0311 -2.0 0.044 -0.0265 -1.85 -2.7266 -0.9993 1588356 IFLab1_005793 Cc1sc(NC(=O)C2CC2)c(C(=O)N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H08 compound treatment 0.084 0.00891 0.57 0.069 -0.00155 -0.11 0.3289 0.5637 2068607 IFLab1_005794 COc1cccc(c1)C2CC(=O)Nc3sc4c(C)c(C#N)c(N)nc4c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H09 compound treatment 0.079 0.00391 0.25 0.088 0.0175 1.22 1.0399 0.8354 1703452 IFLab1_005795 Cc1cc(C)n(n1)C(=O)c2ccc(NC(=O)C3CC3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H10 compound treatment 0.106 0.0309 1.99 0.082 0.0115 0.8 1.9723 0.9199 2068608 IFLab1_005796 CS(=O)(=O)N1CCSC1c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H11 compound treatment 0.118 0.0429 2.76 0.107 0.0365 2.55 3.7534 0.9992 2068609 IFLab1_005797 CN(Cc1ccccc1)C(=O)/C=C/c2ccc(C)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H12 compound treatment 0.732 0.657 42.28 0.597 0.526 36.78 55.9036 0.9976 2068610 IFLab1_005798 COc1ccc2cc(sc(=O)c2c1OC)C(=O)OC(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H13 compound treatment 0.071 -0.00409 -0.26 0.066 -0.00455 -0.32 -0.411 -0.9957 1243065 IFLab1_005799 OC(=O)C1CCCCC1C(=O)NCC2CCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H14 compound treatment 0.073 -0.00209 -0.13 0.064 -0.00655 -0.46 -0.4188 -0.8781 1145455 IFLab1_005800 CC(=O)Nc1cccc(NC(=O)c2cccnc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H15 compound treatment 0.087 0.0119 0.77 0.08 0.00945 0.66 1.0088 0.9972 2068611 IFLab1_005801 CC(=O)Oc1cn(C)c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H16 compound treatment 0.129 0.0539 3.47 0.099 0.0285 1.99 3.8589 0.965 2068612 IFLab1_005802 COC(=O)Oc1ccc2c3CCCCc3c(=O)oc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H17 compound treatment 0.937 0.862 55.48 0.946 0.875 61.16 82.4737 0.9988 1482525 IFLab1_005803 Nc1c(sc2nc3CCCc3cc12)C(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H18 compound treatment 0.042 -0.0331 -2.13 0.047 -0.0235 -1.65 -2.6694 -0.9918 2068613 IFLab1_005804 Cc1cccc2nc(CSC(=S)NCC3CCCO3)cn12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H19 compound treatment 0.056 -0.0191 -1.23 0.055 -0.0155 -1.09 -1.6371 -0.9981 2068614 IFLab1_005805 O=C(N1CCc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H20 compound treatment 0.065 -0.0101 -0.65 0.063 -0.00755 -0.53 -0.8323 -0.9946 2068615 IFLab1_005806 COc1cc(C)c(C)cc1S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H21 compound treatment 0.085 0.00991 0.64 0.076 0.00545 0.38 0.7202 0.9697 2068616 IFLab1_005807 CCCS(=O)(=O)N1CCN(CC1)c2ccccc2F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H22 compound treatment 0.078 0.00291 0.19 0.073 0.00245 0.17 0.2534 0.999 2068617 IFLab1_005808 CCOc1ccc(Cl)cc1S(=O)(=O)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H23 mock treatment 0.076 9.06E-4 0.06 0.067 -0.00355 -0.25 -0.134 -0.5263 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 H24 mock treatment 0.064 -0.0111 -0.71 0.073 0.00245 0.17 -0.3838 -0.5227 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I01 compound treatment 0.068 -0.00709 -0.46 0.063 -0.00755 -0.53 -0.6957 -0.9974 1711638 IFLab1_005809 CC(=O)Nc1ccc(NC(=O)c2ccccc2OC(=O)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I02 compound treatment 0.082 0.00691 0.44 0.074 0.00345 0.24 0.4848 0.9587 2068618 IFLab1_005810 COCCN1C(=O)/C(=C/c2cn(nc2c3ccccc3)c4ccccc4)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I03 compound treatment 0.068 -0.00709 -0.46 0.061 -0.00955 -0.67 -0.7945 -0.9829 2068619 IFLab1_005811 CC1(C)CC(=O)C2=C(C1)OC3=C(C2c4ccccn4)C(=O)CC(C)(C)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I04 compound treatment 0.052 -0.0231 -1.49 0.051 -0.0195 -1.37 -2.0167 -0.9991 1875413 IFLab1_005812 CC(Oc1ccc(F)cc1)C(=O)Oc2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I05 compound treatment 0.066 -0.00909 -0.59 0.066 -0.00455 -0.32 -0.6386 -0.9588 1664813 IFLab1_005813 Clc1ccccc1C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I06 compound treatment 0.176 0.101 6.49 0.134 0.0635 4.43 7.7269 0.9827 2068620 IFLab1_005814 COC(=O)Nc1sc(nc1c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I07 compound treatment 0.066 -0.00909 -0.59 0.062 -0.00855 -0.6 -0.8362 -0.9999 2068621 IFLab1_005815 CN1CCN(CC1)c2ncnc3n(Cc4ccc(Cl)cc4)ncc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I08 compound treatment 0.3 0.225 14.48 0.294 0.223 15.61 21.2743 0.9993 1351145 IFLab1_005816 COc1ccc(cc1OC)c2nnc(o2)c3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I09 compound treatment 0.081 0.00591 0.38 0.075 0.00445 0.31 0.4887 0.995 1693765 IFLab1_005817 Cc1cc(C)c(c(C)c1)S(=O)(=O)N2CCC(CC2)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I10 compound treatment 0.071 -0.00409 -0.26 0.069 -0.00155 -0.11 -0.2628 -0.9227 1339994 IFLab1_005818 Cc1ccc(cc1)S(=O)(=O)CNC(=O)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I11 compound treatment 0.065 -0.0101 -0.65 0.063 -0.00755 -0.53 -0.8323 -0.9946 2068622 IFLab1_005819 CCOC(=O)/C(=C\1/Sc2ccccc2N1C)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I12 compound treatment 0.061 -0.0141 -0.91 0.058 -0.0125 -0.88 -1.2613 -0.9999 2068623 IFLab1_005820 CC1CCCC(C)N1CC(O)COc2cccc(C)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I13 compound treatment 0.086 0.0109 0.7 0.071 4.52E-4 0.03 0.5187 0.7381 2068624 IFLab1_005821 CCN(CC)C(=O)CSc1nc(N)cc(O)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I14 compound treatment 0.062 -0.0131 -0.84 0.063 -0.00755 -0.53 -0.9688 -0.9745 1559508 IFLab1_005822 Cc1cccc(OCC(O)Cn2cnc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I15 compound treatment 0.071 -0.00409 -0.26 0.061 -0.00955 -0.67 -0.658 -0.9174 2068625 IFLab1_005823 CCc1ccccc1NC(=O)CC2SC(=N)NC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I16 compound treatment 0.149 0.0739 4.76 0.14 0.0695 4.85 6.7945 1.0 1566329 IFLab1_005824 O=C(COC(=O)C1CCN(CC1)S(=O)(=O)c2cccs2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I17 compound treatment 0.081 0.00591 0.38 0.07 -5.48E-4 -0.04 0.2417 0.6326 2068626 IFLab1_005825 Nc1cc(O)nc(SCc2ccc(cc2)C(=O)c3ccccc3)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I18 compound treatment 0.079 0.00391 0.25 0.072 0.00145 0.1 0.2495 0.9203 2068627 IFLab1_005826 Cc1sc2nc[nH]c(=O)c2c1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I19 compound treatment 0.08 0.00491 0.32 0.079 0.00845 0.59 0.6408 0.957 2068628 IFLab1_005827 CCCC(=O)Nc1nc2ccc(cc2s1)S(=O)(=O)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I20 compound treatment 0.171 0.0959 6.17 0.157 0.0865 6.04 8.6355 0.9999 2068629 IFLab1_005828 COc1cccc(c1)S(=O)(=O)N2CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I21 compound treatment 0.066 -0.00909 -0.59 0.065 -0.00555 -0.39 -0.688 -0.98 2068630 IFLab1_005829 CCCN1C(=O)/C(=C\2/C(=O)N(Cc3ccc(C)cc3)c4ccccc24)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I22 compound treatment 0.072 -0.00309 -0.2 0.076 0.00545 0.38 0.1285 0.299 1526180 IFLab1_005830 Fc1cccc(F)c1S(=O)(=O)N2CCN(CC2)C(=O)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I23 mock treatment 0.078 0.00291 0.19 0.126 0.0555 3.87 2.8715 0.7404 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 I24 mock treatment 0.08 0.00491 0.32 0.077 0.00645 0.45 0.542 0.9849 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J01 compound treatment 0.046 -0.0291 -1.87 0.046 -0.0245 -1.71 -2.5368 -0.999 2068631 IFLab1_005831 Cc1cc(O)n(n1)C(=S)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J02 compound treatment 0.069 -0.00609 -0.39 0.062 -0.00855 -0.6 -0.6996 -0.9792 2068632 IFLab1_005832 Brc1ccc(nc1)C(=O)OCC(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J03 compound treatment 0.057 -0.0181 -1.16 0.055 -0.0155 -1.09 -1.5916 -0.9994 2068633 IFLab1_005833 Cn1ccnc1C(O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J04 compound treatment 0.157 0.0819 5.27 0.145 0.0745 5.2 7.4056 1.0 2068634 IFLab1_005834 O=C(COC(=O)c1cccs1)c2cccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J05 compound treatment 0.071 -0.00409 -0.26 0.062 -0.00855 -0.6 -0.6086 -0.9324 1191156 IFLab1_005835 O=C(Nc1ccc(cc1)S(=O)(=O)N2CCCC2)C3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J06 compound treatment 0.076 9.06E-4 0.06 0.074 0.00345 0.24 0.2118 0.8535 1131862 IFLab1_005836 Cc1cc(NCc2cccnc2)n3c4ccccc4nc3c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J07 compound treatment 0.062 -0.0131 -0.84 0.062 -0.00855 -0.6 -1.0182 -0.9858 2068635 IFLab1_005837 CC1CCN(CC1)S(=O)(=O)c2ccc(NC(=O)/C=C/c3ccco3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J08 compound treatment 0.084 0.00891 0.57 0.08 0.00945 0.66 0.8722 0.9975 2068636 IFLab1_005838 O=C(CSC1=C(C#N)C(CC(=O)N1)c2ccco2)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J09 compound treatment 0.171 0.0959 6.17 0.39 0.319 22.32 20.1454 0.87 2068637 IFLab1_005839 COc1ccc(/C=C/C(=O)Nc2nccs2)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J10 compound treatment 0.102 0.0269 1.73 0.088 0.0175 1.22 2.0867 0.9852 2068638 IFLab1_005840 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCSC2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J11 compound treatment 0.088 0.0129 0.83 0.085 0.0145 1.01 1.3013 0.9953 2068639 IFLab1_005841 Cc1ccc(/C=C/C(=O)NCC2CCCO2)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J12 compound treatment 0.437 0.362 23.29 0.412 0.341 23.85 33.3386 0.9999 2068640 IFLab1_005842 CCOC(=O)c1cc2ccccc2c(=O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J13 compound treatment 0.102 0.0269 1.73 0.075 0.00445 0.31 1.4445 0.821 1707491 IFLab1_005843 COc1cc(cc(OC)c1OC)C(=O)NCC2CCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J14 compound treatment 0.072 -0.00309 -0.2 0.07 -5.48E-4 -0.04 -0.1679 -0.828 2068641 IFLab1_005844 Cc1ccc(cc1NC(=O)c2cccnc2)S(=O)(=O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J15 compound treatment 0.091 0.0159 1.02 0.089 0.0185 1.29 1.6354 0.9935 2068642 IFLab1_005845 O=C(Nc1nccs1)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J16 compound treatment 0.07 -0.00509 -0.33 0.065 -0.00555 -0.39 -0.5059 -0.9965 2068643 IFLab1_005846 CN(C1CCS(=O)(=O)C1)C(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J17 compound treatment 0.08 0.00491 0.32 0.074 0.00345 0.24 0.3938 0.9911 1007321 IFLab1_005847 CCOC(=O)c1[nH]c(C)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J18 compound treatment 0.054 -0.0211 -1.36 0.053 -0.0175 -1.23 -1.8269 -0.9987 2068644 IFLab1_005848 Cc1cccc2nc(CSC(=S)NCc3cccnc3)cn12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J19 compound treatment 0.184 0.109 7.01 0.147 0.0765 5.34 8.7332 0.991 1374001 IFLab1_005849 O=C(COc1ccccc1)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J20 compound treatment 0.164 0.0889 5.72 0.141 0.0705 4.92 7.5266 0.9972 2068645 IFLab1_005850 COc1cc(C)c(cc1S(=O)(=O)N2CCCC2)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J21 compound treatment 0.076 9.06E-4 0.06 0.068 -0.00255 -0.18 -0.0846 -0.4518 1361126 IFLab1_005851 Cc1ccc(cc1C(=O)O)S(=O)(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J22 compound treatment 0.079 0.00391 0.25 0.066 -0.00455 -0.32 -0.0469 -0.1157 2068646 IFLab1_005852 CCOc1ccc(Cl)cc1S(=O)(=O)N2CC(C)OC(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J23 mock treatment 0.078 0.00291 0.19 0.077 0.00645 0.45 0.451 0.9241 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 J24 mock treatment 0.08 0.00491 0.32 0.08 0.00945 0.66 0.6902 0.943 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K01 compound treatment 0.079 0.00391 0.25 0.069 -0.00155 -0.11 0.1013 0.3701 2068647 IFLab1_005853 Clc1cccc(c1)N2CCN(CC2)C(=O)c3ccc(cc3)S(=O)(=O)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K02 compound treatment 0.079 0.00391 0.25 0.075 0.00445 0.31 0.3977 0.9944 2068648 IFLab1_005854 OC(=O)CSc1nc(cc(c1C#N)C(F)(F)F)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K03 compound treatment 0.066 -0.00909 -0.59 0.056 -0.0145 -1.02 -1.1325 -0.9656 2068649 IFLab1_005855 O=C1CCCC2=C1C(C3=C(CCCC3=O)O2)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K04 compound treatment 0.076 9.06E-4 0.06 0.067 -0.00355 -0.25 -0.134 -0.5263 2068650 IFLab1_005856 CN1C(=O)/C(=C/C2=Cc3ccccc3OC2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K05 compound treatment 0.071 -0.00409 -0.26 0.063 -0.00755 -0.53 -0.5592 -0.9486 2068651 IFLab1_005857 Cc1cc(NCc2ccccn2)n3c4ccccc4nc3c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K06 compound treatment 0.076 9.06E-4 0.06 0.073 0.00245 0.17 0.1624 0.8973 2068652 IFLab1_005858 Cc1ccc(SCC(=O)Nc2nnc(SCc3ccccc3)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K07 compound treatment 0.429 0.354 22.78 0.473 0.402 28.12 35.9878 0.9945 2068653 IFLab1_005859 CCN(CC)c1ncnc2n(Cc3ccc(Cl)cc3)ncc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K08 compound treatment 0.074 -0.00109 -0.07 0.08 0.00945 0.66 0.4171 0.6282 2068654 IFLab1_005860 O=S1(=O)CCC(C1)n2nnnc2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K09 compound treatment 1.145 1.07 68.86 1.039 0.968 67.66 96.5345 1.0 1603138 IFLab1_005861 COc1ccc(cc1OC)S(=O)(=O)N2CCc3ccccc3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K10 compound treatment 0.055 -0.0201 -1.29 0.065 -0.00555 -0.39 -1.1886 -0.8803 2068655 IFLab1_005862 COC(=O)NC(=C(Cl)Cl)S(=O)(=O)c1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K11 compound treatment 0.123 0.0479 3.08 0.091 0.0205 1.43 3.1906 0.9389 2068656 IFLab1_005863 CC(C)CCNC(=O)c1cccc(NS(=O)(=O)c2ccc(C)cc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K12 compound treatment 0.079 0.00391 0.25 0.073 0.00245 0.17 0.2989 0.9825 2068657 IFLab1_005864 CC1CN(CC(O)COc2cccc(C)c2)CC(C)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K13 compound treatment 0.082 0.00691 0.44 0.063 -0.00755 -0.53 -0.0586 -0.0849 2068658 IFLab1_005865 Nc1cc(O)nc(SCC(=O)Nc2ccccc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K14 compound treatment 0.068 -0.00709 -0.46 0.069 -0.00155 -0.11 -0.3993 -0.8511 2068659 IFLab1_005866 Cc1cccc(OCC(O)CN2C(C)(C)CCCC2(C)C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K15 compound treatment 0.071 -0.00409 -0.26 0.064 -0.00655 -0.46 -0.5098 -0.9657 2068660 IFLab1_005867 FC(F)(F)Sc1ccccc1NC(=O)CC2SC(=N)NC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K16 compound treatment 0.057 -0.0181 -1.16 0.052 -0.0185 -1.3 -1.7398 -0.9986 2068661 IFLab1_005868 Fc1ccc2c(Cl)c(sc2c1)C(=O)Nc3ccon3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K17 compound treatment 0.067 -0.00809 -0.52 0.062 -0.00855 -0.6 -0.7906 -0.9977 2068662 IFLab1_005869 O=C(CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccco3)NC4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K18 compound treatment 0.07 -0.00509 -0.33 0.067 -0.00355 -0.25 -0.4071 -0.9905 2068663 IFLab1_005870 COCCn1c(C)cc(C(=O)CSc2ncnc3sc(C)c(C)c23)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K19 compound treatment 0.073 -0.00209 -0.13 0.073 0.00245 0.17 0.0258 0.1184 2068664 IFLab1_005871 Nc1nc2ccc(cc2s1)S(=O)(=O)N3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K20 compound treatment 0.131 0.0559 3.6 0.12 0.0495 3.45 4.9873 0.9998 2068665 IFLab1_005872 COc1ccc(cc1)c2ccc(cc2)S(=O)(=O)N3CCCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K21 compound treatment 0.071 -0.00409 -0.26 0.059 -0.0115 -0.81 -0.7568 -0.8917 2068666 IFLab1_005873 COCCN1C(=O)/C(=C\2/C(=O)N(Cc3ccc(C)cc3)c4ccccc24)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K22 compound treatment 0.075 -9.38E-5 -0.01 0.075 0.00445 0.31 0.2156 0.6933 2068667 IFLab1_005874 COc1ccccc1Oc2ccc(cc2)S(=O)(=O)Nc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K23 mock treatment 0.075 -9.38E-5 -0.01 0.062 -0.00855 -0.6 -0.4265 -0.7142 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 K24 mock treatment 0.069 -0.00609 -0.39 0.068 -0.00255 -0.18 -0.4032 -0.9361 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L01 compound treatment 0.063 -0.0121 -0.78 0.07 -5.48E-4 -0.04 -0.5775 -0.741 1637501 IFLab1_005875 O=C(NC1CCCCC1NC(=O)c2cccs2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L02 compound treatment 0.08 0.00491 0.32 0.07 -5.48E-4 -0.04 0.1962 0.6168 2068668 IFLab1_005876 COc1ccc(cc1OC)C(=O)N2CCN(CC2)c3ccc(Cl)c(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L03 compound treatment 0.05 -0.0251 -1.62 0.053 -0.0175 -1.23 -2.009 -0.9907 1040671 IFLab1_005877 CC(=O)OCC(=O)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L04 compound treatment 0.215 0.14 9.01 0.261 0.19 13.3 15.7755 0.9819 2068669 IFLab1_005878 CC(OC(=O)c1cccs1)C(=O)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L05 compound treatment 0.104 0.0289 1.86 0.105 0.0345 2.41 3.0175 0.9919 2068670 IFLab1_005879 Cc1cc(C)nc(SCCS(=O)(=O)Cc2ccc(Cl)cc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L06 compound treatment 0.065 -0.0101 -0.65 0.068 -0.00255 -0.18 -0.5853 -0.8688 2068671 IFLab1_005880 Cc1cc(NCCCN2CCOCC2)n3c4ccccc4nc3c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L07 compound treatment 0.447 0.372 23.94 0.095 0.0245 1.71 18.1344 0.7556 2068672 IFLab1_005881 O=C(Nc1ccc(Nc2ccccc2)cc1)/C=C/c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L08 compound treatment 0.079 0.00391 0.25 0.096 0.0255 1.78 1.4351 0.7991 2068673 IFLab1_005882 O=C(CSC1=C(C#N)C(CC(=O)N1)c2ccco2)NCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L09 compound treatment 0.178 0.103 6.62 0.146 0.0755 5.27 8.4107 0.9936 2068674 IFLab1_005883 COc1ccc(/C=C/C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCC3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L10 compound treatment 0.079 0.00391 0.25 0.077 0.00645 0.45 0.4965 0.962 2068675 IFLab1_005884 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCSC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L11 compound treatment 0.235 0.16 10.29 0.223 0.152 10.65 14.8087 0.9999 2068676 IFLab1_005885 CN(Cc1ccccc1)S(=O)(=O)c2ccc(NC(=O)/C=C/c3ccco3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L12 compound treatment 0.149 0.0739 4.76 0.136 0.0655 4.57 6.5969 0.9998 2068677 IFLab1_005886 COC(=O)c1cc2ccccc2c(=O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L13 compound treatment 0.272 0.197 12.67 0.388 0.317 22.18 24.6434 0.9648 1197766 IFLab1_005887 Cc1ccc(CNCC2CCCO2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L14 compound treatment 0.079 0.00391 0.25 0.072 0.00145 0.1 0.2495 0.9203 1602731 IFLab1_005888 CS(=O)(=O)c1ccc(Cl)c(NC(=O)c2cccnc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L15 compound treatment 0.665 0.59 37.97 0.57 0.499 34.89 51.5204 0.9991 1364252 IFLab1_005889 CCOC(=O)c1c(NC(=O)CCC(=O)OC)sc2CCCc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L16 compound treatment 0.27 0.195 12.55 0.234 0.163 11.42 16.945 0.9989 2068678 IFLab1_005890 COc1cccc(c1)c2nc3ccccc3c(=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L17 compound treatment 0.075 -9.38E-5 -0.01 0.088 0.0175 1.22 0.8578 0.7036 1319156 IFLab1_005891 CC(=O)Nc1ccc(cc1)S(=O)(=O)NCC2CCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L18 compound treatment 0.051 -0.0241 -1.55 0.048 -0.0225 -1.58 -2.2104 -1.0 2068679 IFLab1_005892 S=C(NCc1ccco1)SCc2cn3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L19 compound treatment 0.088 0.0129 0.83 0.068 -0.00255 -0.18 0.4615 0.5432 1413491 IFLab1_005893 COc1ccc(cc1OC)C(O)c2nccn2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L20 compound treatment 0.175 0.0999 6.43 0.14 0.0695 4.85 7.9778 0.9904 2068680 IFLab1_005894 O=S(=O)(N1CCCC1)c2ccc(cc2)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L21 compound treatment 0.942 0.867 55.8 1.044 0.973 68.01 87.5423 0.9952 2068681 IFLab1_005895 Fc1ccccc1N2CCN(CC2)S(=O)(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L22 compound treatment 0.053 -0.0221 -1.42 0.054 -0.0165 -1.16 -1.823 -0.9947 2068682 IFLab1_005896 COc1ccc(cc1C)S(=O)(=O)NC2CCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L23 mock treatment 0.08 0.00491 0.32 0.064 -0.00655 -0.46 -0.1002 -0.1802 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 L24 mock treatment 0.077 0.00191 0.12 0.069 -0.00155 -0.11 0.0103 0.0628 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M01 compound treatment 0.135 0.0599 3.86 0.102 0.0315 2.2 4.2802 0.9644 2068683 IFLab1_005897 CCn1c(SCC(=O)O)nnc1c2sc3cc(Cl)ccc3c2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M02 compound treatment 0.136 0.0609 3.92 0.13 0.0595 4.15 5.7088 0.9996 1875263 IFLab1_005898 Nc1sc2CCCc2c1C(=O)NCCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M03 compound treatment 0.09 0.0149 0.96 0.075 0.00445 0.31 0.8983 0.8907 2068684 IFLab1_005899 CCCCC1C2=C(CCCC2=O)OC3=C1C(=O)CCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M04 compound treatment 0.075 -9.38E-5 -0.01 0.079 0.00845 0.59 0.4132 0.6998 2068685 IFLab1_005900 Nc1nc(cs1)c2ccc(cc2)S(=O)(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M05 compound treatment 0.099 0.0239 1.54 0.092 0.0215 1.5 2.1477 0.9999 2068686 IFLab1_005901 Clc1ccc(cc1)c2csc3nc[nH]c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M06 compound treatment 0.115 0.0399 2.57 0.102 0.0315 2.2 3.3699 0.997 2068687 IFLab1_005902 N#C/C(=C/C1=Cc2ccccc2OC1)/c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M07 compound treatment 0.098 0.0229 1.47 0.089 0.0185 1.29 1.954 0.9978 2068688 IFLab1_005903 Clc1ccc(Cn2ncc3c(NC4CCCCC4)ncnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M08 compound treatment 0.091 0.0159 1.02 0.083 0.0125 0.87 1.339 0.9967 2068689 IFLab1_005904 CC1Oc2ccccc2C=C1/C=C(\NC(=O)c3ccccc3)/C(=O)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M09 compound treatment 0.257 0.182 11.71 0.172 0.101 7.09 13.2906 0.9711 2068690 IFLab1_005905 CCOc1ccc(OCC)c(c1)S(=O)(=O)N(C)C2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M10 compound treatment 0.168 0.0929 5.98 0.158 0.0875 6.11 8.5484 0.9999 2068691 IFLab1_005906 ClC(=CNC(=O)c1ccccc1)Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M11 compound treatment 0.083 0.00791 0.51 0.09 0.0195 1.36 1.3207 0.9102 2068692 IFLab1_005907 CNCC(O)Cn1c2ccccc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M12 compound treatment 0.082 0.00691 0.44 0.07 -5.48E-4 -0.04 0.2872 0.6438 2068693 IFLab1_005908 CCOC(=O)C1CCN(CC(O)COc2cccc(C)c2)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M13 compound treatment 0.07 -0.00509 -0.33 0.055 -0.0155 -1.09 -0.9999 -0.8813 2068694 IFLab1_005909 CN(C)C(=O)CSc1nc(O)c2c(C)cc(C)nc2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M14 compound treatment 0.065 -0.0101 -0.65 0.058 -0.0125 -0.88 -1.0793 -0.9891 2068695 IFLab1_005910 CC1CCN(CC(O)COc2ccccc2Br)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M15 compound treatment 0.058 -0.0171 -1.1 0.057 -0.0135 -0.95 -1.4473 -0.9972 2068696 IFLab1_005911 Cc1oc2nc(SCC(=O)N3CCCCC3)nc(N)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M16 compound treatment 0.145 0.0699 4.5 0.127 0.0565 3.94 5.9703 0.9978 2068697 IFLab1_005912 CCn1c(SC)nnc1c2nnc(SC)n2CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M17 compound treatment 0.231 0.156 10.03 0.171 0.1 7.02 12.0579 0.9847 2068698 IFLab1_005913 CSCCC(N1C(=O)/C(=C/c2c[nH]c3ccccc23)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M18 compound treatment 0.074 -0.00109 -0.07 0.075 0.00445 0.31 0.1701 0.5335 2068699 IFLab1_005914 COc1cccc(NC(=O)CSc2nnc3ccccn23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M19 compound treatment 0.121 0.0459 2.95 0.095 0.0245 1.71 3.2972 0.9661 2068700 IFLab1_005915 O=C(Nc1nc2ccc(cc2s1)S(=O)(=O)N3CCCC3)/C=C/c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M20 compound treatment 0.173 0.0979 6.3 0.119 0.0485 3.38 6.8494 0.9575 1149422 IFLab1_005916 Cc1ccccc1Oc2ccc(cc2)S(=O)(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M21 compound treatment 0.071 -0.00409 -0.26 0.073 0.00245 0.17 -0.0652 -0.2075 2068701 IFLab1_005917 CCCN1C(=O)/C(=C/2\SC(=S)N(C)C2=O)/c3cc(Br)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M22 compound treatment 0.088 0.0129 0.83 0.08 0.00945 0.66 1.0543 0.9935 2068702 IFLab1_005918 COc1ccccc1Oc2ccc(cc2)S(=O)(=O)NCc3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M23 mock treatment 0.071 -0.00409 -0.26 0.074 0.00345 0.24 -0.0158 -0.0443 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 M24 mock treatment 0.076 9.06E-4 0.06 0.074 0.00345 0.24 0.2118 0.8535 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N01 compound treatment 0.081 0.00591 0.38 0.074 0.00345 0.24 0.4393 0.9759 1464164 IFLab1_005919 Brc1ccc(o1)C(=O)NCC2CCCO2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N02 compound treatment 0.039 -0.0361 -2.32 0.039 -0.0315 -2.2 -3.2012 -0.9997 2068703 IFLab1_005920 C/C(=C/C(=O)O)/C(=O)Nc1sc2CCCCc2c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N03 compound treatment 0.942 0.867 55.8 0.901 0.83 58.02 80.4784 0.9998 2068704 IFLab1_005921 Cc1cc(C)nc(SCCS(=O)(=O)c2nc3ccccc3s2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N04 compound treatment 0.057 -0.0181 -1.16 0.056 -0.0145 -1.02 -1.5422 -0.9977 2068705 IFLab1_005922 OCCN1CCN(CC1)C(=O)c2cc3cc(Br)ccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N05 compound treatment 0.068 -0.00709 -0.46 0.082 0.0115 0.8 0.2428 0.2636 1721418 IFLab1_005923 O=C(NCC1CCCO1)C2CCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N06 compound treatment 0.063 -0.0121 -0.78 0.059 -0.0115 -0.81 -1.1209 -0.9998 1047107 IFLab1_005924 CC(=O)Nc1ccc(cc1)N2C(=O)C=CC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N07 compound treatment 0.086 0.0109 0.7 0.082 0.0115 0.8 1.0621 0.9979 1189856 IFLab1_005925 O=C(Nc1ccc(cc1)S(=O)(=O)N2CCCC2)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N08 compound treatment 0.168 0.0929 5.98 0.159 0.0885 6.18 8.5978 0.9999 1873360 IFLab1_005926 COc1cccc(NC(=O)CSC2=C(C#N)C(C3=C(CCCC3=O)N2)c4ccccc4F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N09 compound treatment 0.164 0.0889 5.72 0.138 0.0675 4.71 7.3784 0.9953 1181825 IFLab1_005927 Cc1ccc2nc(sc2c1)c3ccc(NC(=O)C4CC4)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N10 compound treatment 0.775 0.7 45.05 0.726 0.655 45.79 64.233 1.0 2068706 IFLab1_005928 CC(C)CC(=O)Nc1nc(cs1)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N11 compound treatment 0.161 0.0859 5.53 0.117 0.0465 3.25 6.2045 0.9677 2068707 IFLab1_005929 Fc1ccc(/C=C/C(=O)Nc2ccc(cc2)S(=O)(=O)N3CCCC3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N12 compound treatment 0.885 0.81 52.13 0.71 0.639 44.67 68.449 0.997 2068708 IFLab1_005930 CC(C)OC(=O)c1cc2ccccc2c(=O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N13 compound treatment 0.08 0.00491 0.32 0.069 -0.00155 -0.11 0.1468 0.4398 2068709 IFLab1_005931 O=C(COc1ccccc1)N2CCNC(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N14 compound treatment 0.088 0.0129 0.83 0.07 -5.48E-4 -0.04 0.5603 0.6738 2068710 IFLab1_005932 CC(=O)Nc1cccc(NC(=O)c2c(F)c(F)c(F)c(F)c2F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N15 compound treatment 0.081 0.00591 0.38 0.08 0.00945 0.66 0.7357 0.9656 1263468 IFLab1_005933 O=C(NC1CCSC1=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N16 compound treatment 0.128 0.0529 3.41 0.133 0.0625 4.36 5.4929 0.9925 1189678 IFLab1_005934 COc1ccc(cc1OC)c2nc3ccccc3c(=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N17 compound treatment 0.079 0.00391 0.25 0.071 4.52E-4 0.03 0.2001 0.7896 2068711 IFLab1_005935 O=C(/C=C/c1ccccc1)N2CCN(CC2)C(=O)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N18 compound treatment 0.062 -0.0131 -0.84 0.064 -0.00655 -0.46 -0.9194 -0.9588 2068712 IFLab1_005936 CN1CCN(CC1)C(c2c(C)[nH]c3ccccc23)c4ccncc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N19 compound treatment 0.094 0.0189 1.22 0.087 0.0165 1.15 1.6732 0.9996 1528199 IFLab1_005937 O=C(Nc1ccc(cc1)S(=O)(=O)N2CCCC2)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N20 compound treatment 0.077 0.00191 0.12 0.076 0.00545 0.38 0.3561 0.8899 2068713 IFLab1_005938 COc1cc(C)c(cc1S(=O)(=O)NCCCn2ccnc2)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N21 compound treatment 0.107 0.0319 2.05 0.093 0.0225 1.57 2.5612 0.9911 2068714 IFLab1_005939 O=C(Nc1ccc(cc1)c2cn3ccsc3n2)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N22 compound treatment 0.066 -0.00909 -0.59 0.061 -0.00955 -0.67 -0.8856 -0.9979 2068715 IFLab1_005940 COc1ccc(c2ccccc12)S(=O)(=O)NC3CCCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N23 mock treatment 0.08 0.00491 0.32 0.076 0.00545 0.38 0.4926 0.9957 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 N24 mock treatment 0.068 -0.00709 -0.46 0.068 -0.00255 -0.18 -0.4487 -0.9157 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O01 compound treatment 0.071 -0.00409 -0.26 0.062 -0.00855 -0.6 -0.6086 -0.9324 2068716 IFLab1_005941 CCn1c(SCC(=O)N)nnc1c2sc3cc(Cl)ccc3c2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O02 compound treatment 0.071 -0.00409 -0.26 0.079 0.00845 0.59 0.2312 0.3576 1875264 IFLab1_005942 Nc1c(oc2ccccc12)C(=O)Nc3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O03 compound treatment 0.06 -0.0151 -0.97 0.063 -0.00755 -0.53 -1.0598 -0.9588 2068717 IFLab1_005943 O=C1CCCC2=C1C(C3=C(CCCC3=O)O2)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O04 compound treatment 0.074 -0.00109 -0.07 0.072 0.00145 0.1 0.0219 0.1776 2068718 IFLab1_005944 Clc1ccccc1NC(=O)CN2C(=O)/C(=C/3\SC(=S)N(CC=C)C3=O)/c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O05 compound treatment 0.135 0.0599 3.86 0.109 0.0385 2.69 4.626 0.9844 1867276 IFLab1_005945 CCC(C)(C)C1CCc2sc3nc[nH]c(=O)c3c2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O06 compound treatment 0.1 0.0249 1.6 0.07 -5.48E-4 -0.04 1.1065 0.69 2068719 IFLab1_005946 OC1=C(C(N(Cc2ccco2)C1=O)c3ccccc3)C(=O)c4ccc(OCC=C)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O07 compound treatment 0.065 -0.0101 -0.65 0.067 -0.00355 -0.25 -0.6347 -0.9127 2068720 IFLab1_005947 Clc1ccc(Cn2ncc3c(NCc4cccnc4)ncnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O08 compound treatment 0.08 0.00491 0.32 0.072 0.00145 0.1 0.295 0.8894 2068721 IFLab1_005948 Cc1oc2nc(SCC(=O)NC3CCCCC3)nc(N)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O09 compound treatment 0.089 0.0139 0.9 0.084 0.0135 0.94 1.2974 0.9997 2068722 IFLab1_005949 COc1ccc(cc1C)S(=O)(=O)N(C)C2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O10 compound treatment 0.085 0.00991 0.64 0.071 4.52E-4 0.03 0.4732 0.7412 1629304 IFLab1_005950 Cn1cnnc1SC2CCCCC2NS(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O11 compound treatment 0.148 0.0729 4.69 0.111 0.0405 2.83 5.3164 0.9705 1139707 IFLab1_005951 CS(=O)(=O)N1CCN(CC(O)Cn2c3ccc(Cl)cc3c4cc(Cl)ccc24)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O12 compound treatment 0.07 -0.00509 -0.33 0.059 -0.0115 -0.81 -0.8023 -0.9213 2068723 IFLab1_005952 CCOC(=O)C1CCCN(CC(O)COc2cccc(C)c2)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O13 compound treatment 0.619 0.544 35.01 0.21 0.139 9.74 31.6434 0.8708 2068724 IFLab1_005953 COC(=O)CSc1nc(nc2CCCCc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O14 compound treatment 0.071 -0.00409 -0.26 0.061 -0.00955 -0.67 -0.658 -0.9174 2068725 IFLab1_005954 CCOC(=O)C1CCCN(CC(O)COc2ccccc2Br)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O15 compound treatment 0.08 0.00491 0.32 0.074 0.00345 0.24 0.3938 0.9911 1510267 IFLab1_005955 COC(=O)c1ccc(NS(=O)(=O)c2cccc3cccnc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O16 compound treatment 0.075 -9.38E-5 -0.01 0.063 -0.00755 -0.53 -0.3771 -0.7152 2068726 IFLab1_005956 C(CNc1ncnc2scc(c3ccccc3)c12)CN4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O17 compound treatment 0.296 0.221 14.22 0.215 0.144 10.09 17.1898 0.9859 2068727 IFLab1_005957 CCOc1ccccc1N2C(=O)/C(=C/c3c[nH]c4ccccc34)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O18 compound treatment 0.086 0.0109 0.7 0.083 0.0125 0.87 1.1115 0.9943 1202252 IFLab1_005958 Cc1cc2nnc(SCC(=O)N3CCCC3)n2c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O19 compound treatment 0.074 -0.00109 -0.07 0.074 0.00345 0.24 0.1207 0.4806 2068728 IFLab1_005959 CC(=O)Nc1nc2ccc(cc2s1)S(=O)(=O)N3CCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O20 compound treatment 0.094 0.0189 1.22 0.08 0.00945 0.66 1.3274 0.9587 2068729 IFLab1_005960 COc1ccccc1Oc2ccc(cc2)S(=O)(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O21 compound treatment 0.072 -0.00309 -0.2 0.076 0.00545 0.38 0.1285 0.299 1875129 IFLab1_005961 O=S(=O)(N1CCCCC1)c2ccc(cc2)c3csc(n3)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O22 compound treatment 0.09 0.0149 0.96 0.072 0.00145 0.1 0.7501 0.7775 2068730 IFLab1_005962 Cc1nnc(SCC(=O)Nc2nsc(n2)c3ccccc3)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O23 mock treatment 0.087 0.0119 0.77 0.062 -0.00855 -0.6 0.1196 0.1231 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 O24 mock treatment 0.085 0.00991 0.64 0.073 0.00245 0.17 0.572 0.8663 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P01 compound treatment 0.071 -0.00409 -0.26 0.067 -0.00355 -0.25 -0.3616 -0.9995 1226990 IFLab1_005963 COC(=O)CCC(=O)Nc1ccc(cc1)c2nc3ccc(C)cc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P02 compound treatment 0.074 -0.00109 -0.07 0.071 4.52E-4 0.03 -0.0275 -0.3561 2068731 IFLab1_005964 COc1ccccc1N2CCN(CC2)S(=O)(=O)c3cc(OC)c(C)cc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P03 compound treatment 0.429 0.354 22.78 0.406 0.335 23.43 32.6781 0.9999 1088422 IFLab1_005965 O=S(=O)(c1ccccc1)n2ccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P04 compound treatment 0.066 -0.00909 -0.59 0.059 -0.0115 -0.81 -0.9844 -0.9876 2068732 IFLab1_005966 Brc1cc(Br)c2oc(=O)c(cc2c1)C(=O)OCC(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P05 compound treatment 0.106 0.0309 1.99 0.09 0.0195 1.36 2.3675 0.9827 1678677 IFLab1_005967 COc1ccc(cc1)C2C(CC(=O)N2Cc3ccccc3)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P06 compound treatment 0.053 -0.0221 -1.42 0.052 -0.0185 -1.3 -1.9218 -0.9989 2068733 IFLab1_005968 [O-]/[N+](=C\c1c[nH]c2ccccc12)/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P07 compound treatment 1.209 1.13 72.98 1.114 1.04 72.9 103.1522 1.0 2068734 IFLab1_005969 Cc1cc(C)nc(SCCS(=O)c2ccc(cc2)C(C)(C)C)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P08 compound treatment 0.11 0.0349 2.25 0.086 0.0155 1.08 2.352 0.9436 1873372 IFLab1_005970 O=C(CSC1=C(C#N)C(CC(=O)N1)c2ccco2)N(c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P09 compound treatment 0.072 -0.00309 -0.2 0.062 -0.00855 -0.6 -0.5631 -0.8945 2068735 IFLab1_005971 Cc1ccc(/C=C/C(=O)N2CCN(CC2)C(=O)\C=C\c3ccc(C)o3)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P10 compound treatment 0.213 0.138 8.88 0.175 0.104 7.3 11.4363 0.9953 2068736 IFLab1_005972 CCCC(=O)Nc1nc(cs1)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P11 compound treatment 0.057 -0.0181 -1.16 0.055 -0.0155 -1.09 -1.5916 -0.9994 1860862 IFLab1_005973 COc1ccc(cc1Br)C(=O)n2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P12 compound treatment 0.1 0.0249 1.6 0.085 0.0145 1.01 1.8474 0.9752 2068737 IFLab1_005974 COc1ccc2cc(sc(=O)c2c1OC)C(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P13 compound treatment 0.081 0.00591 0.38 0.067 -0.00355 -0.25 0.0935 0.2061 1146748 IFLab1_005975 COc1ccc(CC(=O)NCC2CCCO2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P14 compound treatment 0.08 0.00491 0.32 0.073 0.00245 0.17 0.3444 0.9587 2068738 IFLab1_005976 CC(=O)Nc1ccc(NC(=O)c2c(F)c(F)c(F)c(F)c2F)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P15 compound treatment 0.143 0.0679 4.37 0.129 0.0585 4.08 5.978 0.9994 2068739 IFLab1_005977 O=C(CCc1ccccc1)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P16 compound treatment 0.068 -0.00709 -0.46 0.066 -0.00455 -0.32 -0.5475 -0.9843 1689389 IFLab1_005978 O=C(Oc1ccc2oc3CCCCc3c2c1)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P17 compound treatment 0.052 -0.0231 -1.49 0.047 -0.0235 -1.65 -2.2143 -0.9987 2068740 IFLab1_005979 Cc1nn(C(=S)N)c(O)c1C(C(C#N)C#N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P18 compound treatment 0.067 -0.00809 -0.52 0.062 -0.00855 -0.6 -0.7906 -0.9977 2068741 IFLab1_005980 CCOC(=O)N1CCN(CC1)C(c2c(C)[nH]c3ccccc23)c4ccncc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P19 compound treatment 0.078 0.00291 0.19 0.072 0.00145 0.1 0.204 0.9586 2068742 IFLab1_005981 NC1=C(C#N)C(c2c(n[nH]c2O1)C(F)(F)F)c3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P20 compound treatment 0.143 0.0679 4.37 0.121 0.0505 3.52 5.5828 0.9943 1154230 IFLab1_005982 COc1cc(ccc1F)S(=O)(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P21 compound treatment 0.079 0.00391 0.25 0.062 -0.00855 -0.6 -0.2445 -0.3773 1569833 IFLab1_005983 O=c1oc2ccccc2cc1c3nnc([nH]3)c4ccncc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P22 compound treatment 0.068 -0.00709 -0.46 0.067 -0.00355 -0.25 -0.4981 -0.9588 2068743 IFLab1_005984 COc1cc(c(C)cc1C)S(=O)(=O)NC2CCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P23 mock treatment 0.088 0.0129 0.83 0.078 0.00745 0.52 0.9555 0.9747 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1428 P24 mock treatment 0.082 0.00691 0.44 0.085 0.0145 1.01 1.0282 0.9321 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A01 compound treatment 0.062 -0.00678 -0.44 0.063 -0.00516 -0.36 -0.5636 -0.9955 2068744 IFLab1_005985 COc1cc(C)c(C)cc1S(=O)(=O)NC2CCCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A02 compound treatment 0.118 0.0492 3.17 0.115 0.0468 3.27 4.5538 0.9999 1916829 IFLab1_005986 Cn1c(nc2ccccc12)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A03 compound treatment 0.065 -0.00378 -0.24 0.068 -1.61E-4 -0.01 -0.1801 -0.7391 2068745 IFLab1_005987 CN(C)CCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A04 compound treatment 0.058 -0.0108 -0.69 0.064 -0.00416 -0.29 -0.6962 -0.9254 2068746 IFLab1_005988 Cn1c(nc2ccccc12)C3CN(C(=O)C3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A05 compound treatment 0.068 -7.81E-4 -0.05 0.07 0.00184 0.13 0.0553 0.4007 2068747 IFLab1_005989 Cc1ccc(cc1)N(C2CS(=O)(=O)C=C2)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A06 compound treatment 0.117 0.0482 3.1 0.135 0.0668 4.67 5.4963 0.9803 2068748 IFLab1_005990 Cc1cc(C)c(cc1C)S(=O)(=O)N2CCSC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A07 compound treatment 0.058 -0.0108 -0.69 0.062 -0.00616 -0.43 -0.795 -0.9736 2068749 IFLab1_005991 CCC(=O)Nc1ccc(cc1)c2cn3cccc(C)c3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A08 compound treatment 0.532 0.463 29.82 0.53 0.462 32.26 43.8965 0.9992 1364444 IFLab1_005992 CCOC(=O)C1CCN(CC1)S(=O)(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A09 compound treatment 0.069 2.19E-4 0.01 0.069 8.39E-4 0.06 0.0514 0.8528 2068750 IFLab1_005993 NC(=O)CSc1nnc(c2cccs2)n1c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A10 compound treatment 0.066 -0.00278 -0.18 0.069 8.39E-4 0.06 -0.0852 -0.4521 2068751 IFLab1_005994 O=S(=O)(NC1CCCCC1n2cc(nn2)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A11 compound treatment 0.872 0.803 51.7 0.739 0.671 46.86 69.6951 0.9988 2068752 IFLab1_005995 CN(C)C(=O)c1cn(nc1c2cc3ccccc3o2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A12 compound treatment 0.091 0.0222 1.43 0.097 0.0288 2.01 2.4358 0.9859 2068753 IFLab1_005996 O=C(NCCC1=CCCCC1)/C=C/c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A13 compound treatment 0.19 0.121 7.8 0.204 0.136 9.49 12.2272 0.9953 2068754 IFLab1_005997 c1ccc(cc1)n2nnnc2c3ccc4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A14 compound treatment 0.065 -0.00378 -0.24 0.068 -1.61E-4 -0.01 -0.1801 -0.7391 1104608 IFLab1_005998 CCOC(=O)C1=C(OC(=C(C#N)C1c2ccccc2)N)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A15 compound treatment 0.08 0.0112 0.72 0.083 0.0148 1.04 1.2436 0.9844 2068755 IFLab1_005999 CCOc1ccc(cc1)n2nnnc2c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A16 compound treatment 0.067 -0.00178 -0.11 0.073 0.00484 0.34 0.158 0.4425 2068756 IFLab1_006000 CN(C)CCN1C(C(=C(O)C1=O)C(=O)c2cccs2)c3cccc(OCC=C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A17 compound treatment 0.06 -0.00878 -0.57 0.061 -0.00716 -0.5 -0.7534 -0.9981 2068757 IFLab1_006001 Cc1ccc2[nH]c(SCc3ccccc3)nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A18 compound treatment 0.064 -0.00478 -0.31 0.066 -0.00216 -0.15 -0.3244 -0.9463 2068758 IFLab1_006002 CCN(CC)CC1=C/C(=N/O)/c2cccnc2C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A19 compound treatment 0.068 -7.81E-4 -0.05 0.069 8.39E-4 0.06 0.0059 0.0761 2068759 IFLab1_006003 Cc1cccc(OCCn2cnc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A20 compound treatment 0.069 2.19E-4 0.01 0.068 -1.61E-4 -0.01 0.002 0.1103 2068760 IFLab1_006004 CN(C)C(CC(=O)Nc1cc(C)cc(C)c1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A21 compound treatment 0.062 -0.00678 -0.44 0.065 -0.00316 -0.22 -0.4648 -0.9502 2068761 IFLab1_006005 CC(C)N1C(=O)/C(=C/c2cccc(Cl)c2Cl)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A22 compound treatment 0.079 0.0102 0.66 0.077 0.00884 0.62 0.9017 0.9995 2068762 IFLab1_006006 COc1cc(/C=N/S(=O)(=O)c2ccccc2)cc(OC)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A23 mock treatment 0.066 -0.00278 -0.18 0.072 0.00384 0.27 0.063 0.1955 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 A24 mock treatment 0.071 0.00222 0.14 0.068 -1.61E-4 -0.01 0.093 0.6493 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B01 compound treatment 0.077 0.00822 0.53 0.079 0.0108 0.76 0.9095 0.9846 2068763 IFLab1_006007 Cc1sc2nc(Nc3ccc(cc3)S(=O)(=O)N)sc(=O)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B02 compound treatment 0.09 0.0212 1.37 0.08 0.0118 0.83 1.5505 0.9711 1541550 IFLab1_006008 CCCCc1ccc(NS(=O)(=O)c2cccs2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B03 compound treatment 0.056 -0.0128 -0.82 0.053 -0.0152 -1.06 -1.3307 -0.9922 2068764 IFLab1_006009 N(/C=N\c1nccs1)c2nccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B04 compound treatment 0.064 -0.00478 -0.31 0.064 -0.00416 -0.29 -0.4232 -0.9996 2068765 IFLab1_006010 CCOc1cc(/C=C\2/SC(=S)N(C2=O)c3ccc4OCOc4c3)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B05 compound treatment 0.061 -0.00778 -0.5 0.068 -1.61E-4 -0.01 -0.3621 -0.7228 2068766 IFLab1_006011 Cc1sc2nc(SCCC(=O)NC3CCCCC3)[nH]c(=O)c2c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B06 compound treatment 0.091 0.0222 1.43 0.078 0.00984 0.69 1.4973 0.9436 2068767 IFLab1_006012 COc1ccccc1/C=C/2\SC(=S)N(C2=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B07 compound treatment 0.098 0.0292 1.88 0.096 0.0278 1.94 2.705 0.9999 2068768 IFLab1_006013 Cc1ccc(cc1)c2cnnn2c3ccc(cc3)C(=O)COC(=O)c4ccccc4F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B08 compound treatment 0.653 0.584 37.6 0.498 0.43 30.03 47.8228 0.9938 2068769 IFLab1_006014 COc1ccc(Cn2c(=O)oc3ccc(C)cc23)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B09 compound treatment 0.061 -0.00778 -0.5 0.075 0.00684 0.48 -0.0163 -0.0236 1630178 IFLab1_006015 COC(=O)Cc1c(c2ccccc2)c3cc(C)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B10 compound treatment 0.057 -0.0118 -0.76 0.062 -0.00616 -0.43 -0.8406 -0.964 2068770 IFLab1_006016 Cc1ccc(NS(=O)(=O)C(F)(F)F)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B11 compound treatment 0.082 0.0132 0.85 0.076 0.00784 0.55 0.9888 0.9773 1633075 IFLab1_006017 Cc1ccc2[nH]c(=O)c(CNS(=O)(=O)c3ccccc3)c(c4ccccc4)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B12 compound treatment 0.051 -0.0178 -1.14 0.052 -0.0162 -1.13 -1.6076 -1.0 2068771 IFLab1_006018 CC1C/C(=C\c2cccnc2)/C(=O)\C(=C\c3cccnc3)\C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B13 compound treatment 0.055 -0.0138 -0.89 0.061 -0.00716 -0.5 -0.981 -0.9633 2068772 IFLab1_006019 COCCn1cnc2cc(C)c(C)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B14 compound treatment 0.053 -0.0158 -1.02 0.063 -0.00516 -0.36 -0.9732 -0.9029 1865121 IFLab1_006020 COc1ccc(OCC(O)CNC(C)C)c(c1)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B15 compound treatment 0.061 -0.00778 -0.5 0.065 -0.00316 -0.22 -0.5103 -0.9323 2068773 IFLab1_006021 CC(=O)NCCCc1nc2ccccc2n1Cc3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B16 compound treatment 0.482 0.413 26.6 0.427 0.359 25.07 36.5328 0.9996 2068774 IFLab1_006022 COc1ccc(CCNC(=O)c2csc3CCCCc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B17 compound treatment 0.065 -0.00378 -0.24 0.069 8.39E-4 0.06 -0.1307 -0.522 2068775 IFLab1_006023 CN(C)CCNc1nc2ccccc2n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B18 compound treatment 0.053 -0.0158 -1.02 0.061 -0.00716 -0.5 -1.072 -0.9468 2068776 IFLab1_006024 FC(F)(F)c1ccc(NC(=O)/C=C/c2ccco2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B19 compound treatment 0.074 0.00522 0.34 0.053 -0.0152 -1.06 -0.5114 -0.4603 2068777 IFLab1_006025 Cc1cccc(OCC(O)CN2CCCCCC2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B20 compound treatment 0.138 0.0692 4.46 0.111 0.0428 2.99 5.2665 0.9813 2068778 IFLab1_006026 OCCN1CCN(CC1)c2nc(c3ccccc3)c4cc(Br)ccc4n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B21 compound treatment 0.064 -0.00478 -0.31 0.065 -0.00316 -0.22 -0.3738 -0.9868 1479148 IFLab1_006027 C(N1CCOCC1)c2cn3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B22 compound treatment 0.13 0.0612 3.94 0.049 -0.0192 -1.34 1.8397 0.4421 2068779 IFLab1_006028 Oc1c(Br)cc(/C=[N+](\[O-])/c2ccccc2)cc1Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B23 mock treatment 0.072 0.00322 0.21 0.062 -0.00616 -0.43 -0.1579 -0.3305 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 B24 mock treatment 0.069 2.19E-4 0.01 0.063 -0.00516 -0.36 -0.245 -0.679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C01 compound treatment 0.062 -0.00678 -0.44 0.07 0.00184 0.13 -0.2178 -0.4787 2068780 IFLab1_006029 COc1cc(C)c(Cl)c(C)c1S(=O)(=O)N2CCN(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C02 compound treatment 0.06 -0.00878 -0.57 0.063 -0.00516 -0.36 -0.6546 -0.9764 2068781 IFLab1_006030 c1csc(c1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C03 compound treatment 0.066 -0.00278 -0.18 0.068 -1.61E-4 -0.01 -0.1346 -0.7501 2068782 IFLab1_006031 CN(CC(O)Cn1c2ccccc2c3ccccc13)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C04 compound treatment 0.054 -0.0148 -0.95 0.057 -0.0112 -0.78 -1.2241 -0.9951 2068783 IFLab1_006032 CC(C)n1c(nc2ccccc12)C3CN(C(=O)C3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C05 compound treatment 0.065 -0.00378 -0.24 0.065 -0.00316 -0.22 -0.3283 -0.9988 2068784 IFLab1_006033 CN(C)S(=O)(=O)Nc1ccc(N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C06 compound treatment 0.19 0.121 7.8 0.207 0.139 9.7 12.3754 0.9942 2068785 IFLab1_006034 CC1SCCN1S(=O)(=O)c2c(C)cc(C)cc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C07 compound treatment 0.059 -0.00978 -0.63 0.054 -0.0142 -0.99 -1.1447 -0.9762 2068786 IFLab1_006035 CC(C)CC(=O)Nc1ccc(cc1)c2cn3cccc(C)c3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C08 compound treatment 0.063 -0.00578 -0.37 0.069 8.39E-4 0.06 -0.2217 -0.5885 2068787 IFLab1_006036 Cc1ccc(s1)S(=O)(=O)NCc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C09 compound treatment 0.259 0.19 12.24 0.261 0.193 13.47 18.1833 0.9989 2068788 IFLab1_006037 COC(=O)CSc1nnc(c2cccs2)n1c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C10 compound treatment 0.077 0.00822 0.53 0.081 0.0128 0.9 1.0083 0.9683 1572783 IFLab1_006038 CC1(C)C(CCC1(C)C(=O)O)C(=O)N2CCc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C11 compound treatment 0.137 0.0682 4.39 0.11 0.0418 2.92 5.1716 0.9804 2068789 IFLab1_006039 COC(=O)CNC(=O)c1cn(nc1c2ccc(F)cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C12 compound treatment 0.089 0.0202 1.3 0.085 0.0168 1.18 1.752 0.9987 2068790 IFLab1_006040 Cc1sc(NC(=O)/C=C/c2ccco2)c(C(=O)N)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C13 compound treatment 0.304 0.235 15.14 0.236 0.168 11.73 18.9964 0.992 2068791 IFLab1_006041 c1ccc(cc1)n2nnnc2c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C14 compound treatment 0.062 -0.00678 -0.44 0.068 -1.61E-4 -0.01 -0.3166 -0.7251 2068792 IFLab1_006042 NC1=C(C#N)C(C2=C(CCCC2=O)O1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C15 compound treatment 0.067 -0.00178 -0.11 0.059 -0.00916 -0.64 -0.5336 -0.8207 2068793 IFLab1_006043 c1ccc(cc1)n2nnnc2c3nc4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C16 compound treatment 0.075 0.00622 0.4 0.077 0.00884 0.62 0.7197 0.978 2068794 IFLab1_006044 COc1cccc(c1)C(=O)C2=C(O)C(=O)N(CCN(C)C)C2c3ccc(cc3)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C17 compound treatment 0.064 -0.00478 -0.31 0.066 -0.00216 -0.15 -0.3244 -0.9463 2068795 IFLab1_006045 CC(O)c1nc2ccccc2n1C/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C18 compound treatment 0.08 0.0112 0.72 0.077 0.00884 0.62 0.9472 0.997 2068796 IFLab1_006046 O/N=C\1/C=C(CN2CCOCC2)C(=O)c3ncccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C19 compound treatment 0.064 -0.00478 -0.31 0.058 -0.0102 -0.71 -0.7196 -0.93 2068797 IFLab1_006047 COCCn1c(nc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C20 compound treatment 0.074 0.00522 0.34 0.075 0.00684 0.48 0.5753 0.9851 2068798 IFLab1_006048 CCN(CC)CC(O)Cn1c2CCCCc2c3cc(C)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C21 compound treatment 0.071 0.00222 0.14 0.069 8.39E-4 0.06 0.1424 0.9226 2068799 IFLab1_006049 CC(C)N1C(=O)/C(=C/c2ccc(Br)cc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C22 compound treatment 0.072 0.00322 0.21 0.069 8.39E-4 0.06 0.1879 0.8729 2068800 IFLab1_006050 COc1ccc(OC)c(NC(=O)CC2Sc3ccccc3NC2=O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C23 mock treatment 0.075 0.00622 0.4 0.067 -0.00116 -0.08 0.2257 0.5526 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 C24 mock treatment 0.065 -0.00378 -0.24 0.076 0.00784 0.55 0.2151 0.359 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D01 compound treatment 0.104 0.0352 2.27 0.108 0.0398 2.78 3.5709 0.9948 2068801 IFLab1_006051 Cc1cccc(c1)c2nc3scc(c4ccccc4)n3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D02 compound treatment 0.112 0.0432 2.78 0.118 0.0498 3.48 4.429 0.9938 2068802 IFLab1_006052 Clc1ccc(Cl)c(NS(=O)(=O)c2cccs2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D03 compound treatment 0.058 -0.0108 -0.69 0.059 -0.00916 -0.64 -0.9432 -0.9992 2068803 IFLab1_006053 CN1C(=O)/C(=C\c2ccc(o2)c3ccccc3)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D04 compound treatment 0.072 0.00322 0.21 0.071 0.00284 0.2 0.2867 0.9998 2068804 IFLab1_006054 COc1cc(/C=C\2/SC(=S)N(C2=O)c3ccc4ccccc4c3)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D05 compound treatment 0.062 -0.00678 -0.44 0.064 -0.00416 -0.29 -0.5142 -0.9805 1013635 IFLab1_006055 OC(=O)C1Cc2ccccc2CN1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D06 compound treatment 0.184 0.115 7.42 0.171 0.103 7.18 10.324 0.9999 2068805 IFLab1_006056 COc1ccccc1/C=C/2\SC(=O)N(C2=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D07 compound treatment 0.122 0.0532 3.43 0.094 0.0258 1.81 3.6985 0.9552 2068806 IFLab1_006057 CCN1C(=O)/C(=C\c2ccc(NC(=O)C(F)(F)F)cc2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D08 compound treatment 0.081 0.0122 0.79 0.075 0.00684 0.48 0.8939 0.9715 1870189 IFLab1_006058 CC(C)C(NC(=O)c1cc2ccccc2cc1O)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D09 compound treatment 0.066 -0.00278 -0.18 0.059 -0.00916 -0.64 -0.5791 -0.8714 1231001 IFLab1_006059 CCOC(=O)Cc1c(c2ccccc2)c3cc(C)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D10 compound treatment 0.055 -0.0138 -0.89 0.058 -0.0102 -0.71 -1.1292 -0.9939 2068807 IFLab1_006060 Cc1ccccc1OCCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D11 compound treatment 0.068 -7.81E-4 -0.05 0.074 0.00584 0.41 0.2529 0.6153 2068808 IFLab1_006061 Cc1ccc(cc1)N2C(=O)CC(Sc3ccccc3C(=O)N4CCOCC4)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D12 compound treatment 0.068 -7.81E-4 -0.05 0.06 -0.00816 -0.57 -0.4387 -0.7665 2068809 IFLab1_006062 Cc1ccnc2ccc(SC(F)(F)F)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D13 compound treatment 0.062 -0.00678 -0.44 0.06 -0.00816 -0.57 -0.7118 -0.9913 1033861 IFLab1_006063 COCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D14 compound treatment 0.062 -0.00678 -0.44 0.062 -0.00616 -0.43 -0.613 -1.0 2068810 IFLab1_006064 Cc1ccc(OCC(O)CN)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D15 compound treatment 0.064 -0.00478 -0.31 0.06 -0.00816 -0.57 -0.6208 -0.9581 2068811 IFLab1_006065 CC(=O)NCCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D16 compound treatment 0.08 0.0112 0.72 0.084 0.0158 1.11 1.293 0.9786 2068812 IFLab1_006066 COc1ccc(cc1)C2C3C(SC(=C2C#N)N)C(=O)N(C3=O)c4ccc(C)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D17 compound treatment 0.06 -0.00878 -0.57 0.068 -1.61E-4 -0.01 -0.4076 -0.7211 2068813 IFLab1_006067 CCN(CC)CCCNc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D18 compound treatment 0.073 0.00422 0.27 0.073 0.00484 0.34 0.431 0.9941 2068814 IFLab1_006068 O=C(NCCc1ccccc1)/C=C/c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D19 compound treatment 0.069 2.19E-4 0.01 0.066 -0.00216 -0.15 -0.0968 -0.6384 2068815 IFLab1_006069 Cc1cccc(OCC(O)CN2CCN(Cc3ccccc3)CC2)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D20 compound treatment 0.058 -0.0108 -0.69 0.065 -0.00316 -0.22 -0.6468 -0.8882 2068816 IFLab1_006070 COc1cc(N)n(n1)S(=O)(=O)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D21 compound treatment 1.053 0.984 63.35 1.015 0.947 66.15 91.5669 0.9998 2068817 IFLab1_006071 COC(=O)c1cccnc1c2nc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D22 compound treatment 0.059 -0.00978 -0.63 0.056 -0.0122 -0.85 -1.0459 -0.9891 2068818 IFLab1_006072 COc1cc(/C=[N+](\[O-])/c2ccccc2)cc(OC)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D23 mock treatment 0.063 -0.00578 -0.37 0.062 -0.00616 -0.43 -0.5675 -0.9974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 D24 mock treatment 0.065 -0.00378 -0.24 0.074 0.00584 0.41 0.1163 0.2449 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E01 compound treatment 0.101 0.0322 2.07 0.097 0.0288 2.01 2.891 0.9999 2068819 IFLab1_006073 COc1ccc(cc1C)S(=O)(=O)n2ccc(C)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E02 compound treatment 0.056 -0.0128 -0.82 0.054 -0.0142 -0.99 -1.2813 -0.9958 2068820 IFLab1_006074 CCCn1c(nc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E03 compound treatment 0.065 -0.00378 -0.24 0.063 -0.00516 -0.36 -0.4271 -0.9817 2068821 IFLab1_006075 CS(=O)(=O)NCC(O)Cn1c2ccccc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E04 compound treatment 0.055 -0.0138 -0.89 0.063 -0.00516 -0.36 -0.8822 -0.9213 1531370 IFLab1_006076 CC(C)CCOc1ccc(CN)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E05 compound treatment 0.069 2.19E-4 0.01 0.076 0.00784 0.55 0.3972 0.725 1012680 IFLab1_006077 O=S(=O)(N1CCCCC1)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E06 compound treatment 0.059 -0.00978 -0.63 0.056 -0.0122 -0.85 -1.0459 -0.9891 2068822 IFLab1_006078 Cc1ccn2cc(nc2c1)c3cccc(NS(=O)(=O)C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E07 compound treatment 0.667 0.598 38.5 0.561 0.493 34.43 51.5721 0.9984 1112848 IFLab1_006079 Oc1nc2ccccc2nc1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E08 compound treatment 0.061 -0.00778 -0.5 0.061 -0.00716 -0.5 -0.7079 -1.0 1141016 IFLab1_006080 O=S(=O)(NCCc1ccccn1)c2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E09 compound treatment 0.082 0.0132 0.85 0.078 0.00984 0.69 1.0876 0.9944 2068823 IFLab1_006081 COc1ccc(cc1OC)c2nnc(SCC(=O)c3ccccc3)n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E10 compound treatment 0.066 -0.00278 -0.18 0.066 -0.00216 -0.15 -0.2333 -0.9964 2068824 IFLab1_006082 COC(=O)C1=C(N)OC2=C(C1c3ccccc3)C(=O)CC(C)(C)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E11 compound treatment 0.155 0.0862 5.55 0.151 0.0828 5.79 8.0162 0.9998 2068825 IFLab1_006083 OC(=O)CNC(=O)c1cn(nc1c2ccc(Cl)s2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E12 compound treatment 0.104 0.0352 2.27 0.107 0.0388 2.71 3.5215 0.996 2068826 IFLab1_006084 COc1ccc(/C=C/C(=O)Nc2sc(C)c(C)c2C(=O)N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E13 compound treatment 0.159 0.0902 5.81 0.117 0.0488 3.41 6.5187 0.9679 2068827 IFLab1_006085 Cc1ccc(cc1)n2nnnc2c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E14 compound treatment 0.06 -0.00878 -0.57 0.062 -0.00616 -0.43 -0.704 -0.991 1259598 IFLab1_006086 CCCC1=C(C(C(=C(N)O1)C#N)c2ccccc2)C(=O)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E15 compound treatment 0.063 -0.00578 -0.37 0.06 -0.00816 -0.57 -0.6663 -0.9786 2068828 IFLab1_006087 Clc1cc(Cn2cnc3ccccc23)c4OCOCc4c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E16 compound treatment 0.069 2.19E-4 0.01 0.078 0.00984 0.69 0.496 0.7214 2068829 IFLab1_006088 COc1cccc(c1)C(=O)C2=C(O)C(=O)N(C2c3ccccc3)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E17 compound treatment 0.05 -0.0188 -1.21 0.048 -0.0202 -1.41 -1.8507 -0.9971 2068830 IFLab1_006089 Cn1c(CC(C)(C)C)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E18 compound treatment 0.077 0.00822 0.53 0.082 0.0138 0.97 1.0577 0.9597 2068831 IFLab1_006090 COC(=O)c1ccccc1c2ccc(/C=C/3\SC(=O)NC3=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E19 compound treatment 0.067 -0.00178 -0.11 0.059 -0.00916 -0.64 -0.5336 -0.8207 2068832 IFLab1_006091 COCc1nc2ccccc2n1Cc3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E20 compound treatment 0.074 0.00522 0.34 0.074 0.00584 0.41 0.5259 0.9953 2068833 IFLab1_006092 CCC(CO)NCC(O)Cn1c2CCCCc2c3cc(C)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E21 compound treatment 0.079 0.0102 0.66 0.069 8.39E-4 0.06 0.5065 0.7671 2068834 IFLab1_006093 COc1cc(/C=C/2\SC(=S)N(C(C)C)C2=O)ccc1OCC(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E22 compound treatment 0.095 0.0262 1.69 0.099 0.0308 2.15 2.7167 0.9927 2068835 IFLab1_006094 CCOc1cc(/C=N/S(=O)(=O)c2cccs2)cc(Br)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E23 mock treatment 0.064 -0.00478 -0.31 0.069 8.39E-4 0.06 -0.1762 -0.5624 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 E24 mock treatment 0.066 -0.00278 -0.18 0.07 0.00184 0.13 -0.0358 -0.1623 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F01 compound treatment 0.083 0.0142 0.92 0.085 0.0168 1.18 1.4789 0.9923 2068836 IFLab1_006095 CSc1nnc(COc2ccccc2)n1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F02 compound treatment 0.088 0.0192 1.24 0.088 0.0198 1.39 1.8547 0.9984 2068837 IFLab1_006096 CCOc1ccccc1N2C(=O)/C(=C\c3cccs3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F03 compound treatment 0.087 0.0182 1.17 0.094 0.0258 1.81 2.1056 0.9782 2068838 IFLab1_006097 CCN(CC)C(=O)/C=C/c1ccc(o1)c2cc(Cl)ccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F04 compound treatment 0.159 0.0902 5.81 0.196 0.128 8.93 10.4211 0.9783 2068839 IFLab1_006098 COc1cc(/C=C\2/SC(=O)N(C2=O)c3ccc(C)cc3)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F05 compound treatment 0.063 -0.00578 -0.37 0.066 -0.00216 -0.15 -0.3699 -0.9211 2068840 IFLab1_006099 COc1ccc(CCNCC2CCCO2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F06 compound treatment 0.058 -0.0108 -0.69 0.061 -0.00716 -0.5 -0.8444 -0.9871 2068841 IFLab1_006100 Clc1cc(Cl)cc(c1)N2C(=O)/C(=C/c3cccs3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F07 compound treatment 0.064 -0.00478 -0.31 0.06 -0.00816 -0.57 -0.6208 -0.9581 1703775 IFLab1_006101 Brc1ccc(cc1)c2cn3ccccc3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F08 compound treatment 0.054 -0.0148 -0.95 0.052 -0.0162 -1.13 -1.4711 -0.9964 1559763 IFLab1_006102 CCCN(CCC)C(=O)c1cc2ccccc2cc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F09 compound treatment 0.077 0.00822 0.53 0.081 0.0128 0.9 1.0083 0.9683 1785241 IFLab1_006103 Cc1ccc2[nH]c(=O)c(CC(=O)O)c(c3ccccc3)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F10 compound treatment 0.065 -0.00378 -0.24 0.06 -0.00816 -0.57 -0.5753 -0.9279 2068842 IFLab1_006104 COc1ccccc1OCCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F11 compound treatment 0.061 -0.00778 -0.5 0.065 -0.00316 -0.22 -0.5103 -0.9323 2068843 IFLab1_006105 Fc1ccc(CN2C(=O)S/C(=C\C(=O)Nc3nccs3)/C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F12 compound treatment 0.065 -0.00378 -0.24 0.065 -0.00316 -0.22 -0.3283 -0.9988 2068844 IFLab1_006106 Clc1ccccc1c2nnc(o2)c3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F13 compound treatment 0.068 -7.81E-4 -0.05 0.077 0.00884 0.62 0.4011 0.6474 2068845 IFLab1_006107 COCc1nc2ccccc2n1Cc3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F14 compound treatment 0.08 0.0112 0.72 0.075 0.00684 0.48 0.8484 0.9799 2068846 IFLab1_006108 Cc1ccc(CC2SC(=N)NC2=O)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F15 compound treatment 0.06 -0.00878 -0.57 0.068 -1.61E-4 -0.01 -0.4076 -0.7211 1705662 IFLab1_006109 C1CNC(C1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F16 compound treatment 0.077 0.00822 0.53 0.082 0.0138 0.97 1.0577 0.9597 2068847 IFLab1_006110 Cc1ccc(NC(=O)C2Cc3ccccc3C(=O)O2)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F17 compound treatment 0.075 0.00622 0.4 0.09 0.0218 1.53 1.3618 0.8634 2068848 IFLab1_006111 COc1ccc(OC)c(NS(=O)(=O)c2cccs2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F18 compound treatment 0.073 0.00422 0.27 0.073 0.00484 0.34 0.431 0.9941 2068849 IFLab1_006112 Oc1ccc(O)c(Sc2nnnn2c3ccccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F19 compound treatment 0.065 -0.00378 -0.24 0.06 -0.00816 -0.57 -0.5753 -0.9279 2068850 IFLab1_006113 CC(C)NCC(O)COc1cc(C)cc(C)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F20 compound treatment 0.072 0.00322 0.21 0.07 0.00184 0.13 0.2373 0.9736 2068851 IFLab1_006114 O=C1CN(c2ccccc2N1)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F21 compound treatment 0.053 -0.0158 -1.02 0.053 -0.0152 -1.06 -1.4672 -0.9998 1415204 IFLab1_006115 Brc1c(nc2ccccn12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F22 compound treatment 0.049 -0.0198 -1.27 0.054 -0.0142 -0.99 -1.5998 -0.9922 2068852 IFLab1_006116 CCc1cc(C(=O)OC)c(NC(=O)/C=C/C(=O)O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F23 mock treatment 0.065 -0.00378 -0.24 0.063 -0.00516 -0.36 -0.4271 -0.9817 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 F24 mock treatment 0.068 -7.81E-4 -0.05 0.069 8.39E-4 0.06 0.0059 0.0761 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G01 compound treatment 0.098 0.0292 1.88 0.091 0.0228 1.6 2.458 0.9967 2068853 IFLab1_006117 COc1cc(ccc1Cl)S(=O)(=O)n2ccc(C)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G02 compound treatment 0.053 -0.0158 -1.02 0.059 -0.00916 -0.64 -1.1708 -0.9752 2068854 IFLab1_006118 CC(C)Cn1c(nc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G03 compound treatment 0.055 -0.0138 -0.89 0.067 -0.00116 -0.08 -0.6846 -0.7686 1146217 IFLab1_006119 Clc1c(sc2cc(Cl)ccc12)C(=O)NCCN3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G04 compound treatment 0.066 -0.00278 -0.18 0.071 0.00284 0.2 0.0136 0.0511 2068855 IFLab1_006120 CCOC(=O)Cn1c2ccc(Cl)cc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G05 compound treatment 0.088 0.0192 1.24 0.097 0.0288 2.01 2.2993 0.9726 1013038 IFLab1_006121 Cc1ccccc1NS(=O)(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G06 compound treatment 0.053 -0.0158 -1.02 0.053 -0.0152 -1.06 -1.4672 -0.9998 2068856 IFLab1_006122 Clc1ccc(s1)S(=O)(=O)NN2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G07 compound treatment 0.074 0.00522 0.34 0.081 0.0128 0.9 0.8717 0.9102 2068857 IFLab1_006123 Fc1ccc(NC(=O)CN2C(=O)/C(=C\C=C\c3ccccc3)/SC2=S)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G08 compound treatment 0.064 -0.00478 -0.31 0.07 0.00184 0.13 -0.1268 -0.3802 2068858 IFLab1_006124 Cc1nc2ccccc2cc1C(=O)NCc3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G09 compound treatment 0.064 -0.00478 -0.31 0.067 -0.00116 -0.08 -0.275 -0.864 2068859 IFLab1_006125 Clc1ccc(cc1)c2csc3ncnn23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G10 compound treatment 0.064 -0.00478 -0.31 0.059 -0.00916 -0.64 -0.6702 -0.9437 2068860 IFLab1_006126 NC1=C(C#N)C(c2cccnc2)c3ccc(N)cc3O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G11 compound treatment 0.075 0.00622 0.4 0.08 0.0118 0.83 0.8678 0.9445 2068861 IFLab1_006127 COc1ccccc1N(C)S(=O)(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G12 compound treatment 0.062 -0.00678 -0.44 0.066 -0.00216 -0.15 -0.4154 -0.8994 2068862 IFLab1_006128 O=C(/C=C/c1ccccc1)N2CCNC(=O)C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G13 compound treatment 0.112 0.0432 2.78 0.102 0.0338 2.36 3.6386 0.9967 2068863 IFLab1_006129 CCOc1ccc(cc1)n2nnnc2c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G14 compound treatment 0.063 -0.00578 -0.37 0.063 -0.00516 -0.36 -0.5181 -0.9999 1650810 IFLab1_006130 COc1ccc(cc1)C2C(=C(N)OC(=C2C(=O)OCc3ccccc3)C)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G15 compound treatment 0.048 -0.0208 -1.34 0.052 -0.0162 -1.13 -1.7442 -0.9964 2068864 IFLab1_006131 ClC1(Cl)CC1Cn2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G16 compound treatment 0.071 0.00222 0.14 0.078 0.00984 0.69 0.587 0.8362 2068865 IFLab1_006132 CN(C)CCN1C(C(=C(O)C1=O)C(=O)c2cc3ccccc3o2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G17 compound treatment 0.066 -0.00278 -0.18 0.071 0.00284 0.2 0.0136 0.0511 1147748 IFLab1_006133 Cc1cccc(OCCn2c(CO)nc3ccccc23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G18 compound treatment 0.078 0.00922 0.59 0.06 -0.00816 -0.57 0.0164 0.02 1082165 IFLab1_006134 CC1(C)OC(=O)N(C1=C)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G19 compound treatment 0.054 -0.0148 -0.95 0.054 -0.0142 -0.99 -1.3723 -0.9998 2068866 IFLab1_006135 OCc1nc2ccccc2n1CC3CC3(Cl)Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G20 compound treatment 0.069 2.19E-4 0.01 0.07 0.00184 0.13 0.1008 0.7799 2068867 IFLab1_006136 CC1CCCCN1CC(O)Cn2c(C)c(C)c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G21 compound treatment 0.065 -0.00378 -0.24 0.077 0.00884 0.62 0.2645 0.3986 2068868 IFLab1_006137 CC(C)N1C(=O)/C(=C/c2ccc(cc2)N(C)C)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G22 compound treatment 0.071 0.00222 0.14 0.073 0.00484 0.34 0.34 0.9265 2068869 IFLab1_006138 CC(NC(=O)CC1Nc2cc(C)c(C)cc2NC1=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G23 mock treatment 0.057 -0.0118 -0.76 0.063 -0.00516 -0.36 -0.7912 -0.9422 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 G24 mock treatment 0.074 0.00522 0.34 0.071 0.00284 0.2 0.3777 0.9684 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H01 compound treatment 0.086 0.0172 1.11 0.07 0.00184 0.13 0.8745 0.7838 2068870 IFLab1_006139 CCn1c(COc2ccc(Cl)c3cccnc23)nnc1SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H02 compound treatment 0.059 -0.00978 -0.63 0.061 -0.00716 -0.5 -0.7989 -0.9935 2068871 IFLab1_006140 Cc1ccc(/N=C/2\NC(=O)\C(=C/c3cccs3)\S2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H03 compound treatment 0.718 0.649 41.79 0.677 0.609 42.53 59.6235 1.0 2068872 IFLab1_006141 Clc1ccc(Cl)c(c1)c2ccc(/C=C/C(=O)N3CCOCC3)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H04 compound treatment 0.055 -0.0138 -0.89 0.056 -0.0122 -0.85 -1.228 -0.9998 2068873 IFLab1_006142 CCC(N1C(=O)/C(=C\C(=C\c2ccccc2)\C)/SC1=S)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H05 compound treatment 0.058 -0.0108 -0.69 0.055 -0.0132 -0.92 -1.1408 -0.9904 1249854 IFLab1_006143 COc1ccc(CNCC2CCCO2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H06 compound treatment 0.061 -0.00778 -0.5 0.063 -0.00516 -0.36 -0.6091 -0.987 2068874 IFLab1_006144 Clc1ccc(cc1Cl)N2C(=O)/C(=C/c3cccs3)/SC2=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H07 compound treatment 0.056 -0.0128 -0.82 0.058 -0.0102 -0.71 -1.0837 -0.9973 2068875 IFLab1_006145 Cc1ccn2cc(nc2c1)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H08 compound treatment 0.082 0.0132 0.85 0.093 0.0248 1.74 1.8286 0.9462 2068876 IFLab1_006146 FC(F)(F)S(=O)(=O)Nc1ccc(Br)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H09 compound treatment 0.061 -0.00778 -0.5 0.062 -0.00616 -0.43 -0.6585 -0.9972 2068877 IFLab1_006147 Brc1ccc2[nH]c(=O)c(CN3CCCCC3)c(c4ccccc4)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H10 compound treatment 0.056 -0.0128 -0.82 0.055 -0.0132 -0.92 -1.2319 -0.9985 1066538 IFLab1_006148 Cc1ccc(OCCC(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H11 compound treatment 0.074 0.00522 0.34 0.08 0.0118 0.83 0.8223 0.9212 2068878 IFLab1_006149 COc1ccc2cc(sc(=O)c2c1OC)C(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H12 compound treatment 0.084 0.0152 0.98 0.075 0.00684 0.48 1.0305 0.9455 2068879 IFLab1_006150 Brc1cccc(c1)c2nnco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H13 compound treatment 0.067 -0.00178 -0.11 0.067 -0.00116 -0.08 -0.1384 -0.9857 2068880 IFLab1_006151 COCc1nc2ccccc2n1CC(=O)N(C(C)C)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H14 compound treatment 0.067 -0.00178 -0.11 0.074 0.00584 0.41 0.2074 0.4894 2068881 IFLab1_006152 CCOC(=O)c1ccc(CC2SC(=N)NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H15 compound treatment 0.07 0.00122 0.08 0.066 -0.00216 -0.15 -0.0513 -0.3015 1920651 IFLab1_006153 Cc1ccc(cc1)c2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H16 compound treatment 0.092 0.0232 1.49 0.089 0.0208 1.46 2.0862 0.9999 2068882 IFLab1_006154 COc1ccc(NC(=O)C2Cc3ccccc3C(=O)O2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H17 compound treatment 0.069 2.19E-4 0.01 0.068 -1.61E-4 -0.01 0.002 0.1103 2068883 IFLab1_006155 CN(Cc1ccccc1)S(=O)(=O)c2ccc(C)c(c2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H18 compound treatment 0.07 0.00122 0.08 0.075 0.00684 0.48 0.3933 0.8123 2068884 IFLab1_006156 C(=C/c1ccccc1)\c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H19 compound treatment 0.062 -0.00678 -0.44 0.075 0.00684 0.48 0.0292 0.0451 2068885 IFLab1_006157 CC1CC(CC(C)(C)C1)OCC(O)CN2CCN(CC2)c3cccc(c3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H20 compound treatment 0.063 -0.00578 -0.37 0.072 0.00384 0.27 -0.0735 -0.1602 2068886 IFLab1_006158 CCCNS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H21 compound treatment 0.066 -0.00278 -0.18 0.062 -0.00616 -0.43 -0.4309 -0.9244 2068887 IFLab1_006159 Cc1cccc2nc(CSc3nncn3c4ccccc4)cn12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H22 compound treatment 0.065 -0.00378 -0.24 0.062 -0.00616 -0.43 -0.4765 -0.9636 2068888 IFLab1_006160 O=C1CC(Nc2ccc(cc2)N3CCOCC3)C(=O)N1C4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H23 mock treatment 0.075 0.00622 0.4 0.062 -0.00616 -0.43 -0.0213 -0.0363 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 H24 mock treatment 0.065 -0.00378 -0.24 0.067 -0.00116 -0.08 -0.2295 -0.8944 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I01 compound treatment 0.128 0.0592 3.81 0.11 0.0418 2.92 4.762 0.9914 2068889 IFLab1_006161 CCOc1ccc(cc1)S(=O)(=O)n2ccc(C)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I02 compound treatment 0.06 -0.00878 -0.57 0.054 -0.0142 -0.99 -1.0992 -0.9647 2068890 IFLab1_006162 CCn1c(nc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I03 compound treatment 0.065 -0.00378 -0.24 0.075 0.00684 0.48 0.1657 0.3091 2068891 IFLab1_006163 CCOC(=O)c1ccc2nc(nc(Cl)c2c1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I04 compound treatment 0.635 0.566 36.44 0.581 0.513 35.83 51.1036 1.0 2068892 IFLab1_006164 COc1ccc(Cn2c(=O)oc3ccccc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I05 compound treatment 0.078 0.00922 0.59 0.082 0.0138 0.97 1.1032 0.9725 1013041 IFLab1_006165 COc1ccc(NS(=O)(=O)N2CCCCC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I06 compound treatment 0.11 0.0412 2.65 0.097 0.0288 2.01 3.3006 0.9908 2068893 IFLab1_006166 CN(c1ccccc1)S(=O)(=O)c2ccc(C)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I07 compound treatment 0.08 0.0112 0.72 0.082 0.0138 0.97 1.1942 0.9897 2068894 IFLab1_006167 C/C(=C\c1ccccc1)/C=C\2/SC(=S)N(CCC(=O)Nc3nc(C)cs3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I08 compound treatment 0.067 -0.00178 -0.11 0.062 -0.00616 -0.43 -0.3854 -0.8653 2068895 IFLab1_006168 Cc1nc2ccccc2cc1C(=O)NCc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I09 compound treatment 0.341 0.272 17.52 0.275 0.207 14.45 22.607 0.9954 2068896 IFLab1_006169 c1sc2nc(nn2c1c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I10 compound treatment 0.07 0.00122 0.08 0.066 -0.00216 -0.15 -0.0513 -0.3015 2068897 IFLab1_006170 CCOC(=O)C1=C(C)OC(=C(C#N)C1c2cccnc2)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I11 compound treatment 0.073 0.00422 0.27 0.082 0.0138 0.97 0.8756 0.872 2068898 IFLab1_006171 COc1ccccc1N(C(=O)C)S(=O)(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I12 compound treatment 0.089 0.0202 1.3 0.084 0.0158 1.11 1.7026 0.9967 1537771 IFLab1_006172 COC(=O)c1c(NC(=O)COc2ccc(OC)cc2)sc3CCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I13 compound treatment 0.232 0.163 10.51 0.238 0.17 11.86 15.8183 0.9982 2068899 IFLab1_006173 COc1ccc(cc1)n2nnnc2c3ccc4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I14 compound treatment 0.048 -0.0208 -1.34 0.051 -0.0172 -1.2 -1.7936 -0.9985 2068900 IFLab1_006174 COC(=O)C1=C(C)OC(=C(C#N)C1c2ccc(Cl)cc2)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I15 compound treatment 0.052 -0.0168 -1.08 0.053 -0.0152 -1.06 -1.5127 -1.0 2068901 IFLab1_006175 Cc1nc2ccccc2n1CC3CC3(Cl)Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I16 compound treatment 0.061 -0.00778 -0.5 0.078 0.00984 0.69 0.1319 0.1551 2068902 IFLab1_006176 CN(C)CCN1C(C(=C(O)C1=O)C(=O)c2ccc(F)cc2)c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I17 compound treatment 0.053 -0.0158 -1.02 0.054 -0.0142 -0.99 -1.4178 -0.9999 2068903 IFLab1_006177 Cc1cc2ncn(Cc3ccccc3F)c2cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I18 compound treatment 0.059 -0.00978 -0.63 0.069 8.39E-4 0.06 -0.4037 -0.6385 2068904 IFLab1_006178 CC(C)NC(CC(=O)Nc1cccc(C)c1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I19 compound treatment 0.059 -0.00978 -0.63 0.068 -1.61E-4 -0.01 -0.4531 -0.7196 2068905 IFLab1_006179 CCC(C)Cn1c(nc2ccccc12)C(C)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I20 compound treatment 0.07 0.00122 0.08 0.073 0.00484 0.34 0.2945 0.8486 2068906 IFLab1_006180 Cc1c(C)c2cc(C)ccc2n1CC(O)CN3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I21 compound treatment 0.07 0.00122 0.08 0.072 0.00384 0.27 0.2451 0.8772 2068907 IFLab1_006181 CC(C)N1C(=O)/C(=C\2/C(=O)Nc3ccccc23)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I22 compound treatment 0.043 -0.0258 -1.66 0.046 -0.0222 -1.55 -2.2681 -0.9994 2068908 IFLab1_006182 COC(=O)c1ccc(/C=[N+](\[O-])/c2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I23 mock treatment 0.067 -0.00178 -0.11 0.273 0.205 14.31 10.0376 0.7014 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 I24 mock treatment 0.073 0.00422 0.27 0.074 0.00584 0.41 0.4804 0.9805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J01 compound treatment 0.072 0.00322 0.21 0.075 0.00684 0.48 0.4843 0.9301 2068909 IFLab1_006183 Cc1ccc2cccc(c2n1)S(=O)(=O)N3CCCc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J02 compound treatment 0.322 0.253 16.3 0.265 0.197 13.75 21.2482 0.9964 2068910 IFLab1_006184 COc1cc(/C=C\2/S/C(=N/c3cccc(Cl)c3Cl)/NC2=O)cc(OC)c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J03 compound treatment 0.062 -0.00678 -0.44 0.067 -0.00116 -0.08 -0.366 -0.8244 1155277 IFLab1_006185 NC(=O)CCn1c(=O)oc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J04 compound treatment 0.087 0.0182 1.17 0.084 0.0158 1.11 1.6116 0.9996 2068911 IFLab1_006186 CCOc1cc(/C=C\2/SC(=S)N(C(C(=O)O)c3ccccc3)C2=O)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J05 compound treatment 0.059 -0.00978 -0.63 0.057 -0.0112 -0.78 -0.9965 -0.9944 2068912 IFLab1_006187 CCC(=O)Nc1ccc(cc1)S(=O)(=O)NC(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J06 compound treatment 0.176 0.107 6.9 0.167 0.0988 6.9 9.7623 1.0 2068913 IFLab1_006188 Oc1ccccc1/C=N/c2c(c3ccccc3)c4cc(Br)ccc4[nH]c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J07 compound treatment 0.116 0.0472 3.04 0.154 0.0858 6.0 6.3894 0.9504 2068914 IFLab1_006189 COC(=O)CNC(c1ccccc1)c2cc(Cl)ccc2NC(=O)c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J08 compound treatment 0.084 0.0152 0.98 0.089 0.0208 1.46 1.722 0.9814 1428158 IFLab1_006190 CN(C)c1ccc(NC(=O)c2cc(nc3ccccc23)c4ccccc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J09 compound treatment 0.084 0.0152 0.98 0.075 0.00684 0.48 1.0305 0.9455 1785243 IFLab1_006191 Brc1ccc2[nH]c(=O)c(CN3CCOCC3)c(c4ccccc4)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J10 compound treatment 0.069 2.19E-4 0.01 0.068 -1.61E-4 -0.01 0.002 0.1103 1072842 IFLab1_006192 COc1ccc(OCCC(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J11 compound treatment 0.07 0.00122 0.08 0.077 0.00884 0.62 0.4921 0.7906 2068915 IFLab1_006193 O=C(N1CCOCC1)c2cc3ccccc3c(=O)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J12 compound treatment 0.074 0.00522 0.34 0.064 -0.00416 -0.29 0.032 0.0719 2068916 IFLab1_006194 Cc1ccc(cc1)c2nnco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J13 compound treatment 0.08 0.0112 0.72 0.078 0.00984 0.69 0.9966 0.9997 2068917 IFLab1_006195 CCc1cccc(C)c1N(C(C)COC)C(=O)Cn2c(COC)nc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J14 compound treatment 0.068 -7.81E-4 -0.05 0.083 0.0148 1.04 0.6975 0.672 1877847 IFLab1_006196 OC(=O)c1ccc(CC2SC(=O)NC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J15 compound treatment 0.063 -0.00578 -0.37 0.059 -0.00916 -0.64 -0.7157 -0.9667 2068918 IFLab1_006197 CCn1c(nc2ccccc12)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J16 compound treatment 0.206 0.137 8.83 0.176 0.108 7.53 11.5723 0.9969 1594185 IFLab1_006198 Clc1ccc(Cl)c(c1)c2ccc(o2)C(=O)Nc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J17 compound treatment 0.074 0.00522 0.34 0.072 0.00384 0.27 0.4271 0.9938 2068919 IFLab1_006199 CN(Cc1ccccc1)S(=O)(=O)c2ccc3[nH]c(=O)oc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J18 compound treatment 0.075 0.00622 0.4 0.075 0.00684 0.48 0.6209 0.9961 2068920 IFLab1_006200 Cc1ccccc1N/2C(=O)C(Cc3ccccc3)S\C2=C(\C#N)/C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J19 compound treatment 0.127 0.0582 3.75 0.117 0.0488 3.41 5.0623 0.9989 2068921 IFLab1_006201 CC1(C)C(OCC(O)CN2CCN(CC2)c3cccc(c3)C(F)(F)F)C4(C)CCC1C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J20 compound treatment 0.088 0.0192 1.24 0.087 0.0188 1.32 1.8053 0.9995 2068922 IFLab1_006202 CCCNS(=O)(=O)c1ccc(NC(=O)c2ccccn2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J21 compound treatment 0.189 0.12 7.74 0.201 0.133 9.28 12.0335 0.9959 2068923 IFLab1_006203 Cc1cc(C)nc(SCc2csc(n2)c3ccccc3)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J22 compound treatment 0.087 0.0182 1.17 0.081 0.0128 0.9 1.4634 0.9912 2068924 IFLab1_006204 Cc1ccc(N2C(=O)CC(Nc3ccc(cc3)N4CCOCC4)C2=O)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J23 mock treatment 0.075 0.00622 0.4 0.061 -0.00716 -0.5 -0.0707 -0.1104 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 J24 mock treatment 0.066 -0.00278 -0.18 0.081 0.0128 0.9 0.5076 0.555 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K01 compound treatment 0.071 0.00222 0.14 0.061 -0.00716 -0.5 -0.2528 -0.4859 1150198 IFLab1_006205 O=C(Nc1nccs1)c2cccc3C(=O)c4ccccc4-c32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K02 compound treatment 0.055 -0.0138 -0.89 0.055 -0.0132 -0.92 -1.2774 -0.9998 2068925 IFLab1_006206 CC(C)n1c(nc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K03 compound treatment 0.064 -0.00478 -0.31 0.065 -0.00316 -0.22 -0.3738 -0.9868 2068926 IFLab1_006207 O=C(/N=C/1\SC2CS(=O)(=O)CC2N1c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K04 compound treatment 0.314 0.245 15.78 0.429 0.361 25.21 28.9855 0.9746 2068927 IFLab1_006208 O=c1oc2ccccc2n1CCOc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K05 compound treatment 0.07 0.00122 0.08 0.069 8.39E-4 0.06 0.0969 0.9897 2068928 IFLab1_006209 CNc1nnc(CSc2nc(C)cc(C)n2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K06 compound treatment 0.073 0.00422 0.27 0.075 0.00684 0.48 0.5298 0.9642 2068929 IFLab1_006210 Cc1ccc(s1)S(=O)(=O)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K07 compound treatment 0.707 0.638 41.08 0.507 0.439 30.66 50.7251 0.9896 2068930 IFLab1_006211 COc1ccc(cc1OC)C(=O)n2c(SC)nc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K08 compound treatment 0.069 2.19E-4 0.01 0.073 0.00484 0.34 0.249 0.7359 2068931 IFLab1_006212 Cc1nc2ccccc2cc1C(=O)NCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K09 compound treatment 0.476 0.407 26.21 0.412 0.344 24.02 35.5188 0.9991 2068932 IFLab1_006213 COc1ccc(cc1)c2nc3scc(c4ccccc4)n3n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K10 compound treatment 0.098 0.0292 1.88 0.086 0.0178 1.25 2.211 0.98 2068933 IFLab1_006214 O=C(Nc1ccc(cc1)S(=O)(=O)Nc2nccs2)/C=C/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K11 compound treatment 0.108 0.0392 2.52 0.096 0.0278 1.94 3.1601 0.9917 2068934 IFLab1_006215 CC1CCCCN1S(=O)(=O)c2cc(Cl)ccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K12 compound treatment 0.189 0.12 7.74 0.199 0.131 9.14 11.9347 0.9966 2068935 IFLab1_006216 O=C(NCCC1=CCCCC1)/C=C/c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K13 compound treatment 0.911 0.842 54.21 0.864 0.796 55.6 77.6449 0.9999 2068936 IFLab1_006217 Cc1cccc(c1)n2nnnc2c3ccc4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K14 compound treatment 0.055 -0.0138 -0.89 0.055 -0.0132 -0.92 -1.2774 -0.9998 1289756 IFLab1_006218 COC(=O)C1=C(C)OC(=C(C#N)C1c2ccccc2C)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K15 compound treatment 0.058 -0.0108 -0.69 0.062 -0.00616 -0.43 -0.795 -0.9736 2068937 IFLab1_006219 CCCn1c(nc2ccccc12)C3CN(C(=O)C3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K16 compound treatment 0.081 0.0122 0.79 0.087 0.0188 1.32 1.4867 0.9697 2068938 IFLab1_006220 Cc1ccc(cc1)c2nc(N)s[n+]2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K17 compound treatment 0.063 -0.00578 -0.37 0.063 -0.00516 -0.36 -0.5181 -0.9999 2068939 IFLab1_006221 Cc1cc2ncn(C(=O)c3ccccc3C(=O)O)c2cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K18 compound treatment 0.062 -0.00678 -0.44 0.064 -0.00416 -0.29 -0.5142 -0.9805 2068940 IFLab1_006222 CC(C)NC(CC(=O)Nc1ccccc1Cl)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K19 compound treatment 0.083 0.0142 0.92 0.089 0.0208 1.46 1.6765 0.975 2068941 IFLab1_006223 CCN1C(=O)/C(=C\c2ccc(OCC(=O)N)c(OC)c2)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K20 compound treatment 0.1 0.0312 2.01 0.094 0.0258 1.81 2.6972 0.9986 2068942 IFLab1_006224 Cc1c(C)c2cc(C)ccc2n1CC(O)Cn3nnc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K21 compound treatment 0.058 -0.0108 -0.69 0.058 -0.0102 -0.71 -0.9926 -0.9999 2068943 IFLab1_006225 COc1cc(/C=C\2/SC(=S)N(Cc3ccccc3)C2=O)ccc1OCC(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K22 compound treatment 0.067 -0.00178 -0.11 0.076 0.00784 0.55 0.3061 0.5472 2068944 IFLab1_006226 CCOC(=O)CSc1nc2ccccc2c(=O)[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K23 mock treatment 0.068 -7.81E-4 -0.05 0.063 -0.00516 -0.36 -0.2905 -0.798 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 K24 mock treatment 0.078 0.00922 0.59 0.073 0.00484 0.34 0.6586 0.9644 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L01 compound treatment 0.068 -7.81E-4 -0.05 0.069 8.39E-4 0.06 0.0059 0.0761 2068945 IFLab1_006227 CSc1nnc(COc2cccc3ccc(C)nc23)n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L02 compound treatment 0.677 0.608 39.15 0.545 0.477 33.31 51.2368 0.9968 2068946 IFLab1_006228 Clc1cccc(NC2=NC(=O)/C(=C\c3cccs3)/S2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L03 compound treatment 0.06 -0.00878 -0.57 0.059 -0.00916 -0.64 -0.8522 -0.9981 2068947 IFLab1_006229 Cc1ccc2oc(=O)n(c2c1)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L04 compound treatment 0.124 0.0552 3.55 0.108 0.0398 2.78 4.4811 0.9927 2068948 IFLab1_006230 COc1cc(/C=C\2/S/C(=N/c3ccccc3C(F)(F)F)/NC2=O)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L05 compound treatment 0.066 -0.00278 -0.18 0.068 -1.61E-4 -0.01 -0.1346 -0.7501 2068949 IFLab1_006231 Cc1ccccc1OCC(=O)Nc2ccc(cc2)S(=O)(=O)NC(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L06 compound treatment 0.558 0.489 31.49 0.463 0.395 27.58 41.7701 0.9978 2068950 IFLab1_006232 OC(=O)Cn1c2ccc(Cl)cc2c3nc4ccccc4nc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L07 compound treatment 0.072 0.00322 0.21 0.076 0.00784 0.55 0.5337 0.9116 1142586 IFLab1_006233 COC(=O)Cc1c(c2ccccc2)c3cc(Br)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L08 compound treatment 0.076 0.00722 0.46 0.067 -0.00116 -0.08 0.2712 0.5749 1550348 IFLab1_006234 CCN1CCN(CC1)C(=O)c2cc(nc3ccccc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L09 compound treatment 0.058 -0.0108 -0.69 0.064 -0.00416 -0.29 -0.6962 -0.9254 1785242 IFLab1_006235 Cc1ccc2[nH]c(=O)c(CN3CCCCC3)c(c4ccccc4)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L10 compound treatment 0.054 -0.0148 -0.95 0.059 -0.00916 -0.64 -1.1253 -0.9814 2068951 IFLab1_006236 Cc1cccc(OCCC(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L11 compound treatment 0.053 -0.0158 -1.02 0.053 -0.0152 -1.06 -1.4672 -0.9998 2068952 IFLab1_006237 CC(=C)Cn1c(nc2ccccc12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L12 compound treatment 0.076 0.00722 0.46 0.064 -0.00416 -0.29 0.123 0.2244 1052523 IFLab1_006238 Oc1ccccc1c2nnco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L13 compound treatment 0.055 -0.0138 -0.89 0.056 -0.0122 -0.85 -1.228 -0.9998 2068953 IFLab1_006239 CCn1c(nc2ccccc12)c3cccc(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L14 compound treatment 0.106 0.0372 2.4 0.096 0.0278 1.94 3.0691 0.9947 2068954 IFLab1_006240 Cc1ccc(cc1C)C2=CC(=O)C=CC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L15 compound treatment 0.07 0.00122 0.08 0.072 0.00384 0.27 0.2451 0.8772 1871622 IFLab1_006241 COc1ccccc1Nc2nc3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L16 compound treatment 0.063 -0.00578 -0.37 0.07 0.00184 0.13 -0.1723 -0.4377 2068955 IFLab1_006242 NS(=O)(=O)c1ccc(NC(=O)c2ccc(o2)c3ccccc3Cl)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L17 compound treatment 0.1 0.0312 2.01 0.091 0.0228 1.6 2.5491 0.9935 2068956 IFLab1_006243 O=C1Nc2ccc(c3cccc1c23)S(=O)(=O)NCc4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L18 compound treatment 0.066 -0.00278 -0.18 0.074 0.00584 0.41 0.1618 0.3633 2068957 IFLab1_006244 CC1S/C(=C(/C#N)\C(=O)N)/N(C1=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L19 compound treatment 0.213 0.144 9.28 0.211 0.143 9.98 13.6198 0.9993 2068958 IFLab1_006245 CC1CC(CC(C)(C)C1)OCC(O)CN2CCN(Cc3ccc(Cl)cc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L20 compound treatment 0.064 -0.00478 -0.31 0.063 -0.00516 -0.36 -0.4726 -0.9969 2068959 IFLab1_006246 CC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L21 compound treatment 0.056 -0.0128 -0.82 0.057 -0.0112 -0.78 -1.1331 -0.9996 2068960 IFLab1_006247 Brc1ccc(cc1)C(=O)CS[n+]2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L22 compound treatment 0.066 -0.00278 -0.18 0.06 -0.00816 -0.57 -0.5297 -0.8865 2068961 IFLab1_006248 O=C(CC1Nc2ccccc2NC1=O)NC3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L23 mock treatment 0.077 0.00822 0.53 0.057 -0.0112 -0.78 -0.1773 -0.1882 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 L24 mock treatment 0.064 -0.00478 -0.31 0.075 0.00684 0.48 0.1202 0.2115 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M01 compound treatment 0.065 -0.00378 -0.24 0.068 -1.61E-4 -0.01 -0.1801 -0.7391 2068962 IFLab1_006249 Cc1nc2ccccc2n1CC(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M02 compound treatment 0.188 0.119 7.67 0.189 0.121 8.44 11.3952 0.9989 2068963 IFLab1_006250 Fc1ccc(Cn2c(nc3ccccc23)c4ccco4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M03 compound treatment 0.061 -0.00778 -0.5 0.058 -0.0102 -0.71 -0.8561 -0.9854 1670110 IFLab1_006251 CC(=O)N(C1CS(=O)(=O)C=C1)c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M04 compound treatment 0.071 0.00222 0.14 0.057 -0.0112 -0.78 -0.4504 -0.5681 2068964 IFLab1_006252 CC(C)N(C(=O)Cn1c(=O)oc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M05 compound treatment 0.101 0.0322 2.07 0.092 0.0238 1.67 2.644 0.9941 2068965 IFLab1_006253 COc1ccc(NC(=O)CCCSc2nc3sc(C)c(C)c3c(=O)[nH]2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M06 compound treatment 0.119 0.0502 3.23 0.107 0.0388 2.71 4.2042 0.9962 2068966 IFLab1_006254 Cc1ccc(s1)S(=O)(=O)N2CCCC(C2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M07 compound treatment 0.269 0.2 12.89 0.177 0.109 7.6 14.489 0.9683 2068967 IFLab1_006255 CSc1nc2ccccc2n1C(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M08 compound treatment 0.068 -7.81E-4 -0.05 0.062 -0.00616 -0.43 -0.3399 -0.7844 2068968 IFLab1_006256 Cc1nc2ccccc2cc1C(=O)Nc3cccc(F)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M09 compound treatment 0.084 0.0152 0.98 0.076 0.00784 0.55 1.0799 0.9623 2068969 IFLab1_006257 CN(C)C(=O)c1cn(nc1c2cc3ccccc3oc2=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M10 compound treatment 0.055 -0.0138 -0.89 0.05 -0.0182 -1.27 -1.5244 -0.9847 2068970 IFLab1_006258 C[n+]1noc(NC(=O)C(F)(F)F)c1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M11 compound treatment 0.06 -0.00878 -0.57 0.062 -0.00616 -0.43 -0.704 -0.991 2068971 IFLab1_006259 Brc1ccc(NP2(=O)CC=CC2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M12 compound treatment 0.117 0.0482 3.1 0.111 0.0428 2.99 4.3107 0.9998 2068972 IFLab1_006260 Cc1cc(C)n(n1)C(=O)COc2cc(C)cc(C)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M13 compound treatment 0.171 0.102 6.58 0.155 0.0868 6.07 8.942 0.9992 2068973 IFLab1_006261 COc1ccccc1n2nnnc2c3ccc4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M14 compound treatment 0.089 0.0202 1.3 0.052 -0.0162 -1.13 0.1219 0.0707 1312516 IFLab1_006262 CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M15 compound treatment 0.076 0.00722 0.46 0.068 -1.61E-4 -0.01 0.3206 0.6898 2068974 IFLab1_006263 CCC(=O)NCCc1nc2ccccc2n1Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M16 compound treatment 0.158 0.0892 5.74 0.117 0.0488 3.41 6.4732 0.9691 2068975 IFLab1_006264 Cc1ccc(cc1)c2nc(Nc3ccccc3)n[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M17 compound treatment 0.082 0.0132 0.85 0.069 8.39E-4 0.06 0.6431 0.754 1142502 IFLab1_006265 Cc1ccccc1OCCn2cnc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M18 compound treatment 0.069 2.19E-4 0.01 0.063 -0.00516 -0.36 -0.245 -0.679 2068976 IFLab1_006266 COc1ccc(NC(=O)CC(NC(C)c2ccccc2)C(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M19 compound treatment 0.062 -0.00678 -0.44 0.062 -0.00616 -0.43 -0.613 -1.0 2068977 IFLab1_006267 CCN(CC)c1ccc(/C=C\2/SC(=S)N(CC)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M20 compound treatment 0.08 0.0112 0.72 0.087 0.0188 1.32 1.4412 0.9601 2068978 IFLab1_006268 Cc1cc(C)n(CC(O)Cn2c(C)c(C)c3cc(C)ccc23)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M21 compound treatment 0.065 -0.00378 -0.24 0.065 -0.00316 -0.22 -0.3283 -0.9988 2068979 IFLab1_006269 O=S(=O)(/N=C(\Nc1ccccn1)/c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M22 compound treatment 0.067 -0.00178 -0.11 0.077 0.00884 0.62 0.3555 0.5661 2068980 IFLab1_006270 OCCNC(=O)CSc1nc2ccccc2c(=O)[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M23 mock treatment 0.069 2.19E-4 0.01 0.081 0.0128 0.9 0.6442 0.7181 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 M24 mock treatment 0.068 -7.81E-4 -0.05 0.065 -0.00316 -0.22 -0.1917 -0.8464 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N01 compound treatment 0.714 0.645 41.53 0.775 0.707 49.38 64.2825 0.9963 1398650 IFLab1_006271 Cc1cc(Nc2ccccc2)n(n1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N02 compound treatment 0.104 0.0352 2.27 0.094 0.0258 1.81 2.8793 0.9936 2068981 IFLab1_006272 Brc1ccccc1NC2=NC(=O)/C(=C\c3cccs3)/S2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N03 compound treatment 0.069 2.19E-4 0.01 0.057 -0.0112 -0.78 -0.5414 -0.6942 2068982 IFLab1_006273 NC(=O)CCn1c(=O)sc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N04 compound treatment 0.43 0.361 23.25 0.337 0.269 18.78 29.7203 0.9944 2068983 IFLab1_006274 CCOc1cc(/C=C\2/S/C(=N/c3ccccc3C(F)(F)F)/NC2=O)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N05 compound treatment 0.062 -0.00678 -0.44 0.067 -0.00116 -0.08 -0.366 -0.8244 1753888 IFLab1_006275 CN1CCN(CC1)S(=O)(=O)c2ccc(N)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N06 compound treatment 0.341 0.272 17.52 0.297 0.229 15.99 23.6937 0.999 2068984 IFLab1_006276 Cc1ccc2oc(=O)n(CCOc3ccccc3)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N07 compound treatment 0.064 -0.00478 -0.31 0.056 -0.0122 -0.85 -0.8184 -0.9057 1580625 IFLab1_006277 CCOC(=O)Cc1c(c2ccccc2)c3cc(Br)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N08 compound treatment 0.055 -0.0138 -0.89 0.052 -0.0162 -1.13 -1.4256 -0.9929 2068985 IFLab1_006278 O=C/1/C(=C/c2cccnc2)/CCCC\C1=C/c3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N09 compound treatment 0.081 0.0122 0.79 0.081 0.0128 0.9 1.1903 0.9979 1219786 IFLab1_006279 Clc1ccc2[nH]c(=O)c(NS(=O)(=O)c3ccccc3)c(c4ccccc4)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N10 compound treatment 0.065 -0.00378 -0.24 0.057 -0.0112 -0.78 -0.7234 -0.8857 1321283 IFLab1_006280 OC(=O)Cn1c(Cc2ccccc2)nc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N11 compound treatment 0.064 -0.00478 -0.31 0.055 -0.0132 -0.92 -0.8678 -0.895 2068986 IFLab1_006281 CC(O)c1nc2ccccc2n1Cc3ccccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N12 compound treatment 0.054 -0.0148 -0.95 0.054 -0.0142 -0.99 -1.3723 -0.9998 2068987 IFLab1_006282 C(Sc1nnc(o1)c2ccccc2)c3cn4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N13 compound treatment 0.069 2.19E-4 0.01 0.067 -0.00116 -0.08 -0.0474 -0.5758 2068988 IFLab1_006283 CCC(=O)NCc1nc2ccccc2n1Cc3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N14 compound treatment 0.954 0.885 56.98 0.904 0.836 58.39 81.5779 0.9999 2068989 IFLab1_006284 Cc1ccc(cc1C)c2cc(O)cc3sc(=O)oc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N15 compound treatment 0.064 -0.00478 -0.31 0.064 -0.00416 -0.29 -0.4232 -0.9996 2068990 IFLab1_006285 COc1ccccc1Nc2nc3ccccc3n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N16 compound treatment 0.063 -0.00578 -0.37 0.063 -0.00516 -0.36 -0.5181 -0.9999 2068991 IFLab1_006286 COC(=O)c1ccccc1NC(=O)c2ccc(o2)c3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N17 compound treatment 0.061 -0.00778 -0.5 0.067 -0.00116 -0.08 -0.4115 -0.8111 2068992 IFLab1_006287 CN(CCc1ccccn1)S(=O)(=O)c2ccc3NC(=O)c4cccc2c34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N18 compound treatment 0.061 -0.00778 -0.5 0.06 -0.00816 -0.57 -0.7573 -0.9979 2068993 IFLab1_006288 CC1=CS/C(=C(/C#N)\C(=O)NCc2ccco2)/N1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N19 compound treatment 0.058 -0.0108 -0.69 0.057 -0.0112 -0.78 -1.042 -0.9983 2068994 IFLab1_006289 OC(COc1ccccc1)CN2CCN(Cc3ccc(Cl)cc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N20 compound treatment 0.071 0.00222 0.14 0.076 0.00784 0.55 0.4882 0.8627 2068995 IFLab1_006290 CC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccccn2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N21 compound treatment 0.07 0.00122 0.08 0.068 -1.61E-4 -0.01 0.0475 0.5994 2068996 IFLab1_006291 O=C(ON1C(=O)c2cccc3cccc(C1=O)c23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N22 compound treatment 0.063 -0.00578 -0.37 0.062 -0.00616 -0.43 -0.5675 -0.9974 2068997 IFLab1_006292 CCc1cc(C(=O)OC)c(NC(=O)CC2Sc3ccccc3NC2=O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N23 mock treatment 0.071 0.00222 0.14 0.068 -1.61E-4 -0.01 0.093 0.6493 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 N24 mock treatment 0.07 0.00122 0.08 0.061 -0.00716 -0.5 -0.2983 -0.589 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O01 compound treatment 0.059 -0.00978 -0.63 0.061 -0.00716 -0.5 -0.7989 -0.9935 1128682 IFLab1_006293 CC(C)(C)NC(=O)C1(CC2CC3CC(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O02 compound treatment 0.069 2.19E-4 0.01 0.061 -0.00716 -0.5 -0.3438 -0.6869 2068998 IFLab1_006294 CCn1c(nc2ccccc12)C3CN(C(=O)C3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O03 compound treatment 0.06 -0.00878 -0.57 0.062 -0.00616 -0.43 -0.704 -0.991 1195801 IFLab1_006295 COc1ccc(cc1)N(C2CS(=O)(=O)C=C2)C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O04 compound treatment 0.061 -0.00778 -0.5 0.058 -0.0102 -0.71 -0.8561 -0.9854 2068999 IFLab1_006296 COC(=O)Cn1c(=O)oc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O05 compound treatment 0.107 0.0382 2.46 0.092 0.0238 1.67 2.917 0.982 2069000 IFLab1_006297 COc1ccc(cc1)c2csc(n2)C(=C(SC)SC)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O06 compound treatment 0.054 -0.0148 -0.95 0.061 -0.00716 -0.5 -1.0265 -0.955 2069001 IFLab1_006298 Cc1ccc(s1)S(=O)(=O)N2CCN(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O07 compound treatment 0.072 0.00322 0.21 0.068 -1.61E-4 -0.01 0.1385 0.6677 2069002 IFLab1_006299 Fc1ccc2c(Cl)c(sc2c1)C(=O)Nc3ccc(cc3)N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O08 compound treatment 0.068 -7.81E-4 -0.05 0.069 8.39E-4 0.06 0.0059 0.0761 2069003 IFLab1_006300 CN(C)N/C(=N\S(=O)(=O)c1ccc(C)cc1)/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O09 compound treatment 0.064 -0.00478 -0.31 0.066 -0.00216 -0.15 -0.3244 -0.9463 2069004 IFLab1_006301 O=C(N1CCCCC1)c2cn(nc2c3ccncc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O10 compound treatment 0.064 -0.00478 -0.31 0.062 -0.00616 -0.43 -0.522 -0.9865 1019444 IFLab1_006302 C[n+]1noc(O)c1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O11 compound treatment 0.073 0.00422 0.27 0.07 0.00184 0.13 0.2828 0.9416 2069005 IFLab1_006303 FC(F)(F)c1cccc(c1)S(=O)(=O)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O12 compound treatment 0.082 0.0132 0.85 0.071 0.00284 0.2 0.7419 0.8492 2069006 IFLab1_006304 Cc1ccccc1NC(=O)CSC2=C(C#N)C(C3=C(CC(C)(C)CC3=O)N2)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O13 compound treatment 0.08 0.0112 0.72 0.073 0.00484 0.34 0.7496 0.9402 2069007 IFLab1_006305 COc1ccc(cc1)n2nnnc2c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O14 compound treatment 0.074 0.00522 0.34 0.08 0.0118 0.83 0.8223 0.9212 2069008 IFLab1_006306 COc1ccc(cc1Cl)C(=O)C2=C(O)C(=O)N(CCN(C)C)C2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O15 compound treatment 0.081 0.0122 0.79 0.08 0.0118 0.83 1.1409 0.9997 2069009 IFLab1_006307 CC(C)C(=O)NCCCc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O16 compound treatment 0.061 -0.00778 -0.5 0.059 -0.00916 -0.64 -0.8067 -0.9926 2069010 IFLab1_006308 O/N=C\1/C=C(CN2CCCCC2)C(=O)c3ncccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O17 compound treatment 0.063 -0.00578 -0.37 0.07 0.00184 0.13 -0.1723 -0.4377 2069011 IFLab1_006309 COCc1nc2ccccc2n1CCOc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O18 compound treatment 0.07 0.00122 0.08 0.063 -0.00516 -0.36 -0.1995 -0.5406 2069012 IFLab1_006310 CN(C)C(CC(=O)Nc1cccc(c1)C(F)(F)F)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O19 compound treatment 0.068 -7.81E-4 -0.05 0.068 -1.61E-4 -0.01 -0.0435 -0.8446 2069013 IFLab1_006311 CCN1C(=O)/C(=C/2\C(=O)Nc3ccccc23)/SC1=S 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O20 compound treatment 0.068 -7.81E-4 -0.05 0.061 -0.00716 -0.5 -0.3893 -0.7743 2069014 IFLab1_006312 COc1ccc(cc1)N/2C(=O)CS\C2=N\S(=O)(=O)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O21 compound treatment 0.469 0.4 25.76 0.471 0.403 28.14 38.1147 0.999 2069015 IFLab1_006313 FC(F)(F)c1nc2ccccc2n1Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O22 compound treatment 0.069 2.19E-4 0.01 0.062 -0.00616 -0.43 -0.2944 -0.6836 2069016 IFLab1_006314 Cc1sc2c(c1C)c(=O)nc3scc(CC(=O)NCCO)n32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O23 mock treatment 0.064 -0.00478 -0.31 0.061 -0.00716 -0.5 -0.5714 -0.9728 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 O24 mock treatment 0.07 0.00122 0.08 0.07 0.00184 0.13 0.1463 0.972 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P01 compound treatment 0.169 0.1 6.45 0.146 0.0778 5.44 8.4064 0.9964 2069017 IFLab1_006315 Cc1c(cnn1c2ccccc2)C(=O)Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P02 compound treatment 0.664 0.595 38.31 0.553 0.485 33.87 51.0404 0.9981 2069018 IFLab1_006316 FC(F)(F)c1cccc(NC2=NC(=O)/C(=C\c3cccs3)/S2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P03 compound treatment 0.075 0.00622 0.4 0.075 0.00684 0.48 0.6209 0.9961 2069019 IFLab1_006317 NS(=O)(=O)c1ccc(Nc2nc3sc4CCCCc4c3c(=O)s2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P04 compound treatment 0.38 0.311 20.03 0.308 0.24 16.76 26.0121 0.9961 2069020 IFLab1_006318 CCOc1cc(/C=C\2/S/C(=N/c3ccccc3F)/NC2=O)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P05 compound treatment 0.091 0.0222 1.43 0.075 0.00684 0.48 1.3491 0.8947 2069021 IFLab1_006319 Fc1ccc(cc1)c2cnnn2c3ccc(cc3)C(=O)COC(=O)c4ccccc4F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P06 compound treatment 0.075 0.00622 0.4 0.06 -0.00816 -0.57 -0.1201 -0.1724 2069022 IFLab1_006320 COc1ccccc1Cn2c(=O)oc3ccc(C)cc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P07 compound treatment 0.07 0.00122 0.08 0.07 0.00184 0.13 0.1463 0.972 1785239 IFLab1_006321 OC(=O)Cc1c(c2ccccc2)c3cc(Br)ccc3[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P08 compound treatment 0.053 -0.0158 -1.02 0.053 -0.0152 -1.06 -1.4672 -0.9998 2069023 IFLab1_006322 OC(=O)c1ccc(OC(F)(F)F)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P09 compound treatment 0.061 -0.00778 -0.5 0.064 -0.00416 -0.29 -0.5597 -0.9665 1327154 IFLab1_006323 Cc1ccc(cc1)S(=O)(=O)Nc2c(c3ccccc3)c4cc(C)ccc4[nH]c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P10 compound treatment 0.066 -0.00278 -0.18 0.061 -0.00716 -0.5 -0.4803 -0.904 1134203 IFLab1_006324 CCOC(=O)CC(=O)Nc1nc2ccccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P11 compound treatment 0.066 -0.00278 -0.18 0.058 -0.0102 -0.71 -0.6285 -0.8585 2069024 IFLab1_006325 CCC(C)Cn1c(CO)nc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P12 compound treatment 0.084 0.0152 0.98 0.076 0.00784 0.55 1.0799 0.9623 2069025 IFLab1_006326 Cc1ccnc(SCc2nc3ccc(Cl)cn3c2Br)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P13 compound treatment 0.062 -0.00678 -0.44 0.062 -0.00616 -0.43 -0.613 -1.0 2069026 IFLab1_006327 CC(=O)NCCc1nc2ccccc2n1Cc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P14 compound treatment 0.103 0.0342 2.2 0.116 0.0478 3.34 3.9205 0.9795 2069027 IFLab1_006328 CCOc1ccc(cc1)c2cc(O)cc3sc(=O)oc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P15 compound treatment 0.066 -0.00278 -0.18 0.062 -0.00616 -0.43 -0.4309 -0.9244 2069028 IFLab1_006329 CN(C)CCNc1nc2ccccc2[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P16 compound treatment 0.074 0.00522 0.34 0.075 0.00684 0.48 0.5753 0.9851 2069029 IFLab1_006330 Clc1cccc(c1)c2ccc(o2)C(=O)NCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P17 compound treatment 0.073 0.00422 0.27 0.065 -0.00316 -0.22 0.0358 0.1024 2069030 IFLab1_006331 Cc1cc(ccc1F)S(=O)(=O)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P18 compound treatment 0.068 -7.81E-4 -0.05 0.071 0.00284 0.2 0.1047 0.5116 2069031 IFLab1_006332 CC1=CS/C(=C(/C#N)\C(=O)N2CCOCC2)/N1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P19 compound treatment 0.088 0.0192 1.24 0.087 0.0188 1.32 1.8053 0.9995 2069032 IFLab1_006333 Cc1cc(C)nc(SCC(=O)CSc2nc(C)cc(C)n2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P20 compound treatment 0.07 0.00122 0.08 0.066 -0.00216 -0.15 -0.0513 -0.3015 2069033 IFLab1_006334 CC(NC(=O)CC1Sc2ccccc2NC1=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P21 compound treatment 0.073 0.00422 0.27 0.088 0.0198 1.39 1.172 0.8299 2069034 IFLab1_006335 OC(=O)CNS(=O)(=O)c1ccc(Cl)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P22 compound treatment 0.074 0.00522 0.34 0.142 0.0738 5.16 3.885 0.7516 2069035 IFLab1_006336 CC(C)N1C(=O)CC(Nc2ccc(cc2)N3CCOCC3)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P23 mock treatment 0.07 0.00122 0.08 0.064 -0.00416 -0.29 -0.1501 -0.4985 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1429 P24 mock treatment 0.071 0.00222 0.14 0.081 0.0128 0.9 0.7352 0.8095 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A01 compound treatment 0.155 0.0196 1.26 0.138 0.0315 2.2 2.4489 0.9652 2069036 IFLab1_006337 O=C1CC(Nc2ccc(cc2)N3CCOCC3)C(=O)N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A02 compound treatment 0.136 6.18E-4 0.04 0.093 -0.0135 -0.94 -0.6387 -0.6767 1986286 IFLab1_006338 COCCN1C(c2c(oc3ccccc3c2=O)C1=O)c4cccc(O)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A03 compound treatment 0.155 0.0196 1.26 0.137 0.0305 2.13 2.3995 0.9688 2069037 IFLab1_006339 Cc1cccc(c1C)n2c(SCC(=O)O)nnc2c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A04 compound treatment 0.154 0.0186 1.2 0.093 -0.0135 -0.94 0.1805 0.1184 2069038 IFLab1_006340 COCCN1C(c2c(oc3ccc(F)cc3c2=O)C1=O)c4cccc(OCC=C)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A05 compound treatment 0.29 0.155 9.95 0.215 0.109 7.58 12.3968 0.991 2069039 IFLab1_006341 O=S(=O)(N1CCCC1)c2cccc(c2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A06 compound treatment 0.229 0.0936 6.03 0.181 0.0745 5.2 7.941 0.9973 2069040 IFLab1_006342 Cc1c(oc2ccc(C)cc12)C(=O)N(Cc3ccccc3)C4CCS(=O)(=O)C4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A07 compound treatment 0.088 -0.0474 -3.05 0.098 -0.0085 -0.59 -2.5764 -0.8292 2069041 IFLab1_006343 CC(C)c1ccc(cc1)S(=O)(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A08 compound treatment 0.152 0.0166 1.07 0.121 0.0145 1.01 1.4726 0.9996 2069042 IFLab1_006344 CC1SC(C)C(=O)N(CC(=O)Nc2ccccc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A09 compound treatment 0.098 -0.0374 -2.41 0.083 -0.0235 -1.64 -2.8622 -0.9826 2069043 IFLab1_006345 Oc1ccc2cc(c(=O)oc2c1)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A10 compound treatment 0.164 0.0286 1.84 0.118 0.0115 0.8 1.8706 0.9308 2069044 IFLab1_006346 CCC1SC(CC)C(=O)N(CC(=O)NCCc2ccccc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A11 compound treatment 0.099 -0.0364 -2.34 0.071 -0.0355 -2.48 -3.4095 -0.9996 1346298 IFLab1_006347 Cn1c(=NC(=O)c2ccc(cc2)N3C(=O)CCC3=O)sc4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A12 compound treatment 0.12 -0.0154 -0.99 0.085 -0.0215 -1.5 -1.7621 -0.9795 2069045 IFLab1_006348 CC1SCC(=O)N(CC(=O)Nc2ccccc2C(F)(F)F)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A13 compound treatment 0.937 0.802 51.6 0.824 0.718 50.12 71.9273 0.9999 2069046 IFLab1_006349 Cn1c(SCc2nc3ccccc3s2)nnc1c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A14 compound treatment 0.11 -0.0254 -1.63 0.076 -0.0305 -2.13 -2.6619 -0.9914 2069047 IFLab1_006350 CCSC1=NCCN1S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A15 compound treatment 0.175 0.0396 2.55 0.12 0.0135 0.94 2.47 0.9085 2069048 IFLab1_006351 CCCOc1ccc(cc1)c2cc(c(C#N)c(SCC(=O)O)n2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A16 compound treatment 0.107 -0.0284 -1.83 0.102 -0.0045 -0.31 -1.514 -0.8168 2069049 IFLab1_006352 CCS(=O)(=O)N1CCN=C1SC(C)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A17 compound treatment 0.088 -0.0474 -3.05 0.096 -0.0105 -0.73 -2.6752 -0.8529 2069050 IFLab1_006353 CC(Oc1ccccc1F)C(=O)N2CCN(CC2)C(c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A18 compound treatment 0.107 -0.0284 -1.83 0.076 -0.0305 -2.13 -2.7984 -0.9971 2069051 IFLab1_006354 CS(=O)(=O)N1CCN=C1SCc2ccc(cc2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A19 compound treatment 0.081 -0.0544 -3.5 0.08 -0.0265 -1.85 -3.7841 -0.9557 2069052 IFLab1_006355 Cc1cc(C)cc(OCC(=O)N2CCN(Cc3ccccc3)CC2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A20 compound treatment 0.111 -0.0244 -1.57 0.092 -0.0145 -1.01 -1.826 -0.9776 2069053 IFLab1_006356 CC1CC(C)CN(C1)C(c2sc3ncnn3c2O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A21 compound treatment 0.127 -0.00838 -0.54 0.096 -0.0105 -0.73 -0.9002 -0.9886 2069054 IFLab1_006357 CCOc1cccc(c1)C2N(Cc3ccccc3)C(=O)C(=C2C(=O)c4ccc(C)o4)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A22 compound treatment 0.119 -0.0164 -1.05 0.101 -0.0055 -0.38 -1.0173 -0.9065 2069055 IFLab1_006358 CC(C)Sc1nnc(CSc2ncccn2)n1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A23 mock treatment 0.117 -0.0184 -1.18 0.087 -0.0195 -1.36 -1.7999 -0.9975 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 A24 mock treatment 0.114 -0.0214 -1.38 0.071 -0.0355 -2.48 -2.7268 -0.9614 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B01 compound treatment 0.1 -0.0354 -2.28 0.084 -0.0225 -1.57 -2.7218 -0.9836 2069056 IFLab1_006359 COc1cccc2c(=O)n(CC(=O)N3CCc4ccccc34)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B02 mock treatment 0.174 0.0386 2.49 0.14 0.0335 2.34 3.4125 0.9995 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B03 compound treatment 0.169 0.0336 2.16 0.117 0.0105 0.73 2.0487 0.8967 2069057 IFLab1_006360 Cn1cccc1Cc2nnc(SCC(=O)NC3CCCC3)n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B04 mock treatment 0.19 0.0546 3.52 0.111 0.0045 0.31 2.7081 0.7673 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B05 compound treatment 0.136 6.18E-4 0.04 0.089 -0.0175 -1.22 -0.8363 -0.6837 2069058 IFLab1_006361 NNc1nc2c3CCCCc3ccc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B06 mock treatment 0.155 0.0196 1.26 0.135 0.0285 1.99 2.3007 0.9759 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B07 compound treatment 0.245 0.11 7.06 0.158 0.0515 3.6 7.5331 0.9512 1060996 IFLab1_006362 COc1ccc2nc(Cl)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B08 mock treatment 0.133 -0.00238 -0.15 0.125 0.0185 1.29 0.8055 0.6189 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B09 mock treatment 0.138 0.00262 0.17 0.087 -0.0195 -1.36 -0.8441 -0.615 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B10 mock treatment 0.111 -0.0244 -1.57 0.107 5.0E-4 0.03 -1.085 -0.6912 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B11 mock treatment 0.109 -0.0264 -1.7 0.082 -0.0245 -1.71 -2.411 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B12 mock treatment 0.126 -0.00938 -0.6 0.098 -0.0085 -0.59 -0.8469 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B13 mock treatment 0.107 -0.0284 -1.83 0.083 -0.0235 -1.64 -2.4526 -0.9986 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B14 mock treatment 0.129 -0.00638 -0.41 0.102 -0.0045 -0.31 -0.5128 -0.9913 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B15 mock treatment 0.14 0.00462 0.3 0.081 -0.0255 -1.78 -1.0495 -0.5811 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B16 mock treatment 0.133 -0.00238 -0.15 0.093 -0.0135 -0.94 -0.7753 -0.8114 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B17 mock treatment 0.124 -0.0114 -0.73 0.086 -0.0205 -1.43 -1.5307 -0.9516 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B18 mock treatment 0.115 -0.0204 -1.31 0.098 -0.0085 -0.59 -1.3475 -0.9358 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B19 mock treatment 0.146 0.0106 0.68 0.1 -0.0065 -0.45 0.1622 0.1976 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B20 mock treatment 0.117 -0.0184 -1.18 0.099 -0.0075 -0.52 -1.2071 -0.9329 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B21 mock treatment 0.132 -0.00338 -0.22 0.091 -0.0155 -1.08 -0.9196 -0.8326 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B22 mock treatment 0.137 0.00162 0.1 0.095 -0.0115 -0.8 -0.4944 -0.6103 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B23 mock treatment 0.135 -3.82E-4 -0.02 0.104 -0.0025 -0.17 -0.1409 -0.7988 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 B24 mock treatment 0.101 -0.0344 -2.21 0.081 -0.0255 -1.78 -2.8245 -0.9942 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C01 compound treatment 0.093 -0.0424 -2.73 0.073 -0.0335 -2.34 -3.5838 -0.9971 2069059 IFLab1_006363 CCc1cc(C(=O)OC)c(s1)N2C(=O)C=CC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C02 compound treatment 0.17 0.0346 2.23 0.09 -0.0165 -1.15 0.7605 0.3031 2069060 IFLab1_006364 COCCN1C(c2c(oc3cc(C)c(C)cc3c2=O)C1=O)c4ccccc4F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C03 compound treatment 0.355 0.22 14.14 0.251 0.144 10.09 17.1335 0.9864 2069061 IFLab1_006365 CSc1nnc(c2cccs2)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C04 compound treatment 0.201 0.0656 4.22 0.124 0.0175 1.22 3.8509 0.8758 2069062 IFLab1_006366 COCCN1C(c2c(oc3ccc(F)cc3c2=O)C1=O)c4ccc(OCC=C)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C05 compound treatment 0.083 -0.0524 -3.37 0.06 -0.0465 -3.25 -4.6811 -0.9998 1558055 IFLab1_006367 CC(=O)N1CC(=O)Nc2ccc(F)cc2C1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C06 compound treatment 0.196 0.0606 3.9 0.132 0.0255 1.78 4.0186 0.9369 2069063 IFLab1_006368 COC(=O)c1ccc2O/C(=C/c3ccccc3O)/C(=O)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C07 compound treatment 0.172 0.0366 2.36 0.122 0.0155 1.08 2.4323 0.9377 2069064 IFLab1_006369 O=C(NC1CCCCC1)c2ccc(NC3=NC4CS(=O)(=O)CC4S3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C08 compound treatment 0.175 0.0396 2.55 0.106 -5.0E-4 -0.03 1.7784 0.6974 2069065 IFLab1_006370 CC1SC(C)C(=O)N(CC(=O)NC2CCCCC2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C09 compound treatment 0.199 0.0636 4.09 0.125 0.0185 1.29 3.8093 0.8871 2069066 IFLab1_006371 Cc1ccc(CCNC(=O)CC(C)(C)CC2=Nc3ccccc3S(=O)(=O)N2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C10 compound treatment 0.124 -0.0114 -0.73 0.092 -0.0145 -1.01 -1.2343 -0.9873 2069067 IFLab1_006372 CC1SCC(=O)N(CC(=O)Nc2cccc(C)c2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C11 compound treatment 0.406 0.271 17.42 0.097 -0.0095 -0.66 11.8473 0.6797 1627112 IFLab1_006373 CCOc1cccc(NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCCCC3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C12 compound treatment 0.144 0.00862 0.55 0.081 -0.0255 -1.78 -0.8674 -0.4649 2069068 IFLab1_006374 CC1SCC(=O)N(CC(=O)NCc2ccccc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C13 compound treatment 0.177 0.0416 2.68 0.108 0.0015 0.1 1.9683 0.7342 2069069 IFLab1_006375 OC(=O)CSc1nnc(c2cccs2)n1c3cccc(c3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C14 compound treatment 0.185 0.0496 3.19 0.119 0.0125 0.87 2.8757 0.8686 2069070 IFLab1_006376 CCSC1=NCCN1S(=O)(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C15 compound treatment 0.399 0.264 16.97 0.217 0.111 7.72 17.4565 0.9364 2069071 IFLab1_006377 O=S(=O)(/C(=C\C1=Cc2ccccc2OC1)/C#N)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C16 compound treatment 0.387 0.252 16.2 0.3 0.194 13.52 21.0104 0.996 2069072 IFLab1_006378 CC(SC1=NCCN1S(=O)(=O)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C17 compound treatment 0.727 0.592 38.08 0.512 0.406 28.33 46.9573 0.9894 2069073 IFLab1_006379 COC(=O)c1nc(oc1Nc2ccc(C)cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C18 compound treatment 0.147 0.0116 0.75 0.097 -0.0095 -0.66 0.0595 0.0595 2069074 IFLab1_006380 CCS(=O)(=O)N1CCN=C1SCc2ccc(cc2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C19 compound treatment 0.207 0.0716 4.61 0.141 0.0345 2.41 4.9638 0.9543 2069075 IFLab1_006381 COCCN1C(C(=C(O)C1=O)C(=O)c2ccc3OC(C)Cc3c2)c4ccc(Cl)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C20 compound treatment 0.131 -0.00438 -0.28 0.098 -0.0085 -0.59 -0.6193 -0.9421 2069076 IFLab1_006382 CC1CN(CC(C)O1)C(c2sc3ncnn3c2O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C21 compound treatment 0.146 0.0106 0.68 0.098 -0.0085 -0.59 0.0634 0.07 2069077 IFLab1_006383 COC(=O)Nc1sc(nc1c2cccs2)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C22 compound treatment 0.17 0.0346 2.23 0.127 0.0205 1.43 2.5882 0.9772 2069078 IFLab1_006384 CSc1nnc(CSc2ncccn2)n1c3cccc(c3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C23 mock treatment 0.132 -0.00338 -0.22 0.086 -0.0205 -1.43 -1.1666 -0.8053 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 C24 mock treatment 0.101 -0.0344 -2.21 0.095 -0.0115 -0.8 -2.1329 -0.906 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D01 compound treatment 0.135 -3.82E-4 -0.02 0.103 -0.0035 -0.24 -0.1903 -0.7743 2069079 IFLab1_006385 COc1cccc2c(=O)n(CC(=O)N)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D02 mock treatment 0.126 -0.00938 -0.6 0.156 0.0495 3.46 2.0182 0.5749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D03 compound treatment 0.18 0.0446 2.87 0.137 0.0305 2.13 3.5373 0.9892 2069080 IFLab1_006386 Cn1cccc1Cc2nnc(SCC(=O)NCc3ccccc3)n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D04 mock treatment 0.189 0.0536 3.45 0.114 0.0075 0.52 2.8108 0.8052 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D05 compound treatment 0.208 0.0726 4.67 0.169 0.0625 4.37 6.3925 0.9994 2069081 IFLab1_006387 Cc1cccc2sc(NN)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D06 mock treatment 0.184 0.0486 3.13 0.151 0.0445 3.11 4.411 1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D07 compound treatment 0.148 0.0126 0.81 0.088 -0.0185 -1.29 -0.3396 -0.2225 1688617 IFLab1_006388 COc1cccc2sc(N)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D08 mock treatment 0.161 0.0256 1.65 0.117 0.0105 0.73 1.6846 0.9335 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D09 mock treatment 0.138 0.00262 0.17 0.11 0.0035 0.24 0.292 0.9835 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D10 mock treatment 0.15 0.0146 0.94 0.11 0.0035 0.24 0.8382 0.8622 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D11 mock treatment 0.134 -0.00138 -0.09 0.091 -0.0155 -1.08 -0.8286 -0.7626 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D12 mock treatment 0.123 -0.0124 -0.8 0.131 0.0245 1.71 0.6467 0.3425 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D13 mock treatment 0.143 0.00762 0.49 0.111 0.0045 0.31 0.569 0.9769 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D14 mock treatment 0.157 0.0216 1.39 0.106 -5.0E-4 -0.03 0.9592 0.6891 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D15 mock treatment 0.136 6.18E-4 0.04 0.104 -0.0025 -0.17 -0.0954 -0.5324 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D16 mock treatment 0.158 0.0226 1.46 0.105 -0.0015 -0.1 0.9553 0.6545 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D17 mock treatment 0.119 -0.0164 -1.05 0.087 -0.0195 -1.36 -1.7089 -0.992 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D18 mock treatment 0.149 0.0136 0.88 0.1 -0.0065 -0.45 0.2987 0.3026 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D19 mock treatment 0.155 0.0196 1.26 0.09 -0.0165 -1.15 0.0778 0.0455 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D20 mock treatment 0.123 -0.0124 -0.8 0.117 0.0105 0.73 -0.0449 -0.0414 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D21 mock treatment 0.126 -0.00938 -0.6 0.079 -0.0275 -1.92 -1.7855 -0.8866 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D22 mock treatment 0.134 -0.00138 -0.09 0.086 -0.0205 -1.43 -1.0756 -0.7496 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D23 mock treatment 0.153 0.0176 1.13 0.11 0.0035 0.24 0.9747 0.8403 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 D24 mock treatment 0.12 -0.0154 -0.99 0.078 -0.0285 -1.99 -2.1079 -0.948 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E01 compound treatment 0.039 -0.0964 -6.2 0.041 -0.0655 -4.58 -7.6222 -0.9888 2069082 IFLab1_006389 COC(=O)c1c(sc2CC(CCc12)C(C)(C)C)N3C(=O)C=CC3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E02 compound treatment 0.181 0.0456 2.94 0.118 0.0115 0.8 2.6443 0.8687 2069083 IFLab1_006390 COCCN1C(c2c(oc3ccc(Br)cc3c2=O)C1=O)c4ccc(Cl)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E03 compound treatment 0.289 0.154 9.89 0.196 0.0895 6.25 11.4128 0.9756 2069084 IFLab1_006391 Cc1ccc2cccc(c2n1)S(=O)(=O)Nc3ccc4OCOc4c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E04 compound treatment 0.32 0.185 11.88 0.232 0.126 8.77 14.602 0.9888 2069085 IFLab1_006392 COc1ccc(cc1F)C(=O)C2=C(O)C(=O)N(CCCO)C2c3cccc(Br)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E05 compound treatment 0.109 -0.0264 -1.7 0.082 -0.0245 -1.71 -2.411 -1.0 2069086 IFLab1_006393 Cc1ccc2NC(=O)CN=C(c3ccc(F)cc3)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E06 compound treatment 0.652 0.517 33.25 0.497 0.391 27.28 42.8028 0.9952 2069087 IFLab1_006394 Fc1ccccc1C(=O)Nc2c(oc3ccccc23)C(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E07 compound treatment 1.132 0.997 64.15 1.115 1.01 70.45 95.1772 0.9989 2069088 IFLab1_006395 Fc1cccc(Cn2c(=O)c3ccccc3n4nncc24)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E08 compound treatment 0.171 0.0356 2.29 0.137 0.0305 2.13 3.1277 0.9993 2069089 IFLab1_006396 CC1SC(C)C(=O)N(CC(=O)NCc2ccco2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E09 compound treatment 0.182 0.0466 3.0 0.102 -0.0045 -0.31 1.8994 0.6296 2069090 IFLab1_006397 Cc1ccc(C)c(NC2=NC3CS(=O)(=O)CC3S2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E10 compound treatment 0.23 0.0946 6.09 0.16 0.0535 3.74 6.9492 0.9725 2069091 IFLab1_006398 CC1SCC(=O)N(CC(=O)Nc2ccc(C)cc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E11 compound treatment 0.16 0.0246 1.58 0.121 0.0145 1.01 1.8367 0.9766 1700163 IFLab1_006399 CCOc1ccc(NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCC3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E12 compound treatment 0.211 0.0756 4.87 0.128 0.0215 1.5 4.5037 0.8842 2069092 IFLab1_006400 CC1SCC(=O)N(CC(=O)NCCc2ccccc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E13 compound treatment 0.859 0.724 46.58 0.693 0.587 40.97 61.9061 0.998 2069093 IFLab1_006401 Cc1ccc(cc1S(=O)(=O)N2CCCC2)c3nc4ccccc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E14 compound treatment 0.137 0.00162 0.1 0.088 -0.0185 -1.29 -0.8402 -0.648 2069094 IFLab1_006402 CCSC1=NCCN1S(=O)(=O)c2ccc(NC(=O)C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E15 compound treatment 0.166 0.0306 1.97 0.12 0.0135 0.94 2.0604 0.9431 2069095 IFLab1_006403 CC1Oc2ccccc2C=C1/C=C(\C#N)/c3nc(=O)c4ccccc4[nH]3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E16 compound treatment 0.139 0.00362 0.23 0.102 -0.0045 -0.31 -0.0576 -0.1473 2069096 IFLab1_006404 CC(SC1=NCCN1S(=O)(=O)c2ccc(NC(=O)C)cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E17 compound treatment 0.135 -3.82E-4 -0.02 0.119 0.0125 0.87 0.6001 0.6869 2069097 IFLab1_006405 O=C(Nc1c(nc2ncccn12)c3cccs3)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E18 compound treatment 0.088 -0.0474 -3.05 0.08 -0.0265 -1.85 -3.4655 -0.9714 2069098 IFLab1_006406 CS(=O)(=O)N1CCN=C1SCc2ccc(Cl)c(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E19 compound treatment 0.141 0.00562 0.36 0.118 0.0115 0.8 0.8238 0.935 2069099 IFLab1_006407 Clc1ccc(CN(C2CCS(=O)(=O)C2)C(=O)c3ccc(Cl)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E20 compound treatment 0.141 0.00562 0.36 0.092 -0.0145 -1.01 -0.4606 -0.4282 2069100 IFLab1_006408 CCN1CCN(CC1)C(c2sc3ncnn3c2O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E21 compound treatment 0.181 0.0456 2.94 0.123 0.0165 1.15 2.8913 0.9166 2069101 IFLab1_006409 Clc1ccc(OCC(=O)N(Cc2cccs2)C3CCS(=O)(=O)C3)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E22 compound treatment 0.183 0.0476 3.06 0.139 0.0325 2.27 3.7727 0.9891 2069102 IFLab1_006410 CCSc1nnc(CSc2ncccn2)n1c3cccc(c3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E23 mock treatment 0.122 -0.0134 -0.86 0.078 -0.0285 -1.99 -2.0169 -0.9297 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 E24 mock treatment 0.113 -0.0224 -1.44 0.099 -0.0075 -0.52 -1.3892 -0.9062 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F01 compound treatment 0.11 -0.0254 -1.63 0.101 -0.0055 -0.38 -1.4269 -0.8502 2069103 IFLab1_006411 COc1cccc2c(=O)n(CC(=O)Nc3ccccc3)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F02 mock treatment 0.154 0.0186 1.2 0.152 0.0455 3.18 3.095 0.9111 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F03 compound treatment 0.501 0.366 23.53 0.342 0.235 16.45 28.2737 0.9847 2069104 IFLab1_006412 Cc1ccc(NC(=O)c2cccn(OCc3ccc(F)cc3)c2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F04 mock treatment 0.175 0.0396 2.55 0.11 0.0035 0.24 1.976 0.7714 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F05 compound treatment 0.23 0.0946 6.09 0.127 0.0205 1.43 5.319 0.8502 2069105 IFLab1_006413 CCc1cccc2sc(NN)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F06 mock treatment 0.171 0.0356 2.29 0.12 0.0135 0.94 2.288 0.9229 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F07 compound treatment 0.163 0.0276 1.78 0.11 0.0035 0.24 1.4299 0.7969 1430771 IFLab1_006414 CCOc1cccc2sc(N)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F08 mock treatment 0.147 0.0116 0.75 0.116 0.0095 0.66 0.9981 0.9982 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F09 mock treatment 0.145 0.00962 0.62 0.104 -0.0025 -0.17 0.3142 0.4885 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F10 mock treatment 0.159 0.0236 1.52 0.121 0.0145 1.01 1.7912 0.9805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F11 mock treatment 0.135 -3.82E-4 -0.02 0.102 -0.0045 -0.31 -0.2397 -0.7601 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F12 mock treatment 0.163 0.0276 1.78 0.123 0.0165 1.15 2.0721 0.978 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F13 mock treatment 0.151 0.0156 1.01 0.109 0.0025 0.17 0.8343 0.8177 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F14 mock treatment 0.152 0.0166 1.07 0.128 0.0215 1.5 1.8184 0.9862 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F15 mock treatment 0.127 -0.00838 -0.54 0.112 0.0055 0.38 -0.1098 -0.1658 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F16 mock treatment 0.119 -0.0164 -1.05 0.088 -0.0185 -1.29 -1.6595 -0.9949 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F17 mock treatment 0.12 -0.0154 -0.99 0.086 -0.0205 -1.43 -1.7127 -0.9838 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F18 mock treatment 0.139 0.00362 0.23 0.092 -0.0145 -1.01 -0.5516 -0.5307 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F19 mock treatment 0.141 0.00562 0.36 0.098 -0.0085 -0.59 -0.1642 -0.2362 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F20 mock treatment 0.143 0.00762 0.49 0.113 0.0065 0.45 0.6678 0.9993 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F21 mock treatment 0.139 0.00362 0.23 0.101 -0.0055 -0.38 -0.107 -0.2382 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F22 mock treatment 0.113 -0.0224 -1.44 0.086 -0.0205 -1.43 -2.0313 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F23 mock treatment 0.139 0.00362 0.23 0.093 -0.0135 -0.94 -0.5022 -0.517 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 F24 mock treatment 0.108 -0.0274 -1.76 0.092 -0.0145 -1.01 -1.9625 -0.9654 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G01 compound treatment 0.039 -0.0964 -6.2 0.04 -0.0665 -4.65 -7.6716 -0.9898 2069106 IFLab1_006415 CCOC(=O)c1c(sc2CC(C)CCc12)N3C(=O)C=CC3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G02 compound treatment 0.2 0.0646 4.16 0.134 0.0275 1.92 4.2994 0.9384 2069107 IFLab1_006416 CCOc1cccc(c1)C2N(CCCN(C)C)C(=O)c3oc4cc(C)c(C)cc4c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G03 compound treatment 0.12 -0.0154 -0.99 0.094 -0.0125 -0.87 -1.3176 -0.998 2069108 IFLab1_006417 CSc1nnc(COc2cccc3ccc(C)nc23)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G04 compound treatment 0.365 0.23 14.78 0.191 0.0845 5.9 14.6247 0.9189 2069109 IFLab1_006418 COC(=O)c1ccc2O/C(=C\c3ccccc3F)/C(=O)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G05 compound treatment 0.143 0.00762 0.49 0.098 -0.0085 -0.59 -0.0732 -0.095 2069110 IFLab1_006419 Cc1nc(N)sc1c2nnc(Nc3ccccc3)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G06 compound treatment 0.519 0.384 24.69 0.414 0.308 21.48 32.6496 0.9976 2069111 IFLab1_006420 CC(C)c1nnc(NC(=O)c2oc3ccc(C)cc3c2C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G07 compound treatment 0.248 0.113 7.25 0.17 0.0635 4.44 8.2624 0.9722 2069112 IFLab1_006421 Fc1cccc(Cn2cc(C(=O)c3ccccc3)c(=O)c4cc(F)ccc24)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G08 compound treatment 0.159 0.0236 1.52 0.121 0.0145 1.01 1.7912 0.9805 2069113 IFLab1_006422 CC1SC(C)C(=O)N(CC(=O)NCc2ccccc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G09 compound treatment 0.183 0.0476 3.06 0.117 0.0105 0.73 2.6859 0.8523 2069114 IFLab1_006423 CSc1cccc(NC2=NC3CS(=O)(=O)CC3S2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G10 compound treatment 0.048 -0.0874 -5.62 0.046 -0.0605 -4.23 -6.9656 -0.9901 2069115 IFLab1_006424 CCCCc1ccc(NC(=O)CN2C(=O)CSC(C)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G11 compound treatment 0.288 0.153 9.82 0.166 0.0595 4.16 9.8853 0.9268 1788580 IFLab1_006425 CCOc1cccc(NC(=O)c2ccc(cc2)S(=O)(=O)N3CCCC3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G12 compound treatment 0.085 -0.0504 -3.24 0.073 -0.0335 -2.34 -3.9479 -0.9872 2069116 IFLab1_006426 CSC1=NCCN1S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G13 compound treatment 0.173 0.0376 2.42 0.124 0.0175 1.22 2.5766 0.9499 2069117 IFLab1_006427 Fc1cccc(c1)C2CC(=O)n3c(S2)nc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G14 compound treatment 0.255 0.12 7.7 0.171 0.0645 4.51 8.6304 0.9674 2069118 IFLab1_006428 CCCS(=O)(=O)N1CCN=C1SCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G15 compound treatment 0.112 -0.0234 -1.5 0.09 -0.0165 -1.15 -1.8793 -0.9913 2069119 IFLab1_006429 Clc1cccc(C=c2sc3nc(nn3c2=O)c4cccs4)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G16 compound treatment 0.185 0.0496 3.19 0.115 0.0085 0.59 2.6781 0.8245 2069120 IFLab1_006430 CCS(=O)(=O)N1CCN=C1SCc2ccccc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G17 compound treatment 0.182 0.0466 3.0 0.12 0.0135 0.94 2.7886 0.8866 1537635 IFLab1_006431 CCCOc1ccc(cc1)C(=O)Nc2ccc(cc2)C(=O)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G18 compound treatment 0.104 -0.0314 -2.02 0.081 -0.0255 -1.78 -2.6879 -0.998 2069121 IFLab1_006432 CS(=O)(=O)N1CCN=C1SCc2cccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G19 compound treatment 0.13 -0.00538 -0.35 0.102 -0.0045 -0.31 -0.4672 -0.9988 2069122 IFLab1_006433 CC(Oc1ccc(F)cc1)C(=O)N(Cc2ccccc2Cl)C3CCS(=O)(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G20 compound treatment 0.124 -0.0114 -0.73 0.089 -0.0175 -1.22 -1.3825 -0.97 2069123 IFLab1_006434 Oc1c(sc2ncnn12)C(N3CCOCC3)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G21 compound treatment 0.12 -0.0154 -0.99 0.098 -0.0085 -0.59 -1.12 -0.9701 2069124 IFLab1_006435 COc1ccccc1C(=O)N(Cc2cccs2)C3CCS(=O)(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G22 compound treatment 0.163 0.0276 1.78 0.101 -0.0055 -0.38 0.9853 0.5418 2069125 IFLab1_006436 CCOc1ccc(cc1)n2c(CSc3nc(C)cc(C)n3)nnc2SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G23 mock treatment 0.122 -0.0134 -0.86 0.084 -0.0225 -1.57 -1.7205 -0.9599 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 G24 mock treatment 0.102 -0.0334 -2.15 0.091 -0.0155 -1.08 -2.285 -0.9497 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H01 compound treatment 0.148 0.0126 0.81 0.128 0.0215 1.5 1.6363 0.9583 2069126 IFLab1_006437 COc1cccc2c(=O)n(CC(=O)NC3CCCC3)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H02 mock treatment 0.162 0.0266 1.71 0.121 0.0145 1.01 1.9277 0.9686 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H03 compound treatment 0.596 0.461 29.65 0.512 0.406 28.33 40.9951 0.9997 2069127 IFLab1_006438 COc1ccc(NC(=O)c2cccn(OCc3ccc(F)cc3)c2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H04 mock treatment 0.14 0.00462 0.3 0.113 0.0065 0.45 0.5313 0.9789 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H05 compound treatment 0.396 0.261 16.77 0.194 0.0875 6.11 16.1838 0.9065 2069128 IFLab1_006439 COc1cccc2sc(NN)nc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H06 mock treatment 0.166 0.0306 1.97 0.143 0.0365 2.55 3.1966 0.9919 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H07 compound treatment 0.166 0.0306 1.97 0.113 0.0065 0.45 1.7146 0.8478 2069129 IFLab1_006440 NC(C(=O)O)C1(CC2CC3CC(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H08 mock treatment 0.179 0.0436 2.81 0.129 0.0225 1.57 3.0966 0.9624 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H09 mock treatment 0.163 0.0276 1.78 0.131 0.0245 1.71 2.4672 0.9998 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H10 mock treatment 0.17 0.0346 2.23 0.133 0.0265 1.85 2.8846 0.9958 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H11 mock treatment 0.151 0.0156 1.01 0.125 0.0185 1.29 1.6247 0.9923 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H12 mock treatment 0.144 0.00862 0.55 0.126 0.0195 1.36 1.3555 0.9216 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H13 mock treatment 0.156 0.0206 1.33 0.084 -0.0225 -1.57 -0.1731 -0.0841 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H14 mock treatment 0.167 0.0316 2.04 0.131 0.0245 1.71 2.6493 0.9963 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H15 mock treatment 0.166 0.0306 1.97 0.131 0.0245 1.71 2.6038 0.9975 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H16 mock treatment 0.148 0.0126 0.81 0.111 0.0045 0.31 0.7966 0.9147 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H17 mock treatment 0.154 0.0186 1.2 0.098 -0.0085 -0.59 0.4275 0.3196 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H18 mock treatment 0.125 -0.0104 -0.67 0.104 -0.0025 -0.17 -0.596 -0.8629 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H19 mock treatment 0.126 -0.00938 -0.6 0.081 -0.0255 -1.78 -1.6867 -0.8967 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H20 mock treatment 0.126 -0.00938 -0.6 0.104 -0.0025 -0.17 -0.5505 -0.8757 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H21 mock treatment 0.124 -0.0114 -0.73 0.09 -0.0165 -1.15 -1.3331 -0.9761 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H22 mock treatment 0.11 -0.0254 -1.63 0.099 -0.0075 -0.52 -1.5257 -0.8893 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H23 mock treatment 0.133 -0.00238 -0.15 0.104 -0.0025 -0.17 -0.2319 -0.9979 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 H24 mock treatment 0.102 -0.0334 -2.15 0.095 -0.0115 -0.8 -2.0874 -0.91 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I01 compound treatment 0.082 -0.0534 -3.44 0.072 -0.0345 -2.41 -4.1338 -0.985 2069130 IFLab1_006441 CCOC(=O)c1cc(C)sc1N2C(=O)C=CC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I02 compound treatment 0.145 0.00962 0.62 0.107 5.0E-4 0.03 0.4624 0.7458 2069131 IFLab1_006442 OCCN1C(c2c(oc3ccccc3c2=O)C1=O)c4cccc(Cl)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I03 compound treatment 0.172 0.0366 2.36 0.12 0.0135 0.94 2.3335 0.9192 2069132 IFLab1_006443 Cn1c(SCc2nc3ccccc3s2)nnc1c4ccncc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I04 compound treatment 0.142 0.00662 0.43 0.11 0.0035 0.24 0.4741 0.9653 2069133 IFLab1_006444 COc1ccc(cc1)C2N(CCCO)C(=O)c3oc4ccccc4c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I05 compound treatment 0.151 0.0156 1.01 0.108 0.0015 0.1 0.7849 0.7766 2069134 IFLab1_006445 COc1ccc(cc1OC)C2=Nc3ccccc3S(=O)(=O)N2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I06 compound treatment 1.413 1.28 82.23 1.442 1.34 93.3 124.1196 0.998 2069135 IFLab1_006446 CC(C)C(=O)Nc1c(oc2ccccc12)C(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I07 compound treatment 0.304 0.169 10.85 0.171 0.0645 4.51 10.8605 0.9242 1206686 IFLab1_006447 O=c1oc2ccccc2cc1S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I08 compound treatment 0.271 0.136 8.73 0.151 0.0445 3.11 8.3706 0.9034 2069136 IFLab1_006448 CC1SC(C)C(=O)N(CC(=O)NCCc2ccccc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I09 compound treatment 0.222 0.0866 5.58 0.128 0.0215 1.5 5.0043 0.8667 2069137 IFLab1_006449 Cc1cc(C)cc(NC2=NC3CS(=O)(=O)CC3S2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I10 compound treatment 0.261 0.126 8.09 0.165 0.0585 4.09 8.607 0.9501 2069138 IFLab1_006450 CC1SCC(=O)N(CC(=O)Nc2ccc(F)cc2F)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I11 compound treatment 0.266 0.131 8.41 0.177 0.0705 4.93 9.4274 0.9675 1218671 IFLab1_006451 CC1CCc2[nH]c(=NC(=O)c3ccc(F)c(F)c3)sc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I12 compound treatment 0.174 0.0386 2.49 0.112 0.0055 0.38 2.0293 0.8068 2069139 IFLab1_006452 CSC1=NCCN1S(=O)(=O)c2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I13 compound treatment 0.266 0.131 8.41 0.207 0.101 7.02 10.9093 0.996 2069140 IFLab1_006453 Cc1ccc(cc1S(=O)(=O)N2CCCC2)C(=O)N3CCN(CC3)c4ccccc4F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I14 compound treatment 0.211 0.0756 4.87 0.118 0.0115 0.8 4.0097 0.8128 2069141 IFLab1_006454 CS(=O)(=O)N1CCN=C1SCc2cccc(F)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I15 compound treatment 0.208 0.0726 4.67 0.178 0.0715 4.99 6.837 0.9994 1657893 IFLab1_006455 Cc1ccc(o1)C(=O)C2=C(O)C(=O)N(CC3CCCO3)C2c4cccc(Cl)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I16 compound treatment 0.261 0.126 8.09 0.145 0.0385 2.69 7.6191 0.8942 2069142 IFLab1_006456 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN=C2SCc3c(F)cccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I17 compound treatment 0.325 0.19 12.2 0.174 0.0675 4.72 11.9645 0.9144 2069143 IFLab1_006457 CCCOc1ccc(cc1C)c2cc(n[nH]2)C(=O)NO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I18 compound treatment 0.178 0.0426 2.74 0.117 0.0105 0.73 2.4584 0.8658 2069144 IFLab1_006458 CCS(=O)(=O)N1CCN=C1SCc2cccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I19 compound treatment 0.195 0.0596 3.84 0.127 0.0205 1.43 3.7261 0.9097 2069145 IFLab1_006459 Clc1ccc(CN(C2CCS(=O)(=O)C2)C(=O)c3cc4ccccc4oc3=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I20 compound treatment 0.125 -0.0104 -0.67 0.1 -0.0065 -0.45 -0.7936 -0.9823 2069146 IFLab1_006460 CCSc1nnc(CSc2ncccn2)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I21 compound treatment 0.153 0.0176 1.13 0.097 -0.0095 -0.66 0.3326 0.2531 2069147 IFLab1_006461 COCCN1C(c2c(oc3ccccc3c2=O)C1=O)c4ccc(C)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I22 compound treatment 0.129 -0.00638 -0.41 0.084 -0.0225 -1.57 -1.4019 -0.8629 2069148 IFLab1_006462 CSc1nnc(CSc2nc(C)cc(C)n2)n1c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I23 mock treatment 0.122 -0.0134 -0.86 0.092 -0.0145 -1.01 -1.3253 -0.9967 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 I24 mock treatment 0.108 -0.0274 -1.76 0.093 -0.0135 -0.94 -1.9131 -0.9571 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J01 compound treatment 0.161 0.0256 1.65 0.137 0.0305 2.13 2.6726 0.992 2069149 IFLab1_006463 COc1cccc2c(=O)n(CC(=O)NCc3ccccc3)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J02 mock treatment 0.14 0.00462 0.3 0.117 0.0105 0.73 0.7289 0.9209 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J03 compound treatment 0.397 0.262 16.84 0.295 0.189 13.17 21.2186 0.9926 2069150 IFLab1_006464 Fc1ccc(COn2cccc(C(=O)Nc3cc(Cl)ccc3Cl)c2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J04 mock treatment 0.157 0.0216 1.39 0.134 0.0275 1.92 2.3424 0.9875 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J05 compound treatment 0.466 0.331 21.28 0.307 0.201 14.01 24.9518 0.9794 2069151 IFLab1_006465 CCOc1ccc2nc(NN)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J06 mock treatment 0.225 0.0896 5.77 0.146 0.0395 2.76 6.03 0.943 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J07 compound treatment 0.17 0.0346 2.23 0.12 0.0135 0.94 2.2424 0.9268 1081539 IFLab1_006466 NCC1(CC2CC3CC(C2)C1)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J08 mock treatment 0.161 0.0256 1.65 0.156 0.0495 3.46 3.6112 0.9426 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J09 mock treatment 0.194 0.0586 3.77 0.122 0.0155 1.08 3.4336 0.8747 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J10 mock treatment 0.192 0.0566 3.64 0.126 0.0195 1.36 3.5401 0.9099 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J11 mock treatment 0.186 0.0506 3.26 0.116 0.0095 0.66 2.7731 0.834 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J12 mock treatment 0.159 0.0236 1.52 0.103 -0.0035 -0.24 0.902 0.5858 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J13 mock treatment 0.199 0.0636 4.09 0.089 -0.0175 -1.22 2.031 0.4753 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J14 mock treatment 0.183 0.0476 3.06 0.135 0.0285 1.99 3.5751 0.9782 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J15 mock treatment 0.149 0.0136 0.88 0.127 0.0205 1.43 1.6325 0.9722 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J16 mock treatment 0.172 0.0366 2.36 0.107 5.0E-4 0.03 1.6913 0.7175 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J17 mock treatment 0.153 0.0176 1.13 0.118 0.0115 0.8 1.3699 0.9858 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J18 mock treatment 0.139 0.00362 0.23 0.105 -0.0015 -0.1 0.0906 0.3547 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J19 mock treatment 0.12 -0.0154 -0.99 0.102 -0.0045 -0.31 -0.9224 -0.8879 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J20 mock treatment 0.134 -0.00138 -0.09 0.107 5.0E-4 0.03 -0.0382 -0.3997 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J21 mock treatment 0.126 -0.00938 -0.6 0.084 -0.0225 -1.57 -1.5385 -0.9137 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J22 mock treatment 0.121 -0.0144 -0.93 0.112 0.0055 0.38 -0.3829 -0.382 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J23 mock treatment 0.143 0.00762 0.49 0.116 0.0095 0.66 0.816 0.9889 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 J24 mock treatment 0.106 -0.0294 -1.89 0.112 0.0055 0.38 -1.0656 -0.5522 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K01 compound treatment 0.203 0.0676 4.35 0.14 0.0335 2.34 4.7323 0.9577 2069152 IFLab1_006467 O=C(N1CCN(CC1)c2ccccc2)c3cccc(c3)S(=O)(=O)N4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K02 compound treatment 0.143 0.00762 0.49 0.097 -0.0095 -0.66 -0.1226 -0.1485 2069153 IFLab1_006468 COc1cccc(c1)C2N(CCO)C(=O)c3oc4ccccc4c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K03 compound treatment 0.116 -0.0194 -1.25 0.072 -0.0345 -2.41 -2.5864 -0.953 2069154 IFLab1_006469 CSc1nnc(NC(=O)/C=C/c2cccc(F)c2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K04 compound treatment 0.148 0.0126 0.81 0.104 -0.0025 -0.17 0.4508 0.5426 2069155 IFLab1_006470 COc1ccc(cc1)C2N(CC=C)C(=O)c3oc4ccccc4c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K05 compound treatment 0.103 -0.0324 -2.08 0.1 -0.0065 -0.45 -1.7949 -0.8414 2069156 IFLab1_006471 COc1ccc(cc1OC)c2nnn(c2N)c3cccc(c3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K06 compound treatment 0.139 0.00362 0.23 0.116 0.0095 0.66 0.634 0.9013 2069157 IFLab1_006472 O=C(CN1C(=O)CSCC1=O)Nc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K07 compound treatment 0.632 0.497 31.96 0.509 0.403 28.12 42.4854 0.998 2069158 IFLab1_006473 COc1ccc2cc(c(=O)oc2c1)S(=O)(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K08 compound treatment 0.33 0.195 12.53 0.153 0.0465 3.25 11.1547 0.862 2069159 IFLab1_006474 CCC1SC(CC)C(=O)N(CC(=O)Nc2ccccc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K09 compound treatment 0.14 0.00462 0.3 0.106 -5.0E-4 -0.03 0.1855 0.6197 2069160 IFLab1_006475 Clc1ccc(NC2=NC3CS(=O)(=O)CC3S2)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K10 compound treatment 0.174 0.0386 2.49 0.118 0.0115 0.8 2.3257 0.8903 2069161 IFLab1_006476 COc1ccccc1NC(=O)CN2C(=O)CSC(C)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K11 compound treatment 0.172 0.0366 2.36 0.093 -0.0135 -0.94 0.9997 0.3938 2069162 IFLab1_006477 NS(=O)(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K12 compound treatment 0.162 0.0266 1.71 0.108 0.0015 0.1 1.2856 0.749 2069163 IFLab1_006478 COc1ccc(cc1)S(=O)(=O)N2CCN=C2SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K13 compound treatment 0.081 -0.0544 -3.5 0.068 -0.0385 -2.69 -4.3769 -0.9915 2069164 IFLab1_006479 COc1ccc(cc1OC)c2nnc(SCC(=O)c3ccccc3)n2CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K14 compound treatment 0.206 0.0706 4.55 0.145 0.0385 2.69 5.1159 0.9686 2069165 IFLab1_006480 CCS(=O)(=O)N1CCN=C1SCc2cccc(F)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K15 compound treatment 0.275 0.14 8.99 0.171 0.0645 4.51 9.5406 0.949 2069166 IFLab1_006481 CCOc1ccc(cc1)C(=O)Nc2sc3CCCCc3c2C(=O)NCc4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K16 compound treatment 0.198 0.0626 4.03 0.127 0.0205 1.43 3.8626 0.903 2069167 IFLab1_006482 CCS(=O)(=O)N1CCN=C1SCc2cccc(C)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K17 compound treatment 0.068 -0.0674 -4.34 0.058 -0.0485 -3.39 -5.4626 -0.9925 2069168 IFLab1_006483 CC(=O)Oc1cccc(C=c2sc3nc(nn3c2=O)c4ccc(F)cc4)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K18 compound treatment 0.238 0.103 6.61 0.186 0.0795 5.55 8.5976 0.9963 2069169 IFLab1_006484 CS(=O)(=O)N1CCN=C1SCc2cccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K19 compound treatment 0.174 0.0386 2.49 0.113 0.0065 0.45 2.0787 0.8227 2069170 IFLab1_006485 CC1Cc2cc(ccc2O1)C(=O)C3=C(O)C(=O)N(CCN(C)C)C3c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K20 compound treatment 0.223 0.0876 5.64 0.141 0.0345 2.41 5.692 0.9281 2069171 IFLab1_006486 CSc1nnc(CSc2ncccn2)n1CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K21 compound treatment 0.141 0.00562 0.36 0.108 0.0015 0.1 0.3298 0.876 2069172 IFLab1_006487 COc1ccc(cc1)C2N(CCCOC(C)C)C(=O)c3oc4ccccc4c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K22 compound treatment 0.144 0.00862 0.55 0.089 -0.0175 -1.22 -0.4722 -0.3518 2069173 IFLab1_006488 COc1cccc2c(=O)n(CC(=O)N3CCCC3)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K23 mock treatment 0.11 -0.0254 -1.63 0.091 -0.0155 -1.08 -1.9209 -0.9801 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 K24 mock treatment 0.112 -0.0234 -1.5 0.114 0.0075 0.52 -0.6937 -0.4353 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L01 compound treatment 0.176 0.0406 2.61 0.166 0.0595 4.16 4.7878 0.975 2069174 IFLab1_006489 Cn1cccc1Cc2nnc(SCC(=O)N3CCCc4ccccc34)n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L02 mock treatment 0.15 0.0146 0.94 0.135 0.0285 1.99 2.0732 0.9414 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L03 compound treatment 0.108 -0.0274 -1.76 0.084 -0.0225 -1.57 -2.3577 -0.9984 2069175 IFLab1_006490 Cc1[nH]c2ccccc2c1CCNCc3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L04 mock treatment 0.143 0.00762 0.49 0.107 5.0E-4 0.03 0.3714 0.7556 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L05 compound treatment 0.484 0.349 22.44 0.317 0.21 14.71 26.265 0.979 2069176 IFLab1_006491 NNc1nc2c(Cl)cc(Cl)cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L06 mock treatment 0.18 0.0446 2.87 0.127 0.0205 1.43 3.0434 0.9483 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L07 compound treatment 1.411 1.28 82.11 1.368 1.26 88.13 120.3731 0.9994 2069177 IFLab1_006492 NC(=O)c1oc2ccccc2c1NC(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L08 mock treatment 0.185 0.0496 3.19 0.131 0.0245 1.71 3.4685 0.9573 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L09 mock treatment 0.199 0.0636 4.09 0.116 0.0095 0.66 3.3647 0.8111 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L10 mock treatment 0.173 0.0376 2.42 0.144 0.0375 2.62 3.5645 0.9992 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L11 mock treatment 0.188 0.0526 3.39 0.126 0.0195 1.36 3.3581 0.9199 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L12 mock treatment 0.158 0.0226 1.46 0.128 0.0215 1.5 2.0915 0.9999 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L13 mock treatment 0.146 0.0106 0.68 0.092 -0.0145 -1.01 -0.233 -0.1907 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L14 mock treatment 0.153 0.0176 1.13 0.147 0.0405 2.83 2.8025 0.9194 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L15 mock treatment 0.16 0.0246 1.58 0.094 -0.0125 -0.87 0.503 0.278 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L16 mock treatment 0.122 -0.0134 -0.86 0.132 0.0255 1.78 0.6506 0.3288 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L17 mock treatment 0.136 6.18E-4 0.04 0.117 0.0105 0.73 0.5468 0.7444 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L18 mock treatment 0.178 0.0426 2.74 0.137 0.0305 2.13 3.4463 0.9922 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L19 mock treatment 0.127 -0.00838 -0.54 0.077 -0.0295 -2.06 -1.8387 -0.8631 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L20 mock treatment 0.166 0.0306 1.97 0.111 0.0045 0.31 1.6158 0.8097 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L21 mock treatment 0.117 -0.0184 -1.18 0.098 -0.0085 -0.59 -1.2565 -0.9492 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L22 mock treatment 0.123 -0.0124 -0.8 0.104 -0.0025 -0.17 -0.687 -0.8421 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L23 mock treatment 0.121 -0.0144 -0.93 0.098 -0.0085 -0.59 -1.0744 -0.977 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 L24 mock treatment 0.121 -0.0144 -0.93 0.112 0.0055 0.38 -0.3829 -0.382 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M01 compound treatment 0.174 0.0386 2.49 0.121 0.0145 1.01 2.4739 0.9217 2069178 IFLab1_006493 Cc1ccc(cc1S(=O)(=O)NCc2ccco2)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M02 compound treatment 0.15 0.0146 0.94 0.113 0.0065 0.45 0.9864 0.9442 2069179 IFLab1_006494 Brc1ccc(cc1)C(=O)N(Cc2ccco2)C3CCS(=O)(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M03 compound treatment 0.172 0.0366 2.36 0.135 0.0285 1.99 3.0744 0.9965 2069180 IFLab1_006495 NC(=O)CSc1nnc(c2cccs2)n1CC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M04 compound treatment 0.196 0.0606 3.9 0.136 0.0295 2.06 4.2162 0.9555 2069181 IFLab1_006496 COc1cc(ccc1O)C2N(CC=C)C(=O)c3oc4ccccc4c(=O)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M05 compound treatment 0.13 -0.00538 -0.35 0.103 -0.0035 -0.24 -0.4178 -0.9855 2069182 IFLab1_006497 Nc1c(nnn1c2ccccc2)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M06 compound treatment 0.171 0.0356 2.29 0.142 0.0355 2.48 3.3747 0.9992 2069183 IFLab1_006498 Fc1ccc(CNC(=O)CN2C(=O)CSCC2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M07 compound treatment 0.201 0.0656 4.22 0.12 0.0135 0.94 3.6533 0.8442 2069184 IFLab1_006499 Cc1ccc(cc1C)S(=O)(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M08 compound treatment 0.411 0.276 17.74 0.255 0.148 10.37 19.8798 0.9673 2069185 IFLab1_006500 CCC1SC(CC)C(=O)N(CC(=O)NC2CCCCC2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M09 compound treatment 0.195 0.0596 3.84 0.147 0.0405 2.83 4.714 0.9888 2069186 IFLab1_006501 O=C(NCc1ccccc1)c2ccc(NC3=NC4CS(=O)(=O)CC4S3)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M10 compound treatment 0.132 -0.00338 -0.22 0.104 -0.0025 -0.17 -0.2774 -0.994 2069187 IFLab1_006502 CCOc1ccccc1NC(=O)CN2C(=O)CSC(C)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M11 compound treatment 0.147 0.0116 0.75 0.102 -0.0045 -0.31 0.3065 0.3778 2069188 IFLab1_006503 OC(COc1ccccc1Cl)CN2CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M12 compound treatment 0.161 0.0256 1.65 0.115 0.0085 0.59 1.5858 0.9049 2069189 IFLab1_006504 CSC1=NCCN1S(=O)(=O)c2ccc(NC(=O)C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M13 compound treatment 0.288 0.153 9.82 0.212 0.106 7.37 12.1576 0.99 2069190 IFLab1_006505 COc1ccc(cc1)n2c(SC)nnc2c3ccc(OC)c(OC)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M14 compound treatment 0.475 0.34 21.86 0.404 0.297 20.78 30.153 0.9997 2069191 IFLab1_006506 Fc1ccc(CSC2=NCCN2S(=O)(=O)c3ccc(F)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M15 compound treatment 0.186 0.0506 3.26 0.172 0.0655 4.58 5.5394 0.9861 2069192 IFLab1_006507 Cc1ccc(cc1)C(=O)Nc2sc(CC#N)nc2c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M16 compound treatment 0.233 0.0976 6.28 0.129 0.0225 1.57 5.5543 0.8576 2069193 IFLab1_006508 CCS(=O)(=O)N1CCN=C1SCc2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M17 compound treatment 0.353 0.218 14.01 0.27 0.164 11.42 17.9811 0.9949 2069194 IFLab1_006509 CCc1ccc(cc1)C2N(CCOC)C(=O)C(=C2C(=O)c3ccc4OC(C)Cc4c3)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M18 compound treatment 0.383 0.248 15.94 0.202 0.0955 6.67 15.9874 0.9253 2069195 IFLab1_006510 CCS(=O)(=O)N1CCN=C1SCc2ccc(Cl)cc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M19 compound treatment 0.144 0.00862 0.55 0.094 -0.0125 -0.87 -0.2252 -0.2177 2069196 IFLab1_006511 O=c1c(=Cc2ccccc2)sc3nc(nn13)c4ccco4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M20 compound treatment 0.197 0.0616 3.97 0.204 0.0975 6.81 7.6208 0.9669 2069197 IFLab1_006512 CCSc1nnc(CSc2ncccn2)n1CCc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M21 compound treatment 0.269 0.134 8.6 0.189 0.0825 5.76 10.1567 0.981 2069198 IFLab1_006513 Cc1ccc(C)c(c1)C(=O)C2=C(O)C(=O)N(CCc3ccccc3)C2c4ccc(O)cc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M22 compound treatment 0.102 -0.0334 -2.15 0.075 -0.0315 -2.2 -3.0754 -0.9999 2069199 IFLab1_006514 COc1cccc2c(=O)n(CC(=O)N3CCCCC3)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M23 mock treatment 0.12 -0.0154 -0.99 0.103 -0.0035 -0.24 -0.873 -0.856 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 M24 mock treatment 0.131 -0.00438 -0.28 0.11 0.0035 0.24 -0.0265 -0.0711 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N01 compound treatment 0.164 0.0286 1.84 0.137 0.0305 2.13 2.8091 0.9974 2069200 IFLab1_006515 Cn1cccc1Cc2nnc(SCC(=O)N)n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N02 mock treatment 0.165 0.0296 1.91 0.153 0.0465 3.25 3.645 0.9677 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N03 compound treatment 0.157 0.0216 1.39 0.149 0.0425 2.97 3.0833 0.9403 2069201 IFLab1_006516 Cc1[nH]c2ccccc2c1CCNCc3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N04 mock treatment 0.148 0.0126 0.81 0.134 0.0275 1.92 1.9327 0.9266 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N05 compound treatment 0.311 0.176 11.3 0.245 0.139 9.68 14.8346 0.997 2069202 IFLab1_006517 NNc1nc2cc3OCOc3cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N06 mock treatment 0.184 0.0486 3.13 0.106 -5.0E-4 -0.03 2.188 0.6992 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N07 compound treatment 0.148 0.0126 0.81 0.093 -0.0135 -0.94 -0.0926 -0.0744 1273015 IFLab1_006518 OC(=O)Cc1sc(NCC=C)nc1c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N08 mock treatment 0.166 0.0306 1.97 0.135 0.0285 1.99 2.8014 1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N09 mock treatment 0.154 0.0186 1.2 0.096 -0.0105 -0.73 0.3287 0.2339 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N10 mock treatment 0.175 0.0396 2.55 0.111 0.0045 0.31 2.0254 0.7883 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N11 mock treatment 0.141 0.00562 0.36 0.11 0.0035 0.24 0.4286 0.9818 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N12 mock treatment 0.15 0.0146 0.94 0.128 0.0215 1.5 1.7274 0.9746 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N13 mock treatment 0.143 0.00762 0.49 0.1 -0.0065 -0.45 0.0256 0.0384 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N14 mock treatment 0.129 -0.00638 -0.41 0.114 0.0075 0.52 0.08 0.1202 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N15 mock treatment 0.134 -0.00138 -0.09 0.115 0.0085 0.59 0.357 0.5946 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N16 mock treatment 0.126 -0.00938 -0.6 0.13 0.0235 1.64 0.7339 0.4195 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N17 mock treatment 0.138 0.00262 0.17 0.095 -0.0115 -0.8 -0.4489 -0.5469 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N18 mock treatment 0.135 -3.82E-4 -0.02 0.132 0.0255 1.78 1.2423 0.6973 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N19 mock treatment 0.117 -0.0184 -1.18 0.105 -0.0015 -0.1 -0.9107 -0.7667 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N20 mock treatment 0.117 -0.0184 -1.18 0.124 0.0175 1.22 0.0279 0.0164 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N21 mock treatment 0.102 -0.0334 -2.15 0.081 -0.0255 -1.78 -2.779 -0.9957 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N22 mock treatment 0.125 -0.0104 -0.67 0.111 0.0045 0.31 -0.2502 -0.3388 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N23 mock treatment 0.132 -0.00338 -0.22 0.108 0.0015 0.1 -0.0798 -0.3304 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 N24 mock treatment 0.11 -0.0254 -1.63 0.099 -0.0075 -0.52 -1.5257 -0.8893 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O01 compound treatment 0.115 -0.0204 -1.31 0.099 -0.0075 -0.52 -1.2981 -0.9189 2069203 IFLab1_006519 N#CCSc1nnc(c2cccs2)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O02 compound treatment 1.278 1.14 73.54 1.266 1.16 81.0 109.2813 0.9988 2069204 IFLab1_006520 C=CCNc1oc(Cc2cccc3ccccc23)nc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O03 compound treatment 0.158 0.0226 1.46 0.123 0.0165 1.15 1.8445 0.9933 1236685 IFLab1_006521 O=C(Nc1nc(cs1)c2ccccc2)c3cccc(c3)S(=O)(=O)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O04 compound treatment 0.531 0.396 25.46 0.428 0.322 22.46 33.8873 0.998 1224766 IFLab1_006522 Nc1c(oc2ccccc12)C(=O)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O05 compound treatment 0.142 0.00662 0.43 0.107 5.0E-4 0.03 0.3259 0.7625 2069205 IFLab1_006523 Cc1cccc(Cn2nnc(C(=O)Nc3ccc(Br)cc3)c2N)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O06 compound treatment 0.145 0.00962 0.62 0.105 -0.0015 -0.1 0.3636 0.5792 2069206 IFLab1_006524 Cc1cc(C)c(NC(=O)CN2C(=O)CSCC2=O)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O07 compound treatment 0.263 0.128 8.21 0.21 0.103 7.23 10.921 0.998 2069207 IFLab1_006525 Clc1ccc(cc1)S(=O)(=O)c2cc3cc(Br)ccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O08 compound treatment 0.189 0.0536 3.45 0.111 0.0045 0.31 2.6626 0.7683 2069208 IFLab1_006526 CCC1SC(CC)C(=O)N(CC(=O)NCc2ccccc2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O09 compound treatment 0.174 0.0386 2.49 0.095 -0.0115 -0.8 1.1895 0.4554 1360347 IFLab1_006527 O=C(N1CCc2ccccc12)c3ccc(cc3)S(=O)(=O)N4CCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O10 compound treatment 0.209 0.0736 4.74 0.15 0.0435 3.04 5.4994 0.9769 2069209 IFLab1_006528 CCOc1ccc(NC(=O)CN2C(=O)CSC(C)C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O11 compound treatment 0.211 0.0756 4.87 0.132 0.0255 1.78 4.7013 0.9071 2069210 IFLab1_006529 CCOC(=O)Cc1csc(=S)n1c2ccc(OC)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O12 compound treatment 0.15 0.0146 0.94 0.118 0.0115 0.8 1.2334 0.9969 2069211 IFLab1_006530 CSC1=NCCN1S(=O)(=O)c2ccc3ccccc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O13 compound treatment 0.226 0.0906 5.83 0.178 0.0715 4.99 7.6563 0.997 1870451 IFLab1_006531 CC(=O)OC1=C(C(N(C1=O)c2ccccn2)c3ccccc3)C(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O14 compound treatment 0.125 -0.0104 -0.67 0.095 -0.0115 -0.8 -1.0406 -0.9958 2069212 IFLab1_006532 CC(SC1=NCCN1S(=O)(=O)C)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O15 compound treatment 0.243 0.108 6.93 0.198 0.0915 6.39 9.418 0.9992 2069213 IFLab1_006533 CC1CCN(CC1)S(=O)(=O)c2ccc(cc2)c3csc(n3)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O16 compound treatment 0.147 0.0116 0.75 0.12 0.0135 0.94 1.1956 0.9934 2069214 IFLab1_006534 CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN=C2SCc3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O17 compound treatment 0.091 -0.0444 -2.86 0.082 -0.0245 -1.71 -3.2302 -0.97 2069215 IFLab1_006535 CC(Oc1ccc(Cl)c(C)c1)C(=O)N(Cc2ccccc2Cl)C3CCS(=O)(=O)C3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O18 compound treatment 0.086 -0.0494 -3.18 0.078 -0.0285 -1.99 -3.6554 -0.9746 2069216 IFLab1_006536 Oc1c(sc2ncnn12)C(N3CCCCC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O19 compound treatment 0.119 -0.0164 -1.05 0.08 -0.0265 -1.85 -2.0546 -0.9644 2069217 IFLab1_006537 CC1(C)C(C=C(Cl)Cl)C1C(=O)Nc2nnc(SCC=C)s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O20 compound treatment 0.191 0.0556 3.58 0.116 0.0095 0.66 3.0006 0.8242 2069218 IFLab1_006538 CCCSc1nnc(CSc2ncccn2)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O21 compound treatment 0.156 0.0206 1.33 0.15 0.0435 3.04 3.0872 0.931 2069219 IFLab1_006539 COCCN1C(c2c(oc3ccccc3c2=O)C1=O)c4cccc(OC)c4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O22 compound treatment 0.073 -0.0624 -4.02 0.064 -0.0425 -2.97 -4.9386 -0.989 2069220 IFLab1_006540 COc1cccc2c(=O)n(CC(=O)N3CCCc4ccccc34)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O23 mock treatment 0.117 -0.0184 -1.18 0.104 -0.0025 -0.17 -0.9601 -0.8028 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 O24 mock treatment 0.108 -0.0274 -1.76 0.095 -0.0115 -0.8 -1.8143 -0.9367 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P01 compound treatment 0.175 0.0396 2.55 0.168 0.0615 4.3 4.8411 0.969 2069221 IFLab1_006541 Cn1cccc1Cc2nnc(SCC(=O)Nc3ccccc3)n2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P02 mock treatment 0.17 0.0346 2.23 0.149 0.0425 2.97 3.675 0.99 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P03 compound treatment 0.1 -0.0354 -2.28 0.088 -0.0185 -1.29 -2.5242 -0.964 2069222 IFLab1_006542 Cc1[nH]c2ccccc2c1CCNCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P04 mock treatment 0.149 0.0136 0.88 0.096 -0.0105 -0.73 0.1011 0.0885 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P05 compound treatment 0.25 0.115 7.38 0.21 0.103 7.23 10.3293 0.9999 2069223 IFLab1_006543 NNc1nc2cc3OCCOc3cc2s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P06 mock treatment 0.159 0.0236 1.52 0.117 0.0105 0.73 1.5936 0.9441 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P07 mock treatment 0.163 0.0276 1.78 0.108 0.0015 0.1 1.3311 0.7475 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P08 mock treatment 0.134 -0.00138 -0.09 0.139 0.0325 2.27 1.5426 0.6789 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P09 mock treatment 0.102 -0.0334 -2.15 0.101 -0.0055 -0.38 -1.791 -0.8205 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P10 mock treatment 0.131 -0.00438 -0.28 0.12 0.0135 0.94 0.4674 0.4749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P11 mock treatment 0.124 -0.0114 -0.73 0.102 -0.0045 -0.31 -0.7403 -0.9286 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P12 mock treatment 0.151 0.0156 1.01 0.1 -0.0065 -0.45 0.3897 0.3533 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P13 mock treatment 0.122 -0.0134 -0.86 0.11 0.0035 0.24 -0.4362 -0.4871 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P14 mock treatment 0.159 0.0236 1.52 0.114 0.0075 0.52 1.4454 0.8989 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P15 mock treatment 0.099 -0.0364 -2.34 0.085 -0.0215 -1.5 -2.7179 -0.977 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P16 mock treatment 0.122 -0.0134 -0.86 0.104 -0.0025 -0.17 -0.7325 -0.8335 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P17 mock treatment 0.095 -0.0404 -2.6 0.098 -0.0085 -0.59 -2.2578 -0.8468 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P18 mock treatment 0.122 -0.0134 -0.86 0.105 -0.0015 -0.1 -0.6831 -0.7873 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P19 mock treatment 0.103 -0.0324 -2.08 0.107 5.0E-4 0.03 -1.4491 -0.6952 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P20 mock treatment 0.106 -0.0294 -1.89 0.108 0.0015 0.1 -1.2632 -0.6669 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P21 mock treatment 0.126 -0.00938 -0.6 0.091 -0.0155 -1.08 -1.1927 -0.962 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P22 mock treatment 0.114 -0.0214 -1.38 0.097 -0.0095 -0.66 -1.4424 -0.9441 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P23 mock treatment 0.124 -0.0114 -0.73 0.104 -0.0025 -0.17 -0.6415 -0.8518 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1430 P24 mock treatment 0.113 -0.0224 -1.44 0.095 -0.0115 -0.8 -1.5867 -0.962 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A01 compound treatment 0.078 0.00884 0.57 0.063 0.00178 0.12 0.4905 0.8418 1023263 Maybridge3_000001 OC(=O)c1ccc(Br)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A02 compound treatment 0.057 -0.0122 -0.78 0.07 0.00878 0.61 -0.1195 -0.1202 2075164 Maybridge3_000002 CC(C)(C)OC(=O)NC1CCN(CC1)c2nccc(n2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A03 compound treatment 0.06 -0.00916 -0.59 0.085 0.0238 1.66 0.758 0.43 2075165 Maybridge3_000003 CC(C)(C)OC(=O)N1CCC(N)(CC1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A04 compound treatment 0.09 0.0208 1.34 0.076 0.0148 1.03 1.6788 0.9916 1125505 Maybridge3_000004 CC(=O)Nc1ccc(cc1Cl)S(=O)(=O)N2CCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A05 compound treatment 0.106 0.0368 2.37 0.076 0.0148 1.03 2.407 0.9306 2075166 Maybridge3_000005 FC(F)(F)c1ccnc(SCC(=O)c2cccnc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A06 compound treatment 0.07 8.44E-4 0.05 0.066 0.00478 0.33 0.2746 0.8114 1209791 Maybridge3_000006 CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A07 compound treatment 0.06 -0.00916 -0.59 0.058 -0.00322 -0.22 -0.5757 -0.9127 2075167 Maybridge3_000007 OC(COc1ccc(F)cc1)CN2CCN(CC2)c3nccc(n3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A08 compound treatment 0.076 0.00684 0.44 0.07 0.00878 0.61 0.7453 0.9868 2075168 Maybridge3_000008 Fc1cccc(Cl)c1CN2CCN(CCCNc3nccc(n3)C(F)(F)F)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A09 compound treatment 0.081 0.0118 0.76 0.074 0.0128 0.89 1.1704 0.9969 2075169 Maybridge3_000009 CC(=O)Nc1ccc(cc1)c2csc(C)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A10 compound treatment 0.068 -0.00116 -0.07 0.072 0.0108 0.75 0.48 0.6341 1620264 Maybridge3_000010 Cc1nc(nc(N2CCCN(Cc3ccc(F)cc3)CC2)c1Cl)c4cccnc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A11 compound treatment 0.073 0.00384 0.25 0.082 0.0208 1.45 1.2015 0.8158 2075170 Maybridge3_000011 Cc1nc(ccc1c2nnc(SCc3cc(F)cc(F)c3)o2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A12 compound treatment 0.079 0.00984 0.63 0.073 0.0118 0.82 1.03 0.9916 2075171 Maybridge3_000012 Clc1cccc(c1Cl)S(=O)(=O)NCCCN2CCN(Cc3ccccc3)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A13 compound treatment 0.079 0.00984 0.63 0.071 0.00978 0.68 0.9312 0.9993 1658739 Maybridge3_000013 OC(CNC1CCN(Cc2ccccc2)CC1)CSc3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A14 compound treatment 0.056 -0.0132 -0.85 0.055 -0.00622 -0.43 -0.906 -0.9519 2075172 Maybridge3_000014 Clc1ccc(OCC(=O)NC2=NCCS2)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A15 compound treatment 1.325 1.26 80.83 1.308 1.25 87.1 118.746 0.9993 1464531 Maybridge3_000015 CCOC(=O)c1cc(C#N)c(C)nc1N(CC)CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A16 compound treatment 0.088 0.0188 1.21 0.071 0.00978 0.68 1.3408 0.9631 2075173 Maybridge3_000016 COc1cc(/C=N/c2cc(C)ccc2NC(=O)C)cc(OC)c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A17 compound treatment 0.07 8.44E-4 0.05 0.074 0.0128 0.89 0.6698 0.7487 2075174 Maybridge3_000017 FC(F)(F)c1ccnc(NCCNS(=O)(=O)c2ccccc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A18 compound treatment 0.102 0.0328 2.11 0.094 0.0328 2.29 3.1142 0.9992 1167525 Maybridge3_000018 OC(=O)CSC1(CCCCCC1)SCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A19 compound treatment 0.047 -0.0222 -1.43 0.05 -0.0112 -0.78 -1.5626 -0.9603 2075175 Maybridge3_000019 Cc1oc(cc1C(=O)O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A20 compound treatment 0.074 0.00484 0.31 0.078 0.0168 1.17 1.0494 0.8651 1575563 Maybridge3_000020 Cc1nc2cc(Cl)ccc2c(=O)n1c3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A21 compound treatment 0.079 0.00984 0.63 0.074 0.0128 0.89 1.0794 0.9859 2075176 Maybridge3_000021 Cc1nc(ccc1C(=O)NCc2ccccc2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A22 compound treatment 0.081 0.0118 0.76 0.084 0.0228 1.59 1.6644 0.9432 1510905 Maybridge3_000022 Clc1ccc(cc1)S(=O)(=O)N(CCc2ccccn2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A23 mock treatment 0.084 0.0148 0.96 0.061 -2.19E-4 -0.02 0.6648 0.6957 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 A24 mock treatment 0.067 -0.00216 -0.14 0.069 0.00778 0.54 0.2862 0.5102 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B01 compound treatment 0.877 0.808 52.0 0.746 0.685 47.84 70.5944 0.9991 2075177 Maybridge3_000023 Fc1cccc(NCc2ccc3OCOc3c2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B02 compound treatment 0.075 0.00584 0.38 0.071 0.00978 0.68 0.7491 0.9604 2075178 Maybridge3_000024 Brc1ccc(cc1)C2=CSc3ccccc3N2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B03 compound treatment 0.059 -0.0102 -0.65 0.061 -2.19E-4 -0.02 -0.473 -0.7234 2075179 Maybridge3_000025 Cn1nc(CC#N)c(C#N)c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B04 compound treatment 0.066 -0.00316 -0.2 0.055 -0.00622 -0.43 -0.4508 -0.9401 2075180 Maybridge3_000026 CCOc1ccccc1NC(=O)Oc2ccc(F)cc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B05 compound treatment 1.067 0.998 64.23 0.981 0.92 64.26 90.8504 1.0 2075181 Maybridge3_000027 COc1ccc(cc1)/C(=C/c2cccs2)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B06 compound treatment 0.631 0.562 36.16 0.623 0.562 39.25 53.3222 0.9992 1568831 Maybridge3_000028 Fc1cccc2nc(oc(=O)c12)c3cccnc3Oc4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B07 compound treatment 0.065 -0.00416 -0.27 0.061 -2.19E-4 -0.02 -0.2 -0.7463 1718012 Maybridge3_000029 COc1cc2CCNC(c3ccccc3)c2cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B08 compound treatment 0.069 -1.56E-4 -0.01 0.065 0.00378 0.26 0.1797 0.6797 2075182 Maybridge3_000030 COc1ccc(/N=C\2/NC(C)(C)C(=C)S2)c(OC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B09 compound treatment 0.068 -0.00116 -0.07 0.066 0.00478 0.33 0.1836 0.5364 1314153 Maybridge3_000031 Nc1cccc(Cl)c1Oc2ccc(cc2)S(=O)(=O)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B10 compound treatment 0.08 0.0108 0.7 0.07 0.00878 0.61 0.9273 0.9979 2075183 Maybridge3_000032 COC(=O)/C=C/1\S/C(=N\c2cccc(SC)c2)/N(C1=O)c3cccc(SC)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B11 compound treatment 1.416 1.35 86.69 1.429 1.37 95.55 128.8649 0.9988 1136610 Maybridge3_000033 O=C(Oc1ccccc1)c2cccnc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B12 compound treatment 0.072 0.00284 0.18 0.067 0.00578 0.4 0.415 0.9359 2075184 Maybridge3_000034 CC(=O)Nc1cc2cc(NC(=O)C(F)(F)F)ccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B13 compound treatment 0.572 0.503 32.37 0.38 0.319 22.27 38.6331 0.9834 1365408 Maybridge3_000035 Cc1ccc2cccc(OC(=O)c3cccnc3Oc4ccccc4)c2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B14 compound treatment 0.07 8.44E-4 0.05 0.065 0.00378 0.26 0.2252 0.835 2075185 Maybridge3_000036 FC(F)(F)C(=O)Nc1nnc(s1)C2CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B15 compound treatment 0.072 0.00284 0.18 0.067 0.00578 0.4 0.415 0.9359 2075186 Maybridge3_000037 CCOC(=O)C1=CNc2ccccc2N=C1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B16 compound treatment 0.068 -0.00116 -0.07 0.074 0.0128 0.89 0.5787 0.6459 1144609 Maybridge3_000038 Fc1ccc(NC(=O)Cc2ncon2)c(F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B17 compound treatment 0.053 -0.0162 -1.04 0.065 0.00378 0.26 -0.5485 -0.5112 2075187 Maybridge3_000039 CCOC(=O)c1cc(Cl)c(NC(=O)C(F)(F)F)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B18 compound treatment 0.066 -0.00316 -0.2 0.059 -0.00222 -0.16 -0.2533 -0.9911 2075188 Maybridge3_000040 Cn1c(nc(=O)c2ccccc12)c3cc(Br)cs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B19 compound treatment 0.712 0.643 41.38 0.571 0.51 35.61 54.44 0.9972 2075189 Maybridge3_000041 Fc1ccc(cc1Cl)C(=O)Nc2nnc(s2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B20 compound treatment 0.066 -0.00316 -0.2 0.07 0.00878 0.61 0.2901 0.449 2075190 Maybridge3_000042 CC(C)(C)c1nnc(N/C=N/O)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B21 compound treatment 0.078 0.00884 0.57 0.071 0.00978 0.68 0.8857 0.9959 2075191 Maybridge3_000043 C/C=C(\C)/c1nnc(NCC(C)(C)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B22 compound treatment 0.075 0.00584 0.38 0.228 0.167 11.65 8.5047 0.7296 1193479 Maybridge3_000044 O=C(NCC1CC1)c2ccccc2NC(=O)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B23 mock treatment 0.091 0.0218 1.41 0.084 0.0228 1.59 2.1195 0.9981 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 B24 mock treatment 0.069 -1.56E-4 -0.01 0.067 0.00578 0.4 0.2785 0.6893 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C01 compound treatment 0.06 -0.00916 -0.59 0.059 -0.00222 -0.16 -0.5263 -0.8637 342762 Maybridge3_000045 COc1ccc2[nH]cc(CCN(C)C)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C02 compound treatment 0.043 -0.0262 -1.68 0.042 -0.0192 -1.34 -2.1398 -0.9937 1121244 Maybridge3_000046 CCOC(=O)c1ccc(cc1)N2C(=O)CC3(CCCC3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C03 compound treatment 0.043 -0.0262 -1.68 0.045 -0.0162 -1.13 -1.9916 -0.9814 1252601 Maybridge3_000047 CCN(CC)S(=O)(=O)c1ccc(s1)c2csc(C)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C04 compound treatment 0.04 -0.0292 -1.88 0.04 -0.0212 -1.48 -2.3752 -0.9932 2075192 Maybridge3_000048 FC(F)(F)c1ccnc(n1)N2CCC(CC2)NC(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C05 compound treatment 0.09 0.0208 1.34 0.074 0.0128 0.89 1.58 0.9804 2075193 Maybridge3_000049 FC(F)(F)c1ccnc(SCC(=O)Nc2ccc(Br)cc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C06 compound treatment 0.124 0.0548 3.53 0.13 0.0688 4.81 5.8938 0.9885 1566490 Maybridge3_000050 CCN(CC)S(=O)(=O)c1ccc(N2C(=O)CC3(CCCC3)C2=O)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C07 compound treatment 0.079 0.00984 0.63 0.059 -0.00222 -0.16 0.3384 0.5188 1513220 Maybridge3_000051 CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C08 compound treatment 0.102 0.0328 2.11 0.08 0.0188 1.31 2.4226 0.9737 1121829 Maybridge3_000052 CC(=O)Nc1ccc(cc1Cl)S(=O)(=O)N2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C09 compound treatment 0.057 -0.0122 -0.78 0.055 -0.00622 -0.43 -0.8605 -0.9615 1309044 Maybridge3_000053 Cc1nc(cs1)c2ccc(s2)S(=O)(=O)N3CCN(Cc4ccccc4)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C10 compound treatment 0.45 0.381 24.51 0.569 0.508 35.47 42.4169 0.9837 1606977 Maybridge3_000054 COc1cccc(CC(=O)Nc2ccc(cc2)c3csc(C)n3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C11 compound treatment 0.497 0.428 27.54 0.503 0.442 30.86 41.2957 0.9984 2075194 Maybridge3_000055 Cc1nc(ccc1c2nnc(SCC=C)o2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C12 compound treatment 0.088 0.0188 1.21 0.068 0.00678 0.47 1.1926 0.9159 2075195 Maybridge3_000056 FC(F)(F)c1ccnc(n1)N2CCC(CC2)N3C(=O)CC4(CCCC4)C3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C13 compound treatment 0.239 0.17 10.93 0.174 0.113 7.88 13.3013 0.9871 2075196 Maybridge3_000057 Cc1nc(ccc1C(=O)Oc2ccc3OCOc3c2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C14 compound treatment 0.058 -0.0112 -0.72 0.05 -0.0112 -0.78 -1.0619 -0.999 2075197 Maybridge3_000058 O=C(Cc1ccccc1)NC2=NCCS2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C15 compound treatment 0.078 0.00884 0.57 0.071 0.00978 0.68 0.8857 0.9959 2075198 Maybridge3_000059 Cc1nc(ccc1C(=O)NCCc2cccs2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C16 compound treatment 0.069 -1.56E-4 -0.01 0.061 -2.19E-4 -0.02 -0.0179 -0.9794 2075199 Maybridge3_000060 CC(=O)Nc1ccc(C)cc1/N=C/c2ccc3OCOc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C17 compound treatment 0.081 0.0118 0.76 0.068 0.00678 0.47 0.874 0.9738 2075200 Maybridge3_000061 FC(F)(F)c1cccc(c1)C(=O)NCCNc2nccc(n2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C18 compound treatment 0.085 0.0158 1.02 0.077 0.0158 1.1 1.5007 0.9992 2075201 Maybridge3_000062 CS(=O)(=O)N1CCc2ccccc2C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C19 compound treatment 0.079 0.00984 0.63 0.081 0.0198 1.38 1.4252 0.9375 1199320 Maybridge3_000063 CCCc1cnc(nc1)N2CCCN(CC2)S(=O)(=O)c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C20 compound treatment 0.121 0.0518 3.34 0.123 0.0618 4.32 5.4115 0.9919 2075202 Maybridge3_000064 CCOC(=O)c1ccc(/N=C/c2ccccn2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C21 compound treatment 0.071 0.00184 0.12 0.071 0.00978 0.68 0.5671 0.8177 2075203 Maybridge3_000065 Cc1nc(ccc1C(=O)NCCNc2cccc(n2)C(F)(F)F)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C22 compound treatment 0.687 0.618 39.77 0.621 0.56 39.11 55.7721 1.0 2075204 Maybridge3_000066 C/C=C(\C)/C(=O)Nc1cc(C)ccc1n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C23 mock treatment 0.068 -0.00116 -0.07 0.062 7.81E-4 0.05 -0.014 -0.152 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 C24 mock treatment 0.069 -1.56E-4 -0.01 0.072 0.0108 0.75 0.5255 0.6976 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D01 compound treatment 0.058 -0.0112 -0.72 0.055 -0.00622 -0.43 -0.8149 -0.971 1722143 Maybridge3_000067 C(Cc1ccccn1)c2c[nH]c3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D02 compound treatment 0.041 -0.0282 -1.81 0.038 -0.0232 -1.62 -2.4284 -0.9985 1604322 Maybridge3_000068 Fc1ccccc1C(=O)NCC(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D03 compound treatment 0.038 -0.0312 -2.01 0.037 -0.0242 -1.69 -2.6144 -0.9964 2075205 Maybridge3_000069 Oc1c(Cl)cc(Cl)cc1/C=N/c2c(C#N)c(CC#N)nn2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D04 compound treatment 0.045 -0.0242 -1.55 0.044 -0.0172 -1.2 -1.95 -0.992 2075206 Maybridge3_000070 Fc1ccc(OC(=O)c2cc3ccccc3s2)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D05 compound treatment 0.171 0.102 6.56 0.149 0.0878 6.13 8.9715 0.9994 2075207 Maybridge3_000071 Cc1ccc(cc1)/C(=C/c2c(F)cccc2Cl)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D06 compound treatment 0.062 -0.00716 -0.46 0.058 -0.00322 -0.22 -0.4847 -0.9456 2075208 Maybridge3_000072 Fc1cccc2nc(oc(=O)c12)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D07 compound treatment 0.104 0.0348 2.24 0.092 0.0308 2.15 3.1064 0.9998 2075209 Maybridge3_000073 FC(F)(F)C(=O)Nc1ccc(Br)cc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D08 compound treatment 0.09 0.0208 1.34 0.08 0.0188 1.31 1.8764 0.9999 2075210 Maybridge3_000074 CC(=O)Nc1ccc(F)cc1Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D09 compound treatment 0.195 0.126 8.1 0.141 0.0798 5.57 9.6686 0.9834 1718995 Maybridge3_000075 COc1ccc2cc(oc2c1)C(=O)c3ccc(Cl)c(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D10 compound treatment 0.076 0.00684 0.44 0.065 0.00378 0.26 0.4983 0.9701 2075211 Maybridge3_000076 Cc1ncc(CSc2nccc(O)n2)c(CO)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D11 compound treatment 0.077 0.00784 0.5 0.064 0.00278 0.19 0.4944 0.9139 1104602 Maybridge3_000077 COC1(C)CNc2ccccc2C(=O)N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D12 compound treatment 0.056 -0.0132 -0.85 0.053 -0.00822 -0.57 -1.0048 -0.9821 2075212 Maybridge3_000078 COC(=O)/C=C/1\S/C(=N\c2ccccn2)/N(C1=O)c3cccc(c3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D13 compound treatment 0.044 -0.0252 -1.62 0.043 -0.0182 -1.27 -2.0449 -0.9929 1064547 Maybridge3_000079 Cc1ccc(cc1)C(=O)CCN2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D14 compound treatment 0.066 -0.00316 -0.2 0.061 -2.19E-4 -0.02 -0.1545 -0.7582 1517249 Maybridge3_000080 Fc1cccc(CSc2ncc3ccccn23)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D15 compound treatment 0.042 -0.0272 -1.75 0.041 -0.0202 -1.41 -2.2347 -0.9944 1223097 Maybridge3_000081 Cn1sc(=O)c2ccc(cc12)S(=O)(=O)NCCc3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D16 compound treatment 0.099 0.0298 1.92 0.09 0.0288 2.01 2.78 0.9997 1283484 Maybridge3_000082 O=c1c2cccnc2oc3ccc(cc13)n4cccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D17 compound treatment 0.088 0.0188 1.21 0.085 0.0238 1.66 2.0324 0.988 2075213 Maybridge3_000083 Cc1onc(c1C(=O)NCCSC2=NCCN2)c3c(Cl)cccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D18 compound treatment 0.115 0.0458 2.95 0.115 0.0538 3.76 4.7432 0.9929 2075214 Maybridge3_000084 Brc1csc(c1)c2nc(=O)c3ccccc3[nH]2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D19 compound treatment 0.091 0.0218 1.41 0.08 0.0188 1.31 1.9219 0.9994 2075215 Maybridge3_000085 CC(=Cc1nc2cccc(F)c2c(=O)o1)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D20 compound treatment 0.069 -1.56E-4 -0.01 0.064 0.00278 0.19 0.1303 0.6696 1322517 Maybridge3_000086 Fc1ccc(NC(=O)Cc2nn[nH]n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D21 compound treatment 0.062 -0.00716 -0.46 0.066 0.00478 0.33 -0.0895 -0.1573 2075216 Maybridge3_000087 Cc1nnc(NCC(C)(C)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D22 compound treatment 0.053 -0.0162 -1.04 0.047 -0.0142 -0.99 -1.4377 -0.9997 2075217 Maybridge3_000088 CCCc1ccc(cc1)c2ccc(cc2)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D23 mock treatment 0.086 0.0168 1.08 0.067 0.00578 0.4 1.0522 0.9095 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 D24 mock treatment 0.075 0.00584 0.38 0.067 0.00578 0.4 0.5516 0.9994 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E01 compound treatment 0.059 -0.0102 -0.65 0.057 -0.00422 -0.29 -0.6706 -0.9352 1050973 Maybridge3_000089 Cc1ccc2[nH]cc(CCN)c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E02 compound treatment 0.05 -0.0192 -1.23 0.045 -0.0162 -1.13 -1.673 -0.9991 2075218 Maybridge3_000090 Brc1ccc(cc1)N2C(=O)CC3(CCCC3)C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E03 compound treatment 0.043 -0.0262 -1.68 0.043 -0.0182 -1.27 -2.0904 -0.9905 1123698 Maybridge3_000091 Cc1nc(cs1)c2ccc(s2)S(=O)(=O)NCc3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E04 compound treatment 0.296 0.227 14.6 0.429 0.368 25.69 28.4921 0.9641 1231775 Maybridge3_000092 CCOC(=O)c1c(NC(=O)CCC(=O)O)sc(C)c1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E05 compound treatment 0.074 0.00484 0.31 0.067 0.00578 0.4 0.506 0.9918 2075219 Maybridge3_000093 OC(=O)CSCC(=O)Nc1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E06 compound treatment 0.263 0.194 12.48 0.197 0.136 9.49 15.5298 0.9909 1696466 Maybridge3_000094 Clc1cc(ccc1N2C(=O)CC3(CCCC3)C2=O)S(=O)(=O)N4CCSCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E07 compound treatment 0.268 0.199 12.8 0.258 0.197 13.75 18.7706 0.9994 1470375 Maybridge3_000095 Clc1cccc(c1Cl)S(=O)(=O)N2CCCN(CC2)C(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E08 compound treatment 0.081 0.0118 0.76 0.075 0.0138 0.96 1.2198 0.9933 2075220 Maybridge3_000096 OC(COc1ccc(/N=C/c2ccc(Cl)cc2)cc1)CN3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E09 compound treatment 0.5 0.431 27.73 0.444 0.383 26.74 38.5177 0.9998 1589430 Maybridge3_000097 Cc1nc(cs1)c2ccc(s2)S(=O)(=O)N3CCCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E10 compound treatment 0.312 0.243 15.63 0.416 0.355 24.78 28.5781 0.9753 2075221 Maybridge3_000098 FC(F)(F)c1ccnc(Oc2ccc(I)cc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E11 compound treatment 0.08 0.0108 0.7 0.069 0.00778 0.54 0.8779 0.9924 1678944 Maybridge3_000099 Clc1ccc(CN2CCCNCC2)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E12 compound treatment 0.092 0.0228 1.47 0.075 0.0138 0.96 1.7205 0.9789 2075222 Maybridge3_000100 FC(F)(F)c1ccnc(n1)N2CCC(CC2)C(=O)N3CCSCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E13 compound treatment 0.06 -0.00916 -0.59 0.051 -0.0102 -0.71 -0.9215 -0.9955 1517901 Maybridge3_000101 OC(COc1ccc(Cl)c(Cl)c1)CN2CCC(O)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E14 compound treatment 0.101 0.0318 2.05 0.106 0.0448 3.13 3.6614 0.979 2075223 Maybridge3_000102 COc1cc(/C=C/2\CCCCC2=O)cc(OC)c1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E15 compound treatment 0.075 0.00584 0.38 0.064 0.00278 0.19 0.4034 0.9528 2075224 Maybridge3_000103 CCOC(=O)c1cc(/C(=N/O)/N)c(C)nc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E16 compound treatment 0.066 -0.00316 -0.2 0.067 0.00578 0.4 0.1419 0.3139 2075225 Maybridge3_000104 CC(=O)Nc1ccc(C)cc1/N=C/c2ccncc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E17 compound treatment 0.078 0.00884 0.57 0.073 0.0118 0.82 0.9845 0.9838 1127707 Maybridge3_000105 Cc1cc(Cl)cc(Br)c1OCC(O)CNCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E18 compound treatment 0.073 0.00384 0.25 0.057 -0.00422 -0.29 -0.0335 -0.087 2075226 Maybridge3_000106 CCOC(=O)/C(=C(/C)\Nc1ccc(F)cc1)/C2CC(=O)N(C2=O)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E19 compound treatment 0.09 0.0208 1.34 0.065 0.00378 0.26 1.1354 0.8304 2075227 Maybridge3_000107 COC(=O)c1sccc1Oc2nccc(n2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E20 compound treatment 0.043 -0.0262 -1.68 0.047 -0.0142 -0.99 -1.8928 -0.9683 2075228 Maybridge3_000108 Oc1ccc(Br)cc1/C=N/c2ccc3[nH]nnc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E21 compound treatment 0.066 -0.00316 -0.2 0.055 -0.00622 -0.43 -0.4508 -0.9401 2075229 Maybridge3_000109 Cc1nc(ccc1C(=O)N2CCCCC2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E22 compound treatment 0.097 0.0278 1.79 0.077 0.0158 1.1 2.0468 0.9728 2075230 Maybridge3_000110 C/C=C(\C)/C(=O)Nc1ccc(cc1)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E23 mock treatment 0.079 0.00984 0.63 0.061 -2.19E-4 -0.02 0.4372 0.6899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 E24 mock treatment 0.071 0.00184 0.12 0.079 0.0178 1.24 0.9623 0.7711 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F01 compound treatment 0.064 -0.00516 -0.33 0.059 -0.00222 -0.16 -0.3443 -0.9399 1295702 Maybridge3_000111 Cc1cc(C)c(NC(=O)CSCc2cnc(C)c(O)c2CO)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F02 compound treatment 0.057 -0.0122 -0.78 0.046 -0.0152 -1.06 -1.305 -0.9886 1449189 Maybridge3_000112 Cc1ccccc1C(=O)NCC(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F03 compound treatment 0.105 0.0358 2.31 0.055 -0.00622 -0.43 1.3242 0.564 2075231 Maybridge3_000113 Cn1ncc(C#N)c1n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F04 compound treatment 0.282 0.213 13.7 0.197 0.136 9.49 16.3945 0.9839 2075232 Maybridge3_000114 COc1ccccc1Oc2ccc(cc2N)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F05 compound treatment 0.075 0.00584 0.38 0.068 0.00678 0.47 0.6009 0.9935 2075233 Maybridge3_000115 COC(=O)C1SC/C(=N\O)/C1C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F06 compound treatment 0.097 0.0278 1.79 0.08 0.0188 1.31 2.195 0.9883 1209945 Maybridge3_000116 Fc1ccc(cc1Cl)c2nc3cccc(F)c3c(=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F07 compound treatment 0.308 0.239 15.37 0.243 0.182 12.7 19.8502 0.9955 1422600 Maybridge3_000117 Clc1c(sc2ccccc12)C(=O)NCC3CCC(CC3)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F08 compound treatment 0.057 -0.0122 -0.78 0.056 -0.00522 -0.36 -0.8111 -0.9396 2075234 Maybridge3_000118 Clc1cccc2nc(oc(=O)c12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F09 compound treatment 0.038 -0.0312 -2.01 0.039 -0.0222 -1.55 -2.5156 -0.992 2075235 Maybridge3_000119 Cc1cc(ccc1Cl)C(=O)CSC#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F10 compound treatment 0.078 0.00884 0.57 0.072 0.0108 0.75 0.9351 0.9905 1399737 Maybridge3_000120 CC(=O)Nc1cc2cc(NC(=O)c3c(F)cccc3F)ccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F11 compound treatment 0.148 0.0788 5.07 0.135 0.0738 5.15 7.2331 1.0 2075236 Maybridge3_000121 Nc1ccc(c(C#N)c1)n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F12 compound treatment 0.073 0.00384 0.25 0.06 -0.00122 -0.09 0.1147 0.4385 2075237 Maybridge3_000122 COC(=O)/C=C/1\S/C(=N\c2ccccn2)/N(C1=O)c3cccc(SC)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F13 compound treatment 0.04 -0.0292 -1.88 0.039 -0.0222 -1.55 -2.4246 -0.9956 1012037 Maybridge3_000123 O=C(CCN1CCCCC1)c2ccc(cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F14 compound treatment 0.346 0.277 17.82 0.32 0.259 18.08 25.3833 1.0 2075238 Maybridge3_000124 CCc1nc2cc(cc(Cl)c2nc1CC)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F15 compound treatment 0.067 -0.00216 -0.14 0.065 0.00378 0.26 0.0887 0.2971 1917196 Maybridge3_000125 FC(F)(F)C(=O)NCCc1ccncc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F16 compound treatment 0.047 -0.0222 -1.43 0.046 -0.0152 -1.06 -1.7602 -0.9895 2075239 Maybridge3_000126 Clc1ccc2OC(Nc2c1)c3ccc(C#N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F17 compound treatment 0.109 0.0398 2.56 0.089 0.0278 1.94 3.1858 0.9906 2075240 Maybridge3_000127 O=C(NCCSC1=NCCN1)c2cccnc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F18 compound treatment 0.071 0.00184 0.12 0.064 0.00278 0.19 0.2213 0.972 1172488 Maybridge3_000128 O=c1nc([nH]c2ccccc12)c3ccc(C#N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F19 compound treatment 0.092 0.0228 1.47 0.071 0.00978 0.68 1.5229 0.9392 1505028 Maybridge3_000129 OC(=O)c1c(F)cccc1NC(=O)COc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F20 compound treatment 0.085 0.0158 1.02 0.069 0.00778 0.54 1.1055 0.9566 1261208 Maybridge3_000130 Cc1ccc(NC(=O)Cc2nn[nH]n2)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F21 compound treatment 0.055 -0.0142 -0.91 0.07 0.00878 0.61 -0.2105 -0.1916 2075241 Maybridge3_000131 CC(C)c1nnc(NCC(C)(C)C)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F22 compound treatment 0.191 0.122 7.84 0.218 0.157 10.95 13.2902 0.9866 2075242 Maybridge3_000132 Cc1cc(c(Cl)cc1Cl)S(=O)(=O)n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F23 mock treatment 0.087 0.0178 1.15 0.067 0.00578 0.4 1.0977 0.9016 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 F24 mock treatment 0.077 0.00784 0.5 0.054 -0.00722 -0.5 4.0E-4 6.0E-4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G01 compound treatment 0.071 0.00184 0.12 0.064 0.00278 0.19 0.2213 0.972 2075243 Maybridge3_000133 Oc1ccc(cc1)n2cncn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G02 compound treatment 0.113 0.0438 2.82 0.087 0.0258 1.8 3.269 0.9765 1484820 Maybridge3_000134 NCCNc1ncnc2scc(c3ccccc3)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G03 compound treatment 0.077 0.00784 0.5 0.068 0.00678 0.47 0.692 0.9995 2075244 Maybridge3_000135 c1csc(c1)c2cc[nH]n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G04 compound treatment 0.109 0.0398 2.56 0.08 0.0188 1.31 2.7412 0.9516 1368451 Maybridge3_000136 CCOC(=O)c1c(sc(C)c1c2ccccc2)N3C(=O)CCC3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G05 compound treatment 0.083 0.0138 0.89 0.091 0.0298 2.08 2.1012 0.9284 2075245 Maybridge3_000137 COc1ccc(CCNCC(O)Cn2ccc3ccccc23)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G06 compound treatment 0.123 0.0538 3.47 0.111 0.0498 3.48 4.9097 1.0 1139862 Maybridge3_000138 Clc1cc(ccc1N2C(=O)CC3(CCCC3)C2=O)S(=O)(=O)NC4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G07 compound treatment 0.082 0.0128 0.83 0.072 0.0108 0.75 1.1171 0.9989 1263570 Maybridge3_000139 OC(COc1ccc(Cl)c(Cl)c1)CN2CCCN(CC2)C(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G08 compound treatment 0.146 0.0768 4.95 0.106 0.0448 3.13 5.7095 0.9756 1720104 Maybridge3_000140 CC(O)CNc1ncnc2scc(c3ccccc3)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G09 compound treatment 0.124 0.0548 3.53 0.107 0.0458 3.2 4.7576 0.9988 1618125 Maybridge3_000141 Cc1nc(cs1)c2ccc(s2)S(=O)(=O)NCc3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G10 compound treatment 0.281 0.212 13.64 0.185 0.124 8.65 15.7562 0.9758 2075246 Maybridge3_000142 CCCc1cnc(nc1)N2CCSCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G11 compound treatment 0.142 0.0728 4.69 0.136 0.0748 5.22 7.0094 0.9985 1463644 Maybridge3_000143 Cc1nc(cs1)c2ccc(s2)S(=O)(=O)NCC3CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G12 compound treatment 0.068 -0.00116 -0.07 0.066 0.00478 0.33 0.1836 0.5364 2075247 Maybridge3_000144 FC(F)(F)c1ccnc(n1)N2CCC(CC2)C(=O)NC3CCN(Cc4ccccc4)CC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G13 compound treatment 0.055 -0.0142 -0.91 0.06 -0.00122 -0.09 -0.7045 -0.7698 2075248 Maybridge3_000145 Cc1nc(ccc1NC(=O)/C=C/C(=O)O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G14 compound treatment 0.08 0.0108 0.7 0.073 0.0118 0.82 1.0755 0.9966 2075249 Maybridge3_000146 CC(=O)NS(=O)(=O)c1ccc(/N=C/c2ccccc2O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G15 compound treatment 0.751 0.682 43.89 0.759 0.698 48.75 65.5019 0.9986 1530311 Maybridge3_000147 COC(=O)c1ccc(nc1C)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G16 compound treatment 0.064 -0.00516 -0.33 0.066 0.00478 0.33 0.0015 0.0032 1918878 Maybridge3_000148 COc1cc(/C=N/Cc2ccccc2)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G17 compound treatment 0.061 -0.00816 -0.52 0.058 -0.00322 -0.22 -0.5302 -0.9284 1704746 Maybridge3_000149 Cc1ccc(OCC(O)CNCc2ccccc2)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G18 compound treatment 0.078 0.00884 0.57 0.057 -0.00422 -0.29 0.1941 0.3028 2075250 Maybridge3_000150 COc1ccc(/C=N/c2cc(NS(=O)(=O)C)ccc2C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G19 compound treatment 0.062 -0.00716 -0.46 0.063 0.00178 0.12 -0.2377 -0.4982 2075251 Maybridge3_000151 OC(CSc1ccccc1)CN2CCC(CC2)Nc3nccc(n3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G20 compound treatment 0.094 0.0248 1.6 0.078 0.0168 1.17 1.9597 0.9884 1431187 Maybridge3_000152 Cc1onc(c1C(=O)Nc2ccc(cc2)N3CCOCC3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G21 compound treatment 0.071 0.00184 0.12 0.063 0.00178 0.12 0.1719 0.9997 2075252 Maybridge3_000153 OC(COc1ccc(Cl)c(Cl)c1)CN2CCC(CC2)Nc3nccc(n3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G22 compound treatment 1.345 1.28 82.12 1.348 1.29 89.89 121.6322 0.999 2075253 Maybridge3_000154 C/C=C(\C)/C(=O)Nc1ccc(Cl)cc1C(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G23 mock treatment 0.076 0.00684 0.44 0.061 -2.19E-4 -0.02 0.3007 0.6822 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 G24 mock treatment 0.073 0.00384 0.25 0.059 -0.00222 -0.16 0.0653 0.2238 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H01 compound treatment 0.087 0.0178 1.15 0.089 0.0278 1.94 2.1845 0.9687 2075254 Maybridge3_000155 Cc1ncc(CSCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c(CO)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H02 compound treatment 0.165 0.0958 6.17 0.138 0.0768 5.36 8.155 0.9976 2075255 Maybridge3_000156 Fc1ccccc1c2ncc(o2)c3ccc(Br)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H03 compound treatment 0.08 0.0108 0.7 0.067 0.00578 0.4 0.7791 0.9662 2075256 Maybridge3_000157 CC1ONC(=N1)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H04 compound treatment 0.089 0.0198 1.28 0.083 0.0218 1.52 1.9791 0.9962 1588151 Maybridge3_000158 COc1ccc(OC)c(c1)S(=O)(=O)NC2CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H05 compound treatment 0.112 0.0428 2.76 0.106 0.0448 3.13 4.1621 0.998 1381483 Maybridge3_000159 Nc1cc(Cl)c(cc1N2CCOCC2)N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H06 compound treatment 0.34 0.271 17.43 0.259 0.198 13.82 22.097 0.9934 1540229 Maybridge3_000160 CC(C)(C)NC(=O)c1cc2ccccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H07 compound treatment 0.079 0.00984 0.63 0.05 -0.0112 -0.78 -0.1062 -0.1053 2075257 Maybridge3_000161 Nc1cc(ccc1Oc2ccc(Cl)cc2Cl)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H08 compound treatment 0.206 0.137 8.81 0.177 0.116 8.09 11.9476 0.9991 2075258 Maybridge3_000162 FC(F)(F)c1cccc(c1)c2nc3cccc(Cl)c3c(=O)o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H09 compound treatment 0.282 0.213 13.7 0.237 0.176 12.28 18.3704 0.9985 2075259 Maybridge3_000163 COc1ccc2ncc(nc2c1)c3ccc(Cl)c(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H10 compound treatment 0.06 -0.00916 -0.59 0.059 -0.00222 -0.16 -0.5263 -0.8637 2075260 Maybridge3_000164 Cc1cccc(/N=C/2\NC(C)(C)C(=C)S2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H11 compound treatment 0.723 0.654 42.08 0.759 0.698 48.75 64.2276 0.9973 2075261 Maybridge3_000165 COc1cccc(C)c1OC(=O)c2cc(F)cc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H12 compound treatment 0.077 0.00784 0.5 0.071 0.00978 0.68 0.8402 0.9889 2075262 Maybridge3_000166 COC(=O)/C=C/1\S/C(=N\c2ccccn2)/N(C1=O)c3ccc(C)c(C)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H13 compound treatment 0.084 0.0148 0.96 0.08 0.0188 1.31 1.6033 0.9879 2075263 Maybridge3_000167 Clc1c(sc2ccccc12)C(=O)Nc3ccc(Br)cn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H14 compound treatment 0.082 0.0128 0.83 0.093 0.0318 2.22 2.1545 0.9094 2075264 Maybridge3_000168 COC(=O)c1sc2ccccc2c1OC(=O)c3ccccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H15 compound treatment 0.206 0.137 8.81 0.161 0.0998 6.97 11.1572 0.9933 1591924 Maybridge3_000169 O=C(CSc1ccccc1)NCc2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H16 compound treatment 0.182 0.113 7.26 0.156 0.0948 6.62 9.8179 0.9989 2075265 Maybridge3_000170 Fc1ccc2nc(cnc2c1)c3ccc(Cl)c(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H17 compound treatment 0.092 0.0228 1.47 0.086 0.0248 1.73 2.2638 0.9967 2075266 Maybridge3_000171 Cc1nn(nc1C(=O)Nc2cc(Cl)cc(Cl)c2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H18 compound treatment 0.078 0.00884 0.57 0.061 -2.19E-4 -0.02 0.3917 0.6879 1188919 Maybridge3_000172 Cc1cc(NS(=O)(=O)c2ccc(C)cc2)no1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H19 compound treatment 0.091 0.0218 1.41 0.075 0.0138 0.96 1.6749 0.9829 2075267 Maybridge3_000173 Fc1cccc2nc(oc(=O)c12)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H20 compound treatment 0.063 -0.00616 -0.4 0.065 0.00378 0.26 -0.0934 -0.1961 2075268 Maybridge3_000174 COC(=O)CSc1cc(C)c(Cl)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H21 compound treatment 0.07 8.44E-4 0.05 0.061 -2.19E-4 -0.02 0.0276 0.4891 2075269 Maybridge3_000175 COc1ccc(cc1OC)S(=O)(=O)Nc2c(F)cc(F)cc2Br 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H22 compound treatment 0.044 -0.0252 -1.62 0.043 -0.0182 -1.27 -2.0449 -0.9929 1710792 Maybridge3_000176 COC(=O)c1sccc1OC(=O)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H23 mock treatment 0.079 0.00984 0.63 0.054 -0.00722 -0.5 0.0914 0.1129 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 H24 mock treatment 0.072 0.00284 0.18 0.065 0.00378 0.26 0.3162 0.9839 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I01 compound treatment 0.088 0.0188 1.21 0.093 0.0318 2.22 2.4276 0.9595 1055531 Maybridge3_000177 OCc1c(F)c(F)c(F)c(F)c1F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I02 compound treatment 0.085 0.0158 1.02 0.08 0.0188 1.31 1.6489 0.9922 1169015 Maybridge3_000178 O=C(N1CCCN(Cc2cccc3ccccc23)CC1)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I03 compound treatment 0.063 -0.00616 -0.4 0.059 -0.00222 -0.16 -0.3898 -0.9161 2075270 Maybridge3_000179 OC(=O)c1ccccc1C(=O)Nc2ccc(cc2)n3nccc3C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I04 compound treatment 0.119 0.0498 3.21 0.093 0.0318 2.22 3.8385 0.9838 2075271 Maybridge3_000180 O=C(NCCNc1ncnc2scc(c3ccccc3)c12)c4cccs4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I05 compound treatment 0.106 0.0368 2.37 0.18 0.119 8.3 7.5445 0.8742 1317957 Maybridge3_000181 COc1ccc(Cc2noc(N)n2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I06 compound treatment 0.103 0.0338 2.18 0.096 0.0348 2.43 3.2585 0.9985 1185792 Maybridge3_000182 CC(C)(C)NS(=O)(=O)c1ccc(N2C(=O)CC3(CCCC3)C2=O)c(Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I07 compound treatment 0.139 0.0698 4.5 0.128 0.0668 4.67 6.4777 0.9998 2075272 Maybridge3_000183 OC(COc1ccc(OC(F)(F)F)cc1)CS(=O)(=O)Cc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I08 compound treatment 0.163 0.0938 6.04 0.132 0.0708 4.94 7.7676 0.9951 1465029 Maybridge3_000184 Cc1ccc(cc1)c2csc3ncnc(N4CCNCC4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I09 compound treatment 0.11 0.0408 2.63 0.095 0.0338 2.36 3.5277 0.9985 1557263 Maybridge3_000185 Cc1nc(cs1)c2ccc(s2)S(=O)(=O)NCc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I10 compound treatment 0.108 0.0388 2.5 0.1 0.0388 2.71 3.6836 0.9992 2075273 Maybridge3_000186 Oc1ncnc2scc(c3ccc4ccccc4c3)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I11 compound treatment 0.124 0.0548 3.53 0.109 0.0478 3.34 4.8564 0.9996 2075274 Maybridge3_000187 CC(C)c1csc2nc[nH]c(=O)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I12 compound treatment 0.114 0.0448 2.89 0.119 0.0578 4.04 4.8953 0.9865 2075275 Maybridge3_000188 CC(O)C/N=C(\C)/c1cc(Cl)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I13 compound treatment 0.098 0.0288 1.86 0.083 0.0218 1.52 2.3887 0.9951 2075276 Maybridge3_000189 NC(=O)c1ccc([nH]c1=O)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I14 compound treatment 0.433 0.364 23.42 0.273 0.212 14.8 27.0212 0.9755 1310718 Maybridge3_000190 Clc1c(sc2ccccc12)C(=O)N(CCC#N)C3CCCCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I15 compound treatment 1.493 1.42 91.65 1.453 1.39 97.23 133.555 0.9996 1523218 Maybridge3_000191 CCOC(=O)c1cc(C#N)c(C)nc1NCC=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I16 compound treatment 0.056 -0.0132 -0.85 0.055 -0.00622 -0.43 -0.906 -0.9519 2075277 Maybridge3_000192 COc1cccc(/C=N/c2ccccc2C(=O)Nc3ccc(F)cc3)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I17 compound treatment 0.078 0.00884 0.57 0.071 0.00978 0.68 0.8857 0.9959 1376595 Maybridge3_000193 Cc1ccc(OCC(O)CNCc2ccco2)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I18 compound treatment 0.07 8.44E-4 0.05 0.07 0.00878 0.61 0.4722 0.7667 2075278 Maybridge3_000194 CCOC(=O)/C(=C(/C)\N)/C1CC(=O)N(C1=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I19 compound treatment 0.072 0.00284 0.18 0.072 0.0108 0.75 0.662 0.8541 2075279 Maybridge3_000195 C(Oc1cccnc1)C2=NCCN2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I20 compound treatment 0.067 -0.00216 -0.14 0.055 -0.00622 -0.43 -0.4053 -0.8888 1152459 Maybridge3_000196 CC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I21 compound treatment 0.07 8.44E-4 0.05 0.076 0.0148 1.03 0.7686 0.7433 2075280 Maybridge3_000197 FC(F)(F)c1ccnc(Sc2ccccc2NC(=O)CSc3ccccn3)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I22 compound treatment 0.076 0.00684 0.44 0.075 0.0138 0.96 0.9923 0.9372 1061675 Maybridge3_000198 CNc1ccc(Cl)cc1C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I23 mock treatment 0.07 8.44E-4 0.05 0.056 -0.00522 -0.36 -0.2194 -0.5952 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 I24 mock treatment 0.072 0.00284 0.18 0.062 7.81E-4 0.05 0.168 0.8797 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J01 compound treatment 0.078 0.00884 0.57 0.09 0.0288 2.01 1.8243 0.873 1327006 Maybridge3_000199 COc1ccccc1NC(=O)CSCc2cnc(C)c(O)c2CO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J02 compound treatment 0.231 0.162 10.42 0.196 0.135 9.42 14.024 0.9987 2075281 Maybridge3_000200 Fc1ccccc1c2ncc(o2)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J03 compound treatment 0.341 0.272 17.5 0.255 0.194 13.54 21.9449 0.992 2075282 Maybridge3_000201 Fc1ccc(NC(=O)CCc2nc(no2)c3ccc(Cl)cc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J04 compound treatment 0.095 0.0258 1.66 0.078 0.0168 1.17 2.0052 0.9853 2075283 Maybridge3_000202 Clc1cc(Cl)cc(c1)C(=O)NC2CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J05 compound treatment 0.102 0.0328 2.11 0.091 0.0298 2.08 2.966 1.0 1160752 Maybridge3_000203 Clc1ccc(cc1)c2csc(=N)n2c3ccccc3N4CCOCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J06 compound treatment 0.238 0.169 10.87 0.21 0.149 10.39 15.0341 0.9998 1382622 Maybridge3_000204 O=C(NC1CC1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J07 compound treatment 0.123 0.0538 3.47 0.09 0.0288 2.01 3.8723 0.9665 1163772 Maybridge3_000205 CS(=O)(=O)N(c1cccc(C#N)c1)S(=O)(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J08 compound treatment 0.095 0.0258 1.66 0.107 0.0458 3.2 3.4377 0.9536 2075284 Maybridge3_000206 Fc1cc(Br)c(c(Br)c1)n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J09 compound treatment 0.167 0.0978 6.3 0.138 0.0768 5.36 8.246 0.9968 1391249 Maybridge3_000207 Nc1nc(nc2n(ncc12)c3ccccc3)c4ccncc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J10 compound treatment 0.231 0.162 10.42 0.156 0.0948 6.62 12.048 0.9761 1664843 Maybridge3_000208 Nc1ccc(Cl)cc1C(=O)NCCc2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J11 compound treatment 0.772 0.703 45.24 0.729 0.668 46.65 64.9758 0.9999 1510127 Maybridge3_000209 CCOC(=O)c1cc(OC)ccc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J12 compound treatment 0.068 -0.00116 -0.07 0.067 0.00578 0.4 0.233 0.5673 1404519 Maybridge3_000210 Cc1cc(Oc2c(C)cccc2C)c3ccccc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J13 compound treatment 0.057 -0.0122 -0.78 0.057 -0.00422 -0.29 -0.7617 -0.911 1397748 Maybridge3_000211 OC(CCN1CCCCC1)c2ccc(cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J14 compound treatment 0.198 0.129 8.29 0.27 0.209 14.59 16.1775 0.9642 2075285 Maybridge3_000212 COC(=O)c1sc2ccccc2c1OC(=O)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J15 compound treatment 0.112 0.0428 2.76 0.096 0.0348 2.43 3.6681 0.998 1205036 Maybridge3_000213 Cc1ccc(SCC(=O)NCc2cccs2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J16 compound treatment 0.269 0.2 12.86 0.207 0.146 10.18 16.2968 0.9933 1714158 Maybridge3_000214 COc1cc2c(=O)oc(nc2c(OC)c1OC)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J17 compound treatment 0.054 -0.0152 -0.98 0.065 0.00378 0.26 -0.503 -0.4977 2075286 Maybridge3_000215 CSCc1ccc(cc1)C(=O)Nc2ccc(C)cc2O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J18 compound treatment 0.152 0.0828 5.33 0.172 0.111 7.74 9.2429 0.9835 2075287 Maybridge3_000216 CCOC(=O)c1cc2cc(Cl)ccc2o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J19 compound treatment 0.084 0.0148 0.96 0.08 0.0188 1.31 1.6033 0.9879 1164150 Maybridge3_000217 Fc1cccc(NC(=O)c2cccs2)c1C(=O)NCc3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J20 compound treatment 0.057 -0.0122 -0.78 0.053 -0.00822 -0.57 -0.9593 -0.9884 1536952 Maybridge3_000218 O=C(NCC1CC1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J21 compound treatment 0.052 -0.0172 -1.1 0.05 -0.0112 -0.78 -1.335 -0.9859 2075288 Maybridge3_000219 Fc1cc(F)c(NC(=O)c2cccs2)c(C#N)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J22 compound treatment 0.055 -0.0142 -0.91 0.053 -0.00822 -0.57 -1.0503 -0.9752 2075289 Maybridge3_000220 Cc1cc(c(Cl)cc1Cl)S(=O)(=O)NN 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J23 mock treatment 0.062 -0.00716 -0.46 0.057 -0.00422 -0.29 -0.5341 -0.9767 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 J24 mock treatment 0.067 -0.00216 -0.14 0.056 -0.00522 -0.36 -0.3559 -0.9124 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K01 compound treatment 0.098 0.0288 1.86 0.088 0.0268 1.87 2.6357 1.0 2042 Maybridge3_000221 CN(C)c1ncnc2[nH]cnc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K02 compound treatment 0.147 0.0778 5.01 0.115 0.0538 3.76 6.1996 0.9899 1367399 Maybridge3_000222 OC(=O)C1CCN(CC1)c2ncnc3scc(c4ccccc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K03 compound treatment 0.039 -0.0302 -1.94 0.039 -0.0222 -1.55 -2.4701 -0.9939 2075290 Maybridge3_000223 OC(=O)/C=C/C(=O)Nc1ccc(cc1)n2nccc2C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K04 compound treatment 0.077 0.00784 0.5 0.064 0.00278 0.19 0.4944 0.9139 2075291 Maybridge3_000224 FC(F)(F)c1ccnc(n1)N2CCC(CC2)NC(=O)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K05 compound treatment 0.299 0.23 14.79 0.28 0.219 15.28 21.2683 0.9999 1276407 Maybridge3_000225 CCOC(=O)C1CCN(CC1)S(=O)(=O)c2ccc(s2)c3csc(C)n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K06 compound treatment 0.125 0.0558 3.59 0.09 0.0288 2.01 3.9634 0.9623 1564123 Maybridge3_000226 Clc1cc(ccc1N2C(=O)CC3(CCCC3)C2=O)S(=O)(=O)NCC4CC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K07 compound treatment 0.196 0.127 8.16 0.123 0.0618 4.32 8.8249 0.9556 1142977 Maybridge3_000227 CC(C)(C)OC(=O)N1CCCN(CC1)S(=O)(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K08 compound treatment 0.226 0.157 10.1 0.144 0.0828 5.78 11.2277 0.965 1445458 Maybridge3_000228 CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K09 compound treatment 0.102 0.0328 2.11 0.101 0.0398 2.78 3.4599 0.9909 1611715 Maybridge3_000229 CC(C)(C)OC(=O)NCCN1C(=O)CC2(CCCC2)C1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K10 compound treatment 0.148 0.0788 5.07 0.196 0.135 9.42 10.2464 0.9579 1158858 Maybridge3_000230 CCCc1cnc(nc1)N2CCOCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K11 compound treatment 0.085 0.0158 1.02 0.076 0.0148 1.03 1.4513 1.0 1576456 Maybridge3_000231 OC(CSc1ccc(F)cc1)CN2CCN(CC2)c3nc4ccc(Cl)cc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K12 compound treatment 0.125 0.0558 3.59 0.1 0.0388 2.71 4.4573 0.9903 2075292 Maybridge3_000232 COC(=O)c1ccc(CSc2ccccc2N)o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K13 compound treatment 0.293 0.224 14.41 0.286 0.225 15.7 21.2916 0.9991 2075293 Maybridge3_000233 Cc1cn(nc1C(F)(F)F)c2ncnc3scc(c4ccccc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K14 compound treatment 0.054 -0.0152 -0.98 0.057 -0.00422 -0.29 -0.8982 -0.8814 2075294 Maybridge3_000234 Cc1cccc(C)c1/N=C/2\NC3(CCCCC3)C(=C)S2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K15 compound treatment 0.384 0.315 20.26 0.267 0.206 14.38 24.4947 0.9859 2075295 Maybridge3_000235 Cc1nc(ccc1C(=O)Oc2ccc(F)cc2F)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K16 compound treatment 0.069 -1.56E-4 -0.01 0.06 -0.00122 -0.09 -0.0673 -0.7852 2075296 Maybridge3_000236 COc1cc(N2C(SCC2=O)c3ccccc3)c(OC)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K17 compound treatment 0.072 0.00284 0.18 0.06 -0.00122 -0.09 0.0692 0.3429 2075297 Maybridge3_000237 FC(F)(F)c1cccnc1N2CCCN(CC2)S(=O)(=O)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K18 compound treatment 0.064 -0.00516 -0.33 0.057 -0.00422 -0.29 -0.4431 -0.9982 1515242 Maybridge3_000238 CCOC(=O)C1=C(C)NC(=O)C1CC(=O)Nc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K19 compound treatment 0.114 0.0448 2.89 0.131 0.0698 4.87 5.488 0.9687 2075298 Maybridge3_000239 Cc1oc(cc1C(=O)NCCNc2nccc(n2)C(F)(F)F)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K20 compound treatment 0.046 -0.0232 -1.49 0.045 -0.0162 -1.13 -1.8551 -0.9908 1249782 Maybridge3_000240 Clc1cccc(c1)C(=O)Nc2ccc3[nH]nnc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K21 compound treatment 0.043 -0.0262 -1.68 0.041 -0.0202 -1.41 -2.1892 -0.9962 1077231 Maybridge3_000241 CCOC(=O)C(=C1CCN(Cc2ccccc2)CC1)C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K22 compound treatment 0.187 0.118 7.59 0.047 -0.0142 -0.99 4.661 0.6093 1538537 Maybridge3_000242 NC(=O)c1ccccc1NCC(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K23 mock treatment 0.051 -0.0182 -1.17 0.048 -0.0132 -0.92 -1.4793 -0.9932 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 K24 mock treatment 0.061 -0.00816 -0.52 0.065 0.00378 0.26 -0.1844 -0.3138 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L01 compound treatment 0.083 0.0138 0.89 0.079 0.0178 1.24 1.5084 0.9867 2075299 Maybridge3_000243 Cc1ncc(CSCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)c(CO)c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L02 compound treatment 0.13 0.0608 3.92 0.12 0.0588 4.11 5.6729 0.9997 1333099 Maybridge3_000244 O=C(N1CCOCC1)c2cc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L03 compound treatment 0.147 0.0778 5.01 0.142 0.0808 5.64 7.5334 0.9982 1117699 Maybridge3_000245 Fc1ccc(NC(=O)c2ccccc2NC(=O)c3ccco3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L04 compound treatment 0.08 0.0108 0.7 0.072 0.0108 0.75 1.0261 0.9993 2075300 Maybridge3_000246 CCC1(CC)N/C(=N/c2ccc(F)c(Cl)c2)/SC1=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L05 compound treatment 0.133 0.0638 4.11 0.116 0.0548 3.83 5.6118 0.9994 2075301 Maybridge3_000247 CC(C)(C)n1ncc(C#N)c1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L06 compound treatment 0.097 0.0278 1.79 0.083 0.0218 1.52 2.3432 0.9967 1495296 Maybridge3_000248 O=C(N1CCCCC1)c2cc3ccccc3oc2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L07 compound treatment 0.096 0.0268 1.73 0.087 0.0258 1.8 2.4953 0.9998 2075302 Maybridge3_000249 N/C(=N\O)/c1cccc(c1)n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L08 compound treatment 0.058 -0.0112 -0.72 0.061 -2.19E-4 -0.02 -0.5186 -0.722 2075303 Maybridge3_000250 Nc1ccc(Oc2ccc(cc2)C(F)(F)F)nc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L09 compound treatment 0.993 0.924 59.46 0.822 0.761 53.15 79.6282 0.9984 1195614 Maybridge3_000251 CC(C)(C)CC(C)(C)NC(=O)c1cccnc1Oc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L10 compound treatment 0.081 0.0118 0.76 0.085 0.0238 1.66 1.7138 0.9376 1642557 Maybridge3_000252 Clc1ccc(CCNC(=O)c2cc3ccccc3oc2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L11 compound treatment 0.08 0.0108 0.7 0.089 0.0278 1.94 1.8659 0.9047 2075304 Maybridge3_000253 OC(=O)CCC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L12 compound treatment 0.119 0.0498 3.21 0.088 0.0268 1.87 3.5915 0.967 1251326 Maybridge3_000254 COC(=O)c1ccc(Cl)cc1NC(=O)c2cccnc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L13 compound treatment 0.079 0.00984 0.63 0.078 0.0168 1.17 1.277 0.9583 1348369 Maybridge3_000255 Clc1ccccc1C(=O)Nc2ccccc2C(=O)NCc3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L14 compound treatment 0.087 0.0178 1.15 0.073 0.0118 0.82 1.3941 0.9866 2075305 Maybridge3_000256 CSc1ncc(C#N)c2nc(nn12)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L15 compound treatment 1.087 1.02 65.51 0.619 0.558 38.97 73.8785 0.9692 2075306 Maybridge3_000257 O=C(NCCSc1ccccc1)c2cccnc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L16 compound treatment 0.041 -0.0282 -1.81 0.043 -0.0182 -1.27 -2.1814 -0.9851 1641688 Maybridge3_000258 Cn1c(nc(=O)c2cc(Cl)ccc12)c3ccc(C#N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L17 compound treatment 0.046 -0.0232 -1.49 0.043 -0.0182 -1.27 -1.9539 -0.9969 2075307 Maybridge3_000259 CC1CN(CC(C)O1)C(C#N)c2c(F)cccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L18 compound treatment 0.062 -0.00716 -0.46 0.058 -0.00322 -0.22 -0.4847 -0.9456 1370020 Maybridge3_000260 CCOC(=O)c1cc(NC(=O)c2cc3ccccc3oc2=O)sc1CC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L19 compound treatment 0.064 -0.00516 -0.33 0.056 -0.00522 -0.36 -0.4925 -0.9989 2075308 Maybridge3_000261 Fc1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1C(=O)NCCc3ccncc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L20 compound treatment 0.044 -0.0252 -1.62 0.049 -0.0122 -0.85 -1.7485 -0.9553 1352714 Maybridge3_000262 Cc1nn(nc1C(=O)NCC2CC2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L21 compound treatment 0.038 -0.0312 -2.01 0.037 -0.0242 -1.69 -2.6144 -0.9964 2075309 Maybridge3_000263 COC(C/N=C/c1cc(Cl)cc(Cl)c1O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L22 compound treatment 0.04 -0.0292 -1.88 0.04 -0.0212 -1.48 -2.3752 -0.9932 2075310 Maybridge3_000264 C/C(=C\C(=O)Nc1ccc(F)cc1)/Nc2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L23 mock treatment 0.047 -0.0222 -1.43 0.046 -0.0152 -1.06 -1.7602 -0.9895 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 L24 mock treatment 0.057 -0.0122 -0.78 0.054 -0.00722 -0.5 -0.9099 -0.9774 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M01 compound treatment 0.097 0.0278 1.79 0.083 0.0218 1.52 2.3432 0.9967 2075311 Maybridge3_000265 C(=N/c1cccc2ccccc12)/c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M02 compound treatment 0.097 0.0278 1.79 0.072 0.0108 0.75 1.7998 0.9258 2075312 Maybridge3_000266 CC(C)Nc1nccc(n1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M03 compound treatment 0.263 0.194 12.48 0.376 0.315 21.99 24.3721 0.964 2075313 Maybridge3_000267 FC(F)(F)c1ccnc(NCc2ccc(Cl)cc2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M04 compound treatment 0.088 0.0188 1.21 0.079 0.0178 1.24 1.736 0.9999 1310185 Maybridge3_000268 OC(CN1CCN(Cc2c(F)cccc2Cl)CC1)Cn3ccc4ccccc34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M05 compound treatment 0.091 0.0218 1.41 0.104 0.0428 2.99 3.1075 0.9408 1049274 Maybridge3_000269 OC(=O)CC1(CCCC1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M06 compound treatment 0.523 0.454 29.21 0.464 0.403 28.14 40.5525 0.9998 2075314 Maybridge3_000270 C(Nc1ncnc2scc(c3ccccc3)c12)c4ccccn4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M07 compound treatment 0.129 0.0598 3.85 0.102 0.0408 2.85 4.7382 0.989 1323196 Maybridge3_000271 Cc1ccc(cc1)S(=O)(=O)N2CCCN(CC2)C(=O)OC(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M08 compound treatment 0.142 0.0728 4.69 0.118 0.0568 3.97 6.1202 0.9965 2075315 Maybridge3_000272 COc1cccc(CC(=O)NC2CCN(CC2)c3nccc(n3)C(F)(F)F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M09 compound treatment 0.081 0.0118 0.76 0.08 0.0188 1.31 1.4668 0.9666 2075316 Maybridge3_000273 CC(C)(C)OC(=O)N1CCC(O)CC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M10 compound treatment 0.072 0.00284 0.18 0.071 0.00978 0.68 0.6126 0.866 2075317 Maybridge3_000274 Fc1cccc(Cl)c1CN2CCN(CCCNc3nc(ns3)c4ccccc4)CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M11 compound treatment 0.077 0.00784 0.5 0.073 0.0118 0.82 0.939 0.9725 1572373 Maybridge3_000275 OC(CN1CCCC1=O)CN2CCN(CC2)c3nc4ccc(Cl)cc4s3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M12 compound treatment 0.085 0.0158 1.02 0.085 0.0238 1.66 1.8958 0.9725 2075318 Maybridge3_000276 O=C(NC1=NCCS1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M13 compound treatment 0.058 -0.0112 -0.72 0.06 -0.00122 -0.09 -0.568 -0.7854 2075319 Maybridge3_000277 Cc1c[nH]nc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M14 compound treatment 0.064 -0.00516 -0.33 0.055 -0.00622 -0.43 -0.5419 -0.9912 1715499 Maybridge3_000278 COc1ccc(NC(=O)C)c(NC(=O)c2ccc(Cl)cc2Cl)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M15 compound treatment 0.041 -0.0282 -1.81 0.042 -0.0192 -1.34 -2.2308 -0.9891 2075320 Maybridge3_000279 Cc1nc(ccc1C(=O)Sc2ccccc2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M16 compound treatment 0.039 -0.0302 -1.94 0.038 -0.0232 -1.62 -2.5195 -0.996 2075321 Maybridge3_000280 CCOC(=O)c1cc(C)ccc1/N=C/c2cc(Cl)cc(Cl)c2O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M17 compound treatment 0.047 -0.0222 -1.43 0.049 -0.0122 -0.85 -1.612 -0.9699 2075322 Maybridge3_000281 FC(F)(F)c1ccn(n1)c2ncnc3scc(c4ccccc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M18 compound treatment 0.065 -0.00416 -0.27 0.055 -0.00622 -0.43 -0.4964 -0.9729 1397179 Maybridge3_000282 CC(C)N(Cc1ccc(cc1)N(C)C)S(=O)(=O)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M19 compound treatment 0.055 -0.0142 -0.91 0.05 -0.0112 -0.78 -1.1985 -0.9972 2075323 Maybridge3_000283 Cc1nc(ccc1C(=O)NCCNc2ncccc2C(F)(F)F)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M20 compound treatment 0.045 -0.0242 -1.55 0.042 -0.0192 -1.34 -2.0488 -0.9973 2075324 Maybridge3_000284 CCc1cc(CC)c(NC(=O)C(C)(C)C)c(CC)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M21 compound treatment 0.042 -0.0272 -1.75 0.042 -0.0192 -1.34 -2.1853 -0.9915 1523751 Maybridge3_000285 C(N1CCCNCC1)c2cccc3ccccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M22 compound treatment 0.044 -0.0252 -1.62 0.043 -0.0182 -1.27 -2.0449 -0.9929 2075325 Maybridge3_000286 Oc1ccccc1/C=N/c2cc(ccc2Cl)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M23 mock treatment 0.05 -0.0192 -1.23 0.049 -0.0122 -0.85 -1.4754 -0.9839 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 M24 mock treatment 0.06 -0.00916 -0.59 0.058 -0.00322 -0.22 -0.5757 -0.9127 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N01 compound treatment 0.101 0.0318 2.05 0.086 0.0248 1.73 2.6735 0.9965 2075326 Maybridge3_000287 COc1cccc(OC)c1C(=O)Nc2nnc(s2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N02 compound treatment 0.2 0.131 8.42 0.234 0.173 12.07 14.4902 0.9845 2075327 Maybridge3_000288 CC1CCN(CC1)C(=O)c2cc3ccccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N03 compound treatment 0.161 0.0918 5.91 0.133 0.0718 5.01 7.726 0.9966 2075328 Maybridge3_000289 Brc1cc(Br)c2nc(oc(=O)c2c1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N04 compound treatment 0.098 0.0288 1.86 0.084 0.0228 1.59 2.4381 0.9971 2075329 Maybridge3_000290 CCOC(=O)c1cnc(SCC(=O)c2ccc(Cl)c(C)c2)nc1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N05 compound treatment 0.098 0.0288 1.86 0.091 0.0298 2.08 2.7839 0.9984 2075330 Maybridge3_000291 FC(F)(F)c1ccc(N2CCOCC2)c(c1)n3c(csc3=N)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N06 compound treatment 0.11 0.0408 2.63 0.1 0.0388 2.71 3.7746 0.9999 1320006 Maybridge3_000292 O=C(Nc1ccccc1N2CCOCC2)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N07 compound treatment 0.07 8.44E-4 0.05 0.079 0.0178 1.24 0.9168 0.7373 1478773 Maybridge3_000293 Cc1cccc(C)c1NC(=O)CSC(=O)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N08 compound treatment 0.052 -0.0172 -1.1 0.055 -0.00622 -0.43 -1.088 -0.9169 1436586 Maybridge3_000294 COC(=O)C=c1sc2nc3ccccc3n2c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N09 compound treatment 0.112 0.0428 2.76 0.088 0.0268 1.87 3.2729 0.9821 1547277 Maybridge3_000295 O=C(N1CCOCC1)c2cccnc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N10 compound treatment 1.435 1.37 87.91 1.393 1.33 93.04 127.9513 0.9996 2075331 Maybridge3_000296 Clc1ccc(CCNC(=O)c2cccnc2Oc3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N11 compound treatment 0.089 0.0198 1.28 0.071 0.00978 0.68 1.3863 0.957 2075332 Maybridge3_000297 N#CCCn1ncc(C#N)c1n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N12 compound treatment 0.52 0.451 29.02 0.369 0.308 21.5 35.7231 0.9891 1620514 Maybridge3_000298 COC(=O)c1ccc(Cl)cc1NC(=O)c2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N13 compound treatment 0.069 -1.56E-4 -0.01 0.072 0.0108 0.75 0.5255 0.6976 2075333 Maybridge3_000299 Nc1ccccc1c2nc(no2)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N14 compound treatment 0.058 -0.0112 -0.72 0.049 -0.0122 -0.85 -1.1113 -0.9963 1246890 Maybridge3_000300 Cc1ccc(NC(=O)Cc2ncon2)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N15 compound treatment 0.045 -0.0242 -1.55 0.045 -0.0162 -1.13 -1.9006 -0.9879 2075334 Maybridge3_000301 FC(F)(F)C(=O)Nc1ccccc1c2nc(no2)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N16 compound treatment 0.043 -0.0262 -1.68 0.044 -0.0172 -1.2 -2.041 -0.9864 2075335 Maybridge3_000302 CC1CN(CC(=N)NS(=O)(=O)c2cc(Cl)cc(Cl)c2)CC(C)O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N17 compound treatment 0.047 -0.0222 -1.43 0.046 -0.0152 -1.06 -1.7602 -0.9895 2075336 Maybridge3_000303 Cc1nn(nc1C(=O)Oc2ccc(Cl)cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N18 compound treatment 0.058 -0.0112 -0.72 0.053 -0.00822 -0.57 -0.9137 -0.9939 1735808 Maybridge3_000304 CCOC(=O)c1cc(CC)sc1NC(=O)c2cccnc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N19 compound treatment 0.051 -0.0182 -1.17 0.048 -0.0132 -0.92 -1.4793 -0.9932 2075337 Maybridge3_000305 CCOC(=O)c1c[nH]c2c(F)cc(F)cc2c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N20 compound treatment 0.055 -0.0142 -0.91 0.047 -0.0142 -0.99 -1.3467 -0.9991 2075338 Maybridge3_000306 O=C(NCC1CC1)c2cccs2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N21 compound treatment 0.05 -0.0192 -1.23 0.05 -0.0112 -0.78 -1.426 -0.9761 1512174 Maybridge3_000307 Cc1cc(C)c(NC(=O)CSCC(=O)c2ccc(Cl)cc2)c(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N22 compound treatment 0.065 -0.00416 -0.27 0.056 -0.00522 -0.36 -0.447 -0.9884 2075339 Maybridge3_000308 Cc1cc(no1)N2C(=O)C=CC2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N23 mock treatment 0.059 -0.0102 -0.65 0.051 -0.0102 -0.71 -0.967 -0.999 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 N24 mock treatment 0.055 -0.0142 -0.91 0.055 -0.00622 -0.43 -0.9515 -0.9426 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O01 compound treatment 0.767 0.698 44.92 0.607 0.546 38.13 58.7216 0.9967 2075340 Maybridge3_000309 CCOc1nc(N)nc(NC)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O02 compound treatment 0.352 0.283 18.21 0.515 0.454 31.7 35.2891 0.9653 2075341 Maybridge3_000310 FC(F)(F)c1ccnc(NCc2ccc3OCOc3c2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O03 compound treatment 0.18 0.111 7.13 0.143 0.0818 5.71 9.0847 0.9939 2075342 Maybridge3_000311 Nc1ccccc1Sc2ncnc3scc(c4ccccc4)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O04 compound treatment 0.079 0.00984 0.63 0.082 0.0208 1.45 1.4746 0.9309 2075343 Maybridge3_000312 OC(=O)/C=C/C(=O)N1CCCN(CC1)c2ncccc2C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O05 compound treatment 0.075 0.00584 0.38 0.074 0.0128 0.89 0.8973 0.9262 2075344 Maybridge3_000313 OC(CSc1ccccc1)CN2CCN(CC2)c3nccc(n3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O06 compound treatment 0.076 0.00684 0.44 0.074 0.0128 0.89 0.9429 0.947 2075345 Maybridge3_000314 NC1CCN(CC1)c2ncc(cc2Cl)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O07 compound treatment 0.134 0.0648 4.17 0.093 0.0318 2.22 4.5212 0.9564 1468130 Maybridge3_000315 CC(C)(C)OC(=O)N1CCCN(CC1)C(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O08 compound treatment 0.11 0.0408 2.63 0.093 0.0318 2.22 3.4289 0.9965 2075346 Maybridge3_000316 Cc1nc(ccc1NC(=O)C(F)(F)Sc2ccccc2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O09 compound treatment 0.043 -0.0262 -1.68 0.042 -0.0192 -1.34 -2.1398 -0.9937 2075347 Maybridge3_000317 Cc1nc(ccc1c2nnc(SC(=O)c3ccc(Cl)cc3)o2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O10 compound treatment 0.07 8.44E-4 0.05 0.068 0.00678 0.47 0.3734 0.783 2075348 Maybridge3_000318 O=C(NCCCN1CCN(Cc2ccccc2)CC1)c3cccs3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O11 compound treatment 0.058 -0.0112 -0.72 0.061 -2.19E-4 -0.02 -0.5186 -0.722 1676831 Maybridge3_000319 OC(CN1CCN(CC1)c2nc3ccc(Cl)cc3s2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O12 compound treatment 0.066 -0.00316 -0.2 0.082 0.0208 1.45 0.8829 0.6023 2075349 Maybridge3_000320 O=C(NC1=NCCS1)c2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O13 compound treatment 0.054 -0.0152 -0.98 0.053 -0.00822 -0.57 -1.0958 -0.9681 2075350 Maybridge3_000321 Cc1nc(ccc1NC(=O)c2ccc(cc2)C(F)(F)F)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O14 compound treatment 1.081 1.01 65.13 1.028 0.967 67.54 93.8094 0.9998 1366003 Maybridge3_000322 COc1nc(Nc2ccc(F)cc2)nc(OC)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O15 compound treatment 0.055 -0.0142 -0.91 0.056 -0.00522 -0.36 -0.9021 -0.9192 2075351 Maybridge3_000323 FC(F)(F)c1ccnc(NCCNC(=O)C2CC2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O16 compound treatment 0.061 -0.00816 -0.52 0.057 -0.00422 -0.29 -0.5796 -0.9627 1016138 Maybridge3_000324 OC(=O)CSC1(CCCCC1)SCC(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O17 compound treatment 0.062 -0.00716 -0.46 0.057 -0.00422 -0.29 -0.5341 -0.9767 2075352 Maybridge3_000325 FC(F)(F)c1ccn(n1)c2nc(ns2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O18 compound treatment 0.061 -0.00816 -0.52 0.065 0.00378 0.26 -0.1844 -0.3138 1123304 Maybridge3_000326 CC(C)N(Cc1ccc(cc1)N(C)C)C(=O)c2c(C)onc2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O19 compound treatment 0.063 -0.00616 -0.4 0.061 -2.19E-4 -0.02 -0.291 -0.7338 2075353 Maybridge3_000327 Clc1ccc(cc1)S(=O)(=O)N2CCN=C2COc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O20 compound treatment 0.059 -0.0102 -0.65 0.057 -0.00422 -0.29 -0.6706 -0.9352 1029792 Maybridge3_000328 C(CN1CCCCC1)C2CCCCN2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O21 compound treatment 0.059 -0.0102 -0.65 0.055 -0.00622 -0.43 -0.7694 -0.9803 2075354 Maybridge3_000329 OC(=O)c1ccccc1C(=O)N2CCCN(CC2)c3ncccc3C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O22 compound treatment 0.066 -0.00316 -0.2 0.057 -0.00422 -0.29 -0.352 -0.9835 1537726 Maybridge3_000330 O=C(Nc1ccc2OCOCc2c1)c3cc4ccccc4oc3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O23 mock treatment 0.063 -0.00616 -0.4 0.052 -0.00922 -0.64 -0.7356 -0.9728 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 O24 mock treatment 0.07 8.44E-4 0.05 0.064 0.00278 0.19 0.1758 0.8714 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P01 compound treatment 0.058 -0.0112 -0.72 0.053 -0.00822 -0.57 -0.9137 -0.9939 2075355 Maybridge3_000331 CCOC(=O)CCc1ccc2OC(Nc2c1)c3ccc(cc3)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P02 compound treatment 0.11 0.0408 2.63 0.111 0.0498 3.48 4.318 0.9905 2075356 Maybridge3_000332 Cc1ccc(NC(=O)Oc2ccc(F)cc2Cl)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P03 compound treatment 0.103 0.0338 2.18 0.101 0.0398 2.78 3.5055 0.9927 1270266 Maybridge3_000333 Brc1cc(Br)c2nc(oc(=O)c2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P04 compound treatment 0.096 0.0268 1.73 0.09 0.0288 2.01 2.6435 0.9971 2075357 Maybridge3_000334 CCOC(=O)c1cnc(SCC(=O)c2ccc(cc2)c3ccccc3)nc1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P05 compound treatment 0.099 0.0298 1.92 0.102 0.0408 2.85 3.3728 0.9816 2075358 Maybridge3_000335 C/C=C(\C)/C(=O)Nc1nncs1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P06 compound treatment 0.084 0.0148 0.96 0.08 0.0188 1.31 1.6033 0.9879 2075359 Maybridge3_000336 CCC1(CC)N/C(=N/c2ccc(C)cc2C)/SC1=C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P07 compound treatment 0.1 0.0308 1.99 0.084 0.0228 1.59 2.5291 0.994 1310840 Maybridge3_000337 OC(=O)c1cnc2c(F)cccc2c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P08 compound treatment 0.057 -0.0122 -0.78 0.058 -0.00322 -0.22 -0.7123 -0.8749 2075360 Maybridge3_000338 COC(=O)/C=C/1\S/C(=N\c2ccc(Cl)cc2)/N(C1=O)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P09 compound treatment 0.396 0.327 21.04 0.287 0.226 15.77 26.0288 0.9899 2075361 Maybridge3_000339 O=C(Sc1ccccc1)c2cccnc2Oc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P10 compound treatment 0.127 0.0578 3.72 0.081 0.0198 1.38 3.6098 0.909 1600278 Maybridge3_000340 CC(=O)Nc1cc2cc(ccc2oc1=O)n3cccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P11 compound treatment 0.08 0.0108 0.7 0.08 0.0188 1.31 1.4213 0.9564 1726788 Maybridge3_000341 CC(=O)Nc1cc2cc(N)ccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P12 compound treatment 0.126 0.0568 3.66 0.102 0.0408 2.85 4.6017 0.9923 1372903 Maybridge3_000342 Cc1onc(c1C(=O)Nc2nnc(s2)C3CC3)c4c(F)cccc4Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P13 compound treatment 0.092 0.0228 1.47 0.102 0.0408 2.85 3.0542 0.9527 2075362 Maybridge3_000343 CN(C)c1ccc(CC(C#N)C#N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P14 compound treatment 0.076 0.00684 0.44 0.062 7.81E-4 0.05 0.3501 0.7887 1525163 Maybridge3_000344 Clc1cc(Cl)cc(NC(=O)Cc2ncon2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P15 compound treatment 0.069 -1.56E-4 -0.01 0.064 0.00278 0.19 0.1303 0.6696 1394189 Maybridge3_000345 Cc1onc(c1C(=O)NCCS(=O)(=O)c2ccccc2)c3c(Cl)cccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P16 compound treatment 0.059 -0.0102 -0.65 0.056 -0.00522 -0.36 -0.72 -0.962 2075363 Maybridge3_000346 Clc1cc(Cl)cc(c1)S(=O)(=O)NC(=N)CN2CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P17 compound treatment 0.053 -0.0162 -1.04 0.043 -0.0182 -1.27 -1.6353 -0.995 2075364 Maybridge3_000347 Cc1nn(nc1C(=O)Sc2ccccn2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P18 compound treatment 0.051 -0.0182 -1.17 0.052 -0.00922 -0.64 -1.2817 -0.9606 1025104 Maybridge3_000348 CSC(=S)Nc1ccc(Cl)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P19 compound treatment 0.072 0.00284 0.18 0.07 0.00878 0.61 0.5632 0.8798 1192638 Maybridge3_000349 CCOC(=O)c1cnc2c(F)cc(F)cc2c1N3CCOCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P20 compound treatment 0.127 0.0578 3.72 0.116 0.0548 3.83 5.3387 0.9999 1166619 Maybridge3_000350 Fc1ccc(c(F)c1)S(=O)(=O)NCC2CC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P21 compound treatment 0.27 0.201 12.93 0.111 0.0498 3.48 11.6001 0.8665 2075365 Maybridge3_000351 Fc1ccc(OC(=O)c2c(Cl)cccc2Cl)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P22 compound treatment 0.07 8.44E-4 0.05 0.065 0.00378 0.26 0.2252 0.835 2075366 Maybridge3_000352 Clc1ccc2sc(Oc3cccc(c3)N4CCOCC4)nc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P23 mock treatment 0.084 0.0148 0.96 0.071 0.00978 0.68 1.1588 0.9865 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1431 P24 mock treatment 0.062 -0.00716 -0.46 0.066 0.00478 0.33 -0.0895 -0.1573 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A01 compound treatment 0.069 0.00266 0.17 0.071 0.00553 0.39 0.3941 0.9327 2075367 Maybridge3_000353 Nc1nnc(Sc2nc3cc(Cl)ccc3s2)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A02 compound treatment 1.061 0.995 64.02 1.187 1.12 78.35 100.6715 0.995 1354581 Maybridge3_000354 CCCSc1nc(=O)c2cccnc2n1c3ccc(OC)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A03 compound treatment 0.274 0.208 13.37 0.276 0.211 14.71 19.8509 0.9989 2075368 Maybridge3_000355 Cc1nn(C)c2oc(=O)cc(c3ccccc3)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A04 compound treatment 0.089 0.0227 1.46 0.101 0.0355 2.48 2.7863 0.9679 2075369 Maybridge3_000356 Cc1ccc(cc1)S(=O)(=O)CC(=O)Nc2ccc(F)c(F)c2F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A05 compound treatment 0.054 -0.0123 -0.79 0.066 5.31E-4 0.04 -0.5356 -0.6733 2075370 Maybridge3_000357 CCOC(=O)CSc1cc(C)c(Cl)cc1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A06 compound treatment 0.104 0.0377 2.42 0.109 0.0435 3.04 3.8642 0.9937 1298817 Maybridge3_000358 CC(C)(C)c1cc(cc(c1)C(=O)Oc2cccnc2)C(=O)Oc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A07 compound treatment 0.138 0.0717 4.61 0.109 0.0435 3.04 5.4117 0.9796 2075371 Maybridge3_000359 CN(C(=O)CSc1cc(Cl)ccc1Cl)c2ccc(F)cc2F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A08 compound treatment 0.098 0.0317 2.04 0.102 0.0365 2.55 3.2454 0.9938 2075372 Maybridge3_000360 COc1cc(C)nc2nc(SC)nn12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A09 compound treatment 0.124 0.0577 3.71 0.11 0.0445 3.11 4.8239 0.9962 1661500 Maybridge3_000361 CC(=O)Nc1ccccc1c2nnc(o2)c3ccc(cc3)C(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A10 compound treatment 0.112 0.0457 2.94 0.149 0.0835 5.84 6.2043 0.9496 1284592 Maybridge3_000362 COC(=O)CNC(=O)c1cccnc1Sc2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A11 compound treatment 0.076 0.00966 0.62 0.073 0.00753 0.53 0.8115 0.9966 1345631 Maybridge3_000363 Cc1onc(c1NC(=O)Oc2ccc(CC#N)cc2)c3c(F)cccc3Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A12 compound treatment 0.083 0.0167 1.07 0.092 0.0265 1.85 2.0687 0.9661 2075373 Maybridge3_000364 CSc1ncccc1C2=N/C(=C\c3ccc(cc3)C(F)(F)F)/C(=O)O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A13 compound treatment 0.096 0.0297 1.91 0.078 0.0125 0.88 1.9688 0.9375 2075374 Maybridge3_000365 Clc1ccc(cc1)S(=O)(=O)n2ccc(c2)c3cnc4ccccc4n3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A14 compound treatment 0.22 0.154 9.89 0.115 0.0495 3.46 9.4401 0.901 1474356 Maybridge3_000366 Clc1cccc(c1)C(=O)OCCS(=O)(=O)c2ccccn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A15 compound treatment 0.087 0.0207 1.33 0.092 0.0265 1.85 2.2507 0.9867 2075375 Maybridge3_000367 O/N=C/Nc1cc(Cl)c(cc1Cl)n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A16 compound treatment 0.088 0.0217 1.39 0.081 0.0155 1.09 1.7529 0.9923 2075376 Maybridge3_000368 CSC1=C(C#N)C(=C(C#N)C#N)NC(=N1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A17 compound treatment 0.266 0.2 12.85 0.256 0.191 13.31 18.4989 0.9998 2075377 Maybridge3_000369 Clc1cncc(Oc2ccc(cn2)n3cccc3)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A18 compound treatment 1.028 0.962 61.9 0.784 0.719 50.2 79.262 0.9946 1401952 Maybridge3_000370 CCOC(=O)c1c(C)c(C#N)c(N)n1c2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A19 compound treatment 0.073 0.00666 0.43 0.072 0.00653 0.46 0.6256 0.9995 2075378 Maybridge3_000371 FC(F)(F)c1ccc(SCCNC(=O)c2ccc(Cl)cc2)nc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A20 compound treatment 0.067 6.56E-4 0.04 0.075 0.00953 0.67 0.5007 0.7505 1135908 Maybridge3_000372 CN(C(=O)CSc1ccccn1)c2c3CCCCc3nn2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A21 compound treatment 0.147 0.0807 5.19 0.135 0.0695 4.86 7.1056 0.9994 2075379 Maybridge3_000373 CC(=C)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A22 compound treatment 0.063 -0.00334 -0.22 0.062 -0.00347 -0.24 -0.3235 -0.9982 2075380 Maybridge3_000374 Cn1nc(OC(C)(C)C(=O)O)cc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A23 mock treatment 0.072 0.00566 0.36 0.069 0.00353 0.25 0.4319 0.982 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 A24 mock treatment 0.067 6.56E-4 0.04 0.066 5.31E-4 0.04 0.0561 0.9979 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B01 compound treatment 0.099 0.0327 2.1 0.097 0.0315 2.2 3.0439 0.9997 1206250 Maybridge3_000375 OC(=O)C1CC1C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B02 compound treatment 0.157 0.0907 5.84 0.177 0.112 7.79 9.6355 0.9898 1921490 Maybridge3_000376 O=C(Nc1ccccc1)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B03 compound treatment 0.088 0.0217 1.39 0.076 0.0105 0.74 1.5059 0.9554 2075381 Maybridge3_000377 COc1ccc(cc1)/C(=C/c2cn[nH]c2)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B04 compound treatment 0.092 0.0257 1.65 0.084 0.0185 1.29 2.0831 0.9927 1002705 Maybridge3_000378 CC1(C)OC2OC(C(O)CO)C(O)C2O1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B05 compound treatment 0.079 0.0127 0.81 0.083 0.0175 1.22 1.442 0.9804 2075382 Maybridge3_000379 O/N=C/c1c[nH]c(n1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B06 compound treatment 0.154 0.0877 5.64 0.148 0.0825 5.77 8.0664 0.9999 1260437 Maybridge3_000380 O=C(N(c1ccccc1)c2ccccc2)c3ccco3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B07 compound treatment 0.082 0.0157 1.01 0.08 0.0145 1.02 1.4304 1.0 2075383 Maybridge3_000381 CCCc1cc(=O)c2ccc(OC/C(=N/O)/C)cc2o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B08 compound treatment 0.097 0.0307 1.97 0.104 0.0385 2.69 3.2986 0.9883 1425483 Maybridge3_000382 CCC(=O)c1ccc(NC(=O)C)cc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B09 compound treatment 0.078 0.0117 0.75 0.078 0.0125 0.88 1.1495 0.997 1184940 Maybridge3_000383 OCc1cc(=O)c(OCc2ccccc2)c[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B10 compound treatment 0.211 0.145 9.31 0.291 0.226 15.76 17.7246 0.9685 2075384 Maybridge3_000384 CSC1=N/C(=C/c2cccs2)/C(=O)N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B11 compound treatment 0.076 0.00966 0.62 0.074 0.00853 0.6 0.8609 0.9998 1153981 Maybridge3_000385 CC(O)c1ccccc1c2ccccc2C(C)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B12 compound treatment 0.079 0.0127 0.81 0.084 0.0185 1.29 1.4914 0.9751 1084431 Maybridge3_000386 CC1(CC1(Br)Br)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B13 compound treatment 0.44 0.374 24.05 0.42 0.355 24.77 34.5194 0.9999 1452761 Maybridge3_000387 O=C(N1CCCCC1)c2cccc3C(=O)c4ccccc4-c32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B14 compound treatment 1.105 1.04 66.85 1.048 0.983 68.64 95.8077 0.9999 1006126 Maybridge3_000388 COC(=O)c1cccc2-c3ccccc3C(=O)c21 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B15 compound treatment 0.106 0.0397 2.55 0.102 0.0365 2.55 3.6095 1.0 1691637 Maybridge3_000389 CCc1ccc(cc1)n2nnnc2c3cn[nH]c3c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B16 compound treatment 0.082 0.0157 1.01 0.097 0.0315 2.2 2.2702 0.9372 1020878 Maybridge3_000390 CNC(=O)Oc1cccc2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B17 compound treatment 0.087 0.0207 1.33 0.085 0.0195 1.36 1.9049 0.9999 1294341 Maybridge3_000391 CCNC(=O)c1ccccc1Sc2ccccc2COC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B18 compound treatment 0.072 0.00566 0.36 0.075 0.00953 0.67 0.7283 0.9596 1016816 Maybridge3_000392 CC(=O)NC(CCc1ccccc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B19 compound treatment 0.077 0.0107 0.69 0.083 0.0175 1.22 1.351 0.9625 1511758 Maybridge3_000393 CC(=O)NCc1ccccc1S(=O)c2ccccc2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B20 compound treatment 0.071 0.00466 0.3 0.071 0.00553 0.39 0.4852 0.9921 1461606 Maybridge3_000394 COc1ccc(cc1)N(C(=C)C2CC2)C(=O)c3ccc(F)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B21 compound treatment 0.068 0.00166 0.11 0.07 0.00453 0.32 0.2992 0.8958 1115519 Maybridge3_000395 CSc1nc2nc(C)cc(O)n2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B22 compound treatment 0.23 0.164 10.53 0.224 0.159 11.07 15.2797 0.9997 1178621 Maybridge3_000396 COn1c2CCCCc2c3c1ccc4nonc43 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B23 mock treatment 0.069 0.00266 0.17 0.06 -0.00547 -0.38 -0.1493 -0.3566 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 B24 mock treatment 0.063 -0.00334 -0.22 0.067 0.00153 0.11 -0.0765 -0.3185 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C01 compound treatment 0.107 0.0407 2.62 0.114 0.0485 3.39 4.2477 0.9918 2075385 Maybridge3_000397 Cc1cc(C)n(n1)c2ccc(nn2)N3CCSCC3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C02 compound treatment 0.124 0.0577 3.71 0.117 0.0515 3.6 5.1697 0.9999 2075386 Maybridge3_000398 CN(c1ccc(Br)cc1)c2nc(=O)c3cccnc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C03 compound treatment 0.091 0.0247 1.59 0.092 0.0265 1.85 2.4328 0.997 1582616 Maybridge3_000399 CCOC(=O)Cc1csc(NS(=O)(=O)c2cc(C)c(Cl)cc2Cl)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C04 compound treatment 0.074 0.00766 0.49 0.079 0.0135 0.95 1.0169 0.9539 2075387 Maybridge3_000400 Fc1ccc(cc1Cl)S(=O)(=O)/C=C/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C05 compound treatment 0.064 -0.00234 -0.15 0.075 0.00953 0.67 0.3642 0.5334 1293762 Maybridge3_000401 Cc1cc(Oc2ncccc2C(=O)O)cc(C)c1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C06 compound treatment 0.043 -0.0233 -1.5 0.041 -0.0245 -1.71 -2.2712 -0.9979 2075388 Maybridge3_000402 Cc1ccc(NC(=O)OCCS(=O)(=O)c2ccc(cn2)C(F)(F)F)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C07 compound treatment 0.073 0.00666 0.43 0.07 0.00453 0.32 0.5268 0.9889 2075389 Maybridge3_000403 O/N=C/Nc1ccccc1Sc2nc3cc(Cl)ccc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C08 compound treatment 0.054 -0.0123 -0.79 0.056 -0.00947 -0.66 -1.0295 -0.9959 2075390 Maybridge3_000404 OC(=O)CSc1cccc(Cl)c1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C09 compound treatment 0.352 0.286 18.39 0.366 0.301 21.0 27.8468 0.9978 1053033 Maybridge3_000405 O=S(=O)(c1ccccc1)n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C10 compound treatment 0.087 0.0207 1.33 0.085 0.0195 1.36 1.9049 0.9999 1189912 Maybridge3_000406 COC(=O)CNC(=O)c1cccnc1Sc2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C11 compound treatment 0.074 0.00766 0.49 0.073 0.00753 0.53 0.7205 0.9995 2075391 Maybridge3_000407 Clc1cc2ncc(nc2cc1Cl)c3ccn(c3)S(=O)(=O)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C12 compound treatment 0.076 0.00966 0.62 0.074 0.00853 0.6 0.8609 0.9998 1216248 Maybridge3_000408 OC(=O)CNC(=O)c1cccnc1Sc2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C13 compound treatment 0.064 -0.00234 -0.15 0.06 -0.00547 -0.38 -0.3768 -0.9174 1597701 Maybridge3_000409 Cc1cccc(NC(=O)c2ccc(Cl)cc2N)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C14 compound treatment 0.042 -0.0243 -1.57 0.043 -0.0225 -1.57 -2.2179 -1.0 2075392 Maybridge3_000410 CSc1nc(nc(SC)c1C#N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C15 compound treatment 0.059 -0.00734 -0.47 0.061 -0.00447 -0.31 -0.555 -0.9797 1676336 Maybridge3_000411 CSc1nnc(SC)n1CCNC(=O)c2cccc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C16 compound treatment 0.238 0.172 11.05 0.215 0.15 10.45 15.1992 0.9996 2075393 Maybridge3_000412 CN(C)c1nc(nc(c1C#N)c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C17 compound treatment 0.074 0.00766 0.49 0.079 0.0135 0.95 1.0169 0.9539 2075394 Maybridge3_000413 COc1ccc(cc1)n2cc(C#N)c(N)n2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C18 compound treatment 0.792 0.726 46.71 0.784 0.719 50.2 68.521 0.9994 2075395 Maybridge3_000414 CCOC(=O)c1c(C)c(C#N)c(n2cccc2)n1c3ccc(C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C19 compound treatment 0.066 -3.44E-4 -0.02 0.061 -0.00447 -0.31 -0.2364 -0.7553 2075396 Maybridge3_000415 OCCS(=O)(=O)c1ccc(cn1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C20 compound treatment 0.098 0.0317 2.04 0.096 0.0305 2.13 2.949 0.9997 1461156 Maybridge3_000416 COc1ccc(Sc2nc(C)c(cc2C#N)c3csc(C)n3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C21 compound treatment 0.249 0.183 11.76 0.27 0.205 14.29 18.4167 0.9953 2075397 Maybridge3_000417 FC(F)(F)c1ccc(SCC(=O)c2cccc(c2)C(F)(F)F)nc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C22 compound treatment 0.099 0.0327 2.1 0.086 0.0205 1.43 2.5005 0.9826 2075398 Maybridge3_000418 Cn1nc(OC(C)(C)C(=O)Nc2ccc(Cl)cc2Cl)cc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C23 mock treatment 0.064 -0.00234 -0.15 0.059 -0.00647 -0.45 -0.4262 -0.8946 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 C24 mock treatment 0.067 6.56E-4 0.04 0.067 0.00153 0.11 0.1055 0.9174 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D01 compound treatment 0.075 0.00866 0.56 0.091 0.0255 1.78 1.6552 0.8858 1536821 Maybridge3_000419 Nc1nc(cs1)c2ccc3NC(=O)CCc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D02 compound treatment 0.043 -0.0233 -1.5 0.047 -0.0185 -1.29 -1.9748 -0.9971 2075399 Maybridge3_000420 OC(=O)/C(=C/C(=O)c1ccccc1)/O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D03 compound treatment 0.085 0.0187 1.2 0.096 0.0305 2.13 2.3573 0.9631 2075400 Maybridge3_000421 COC(=O)/C(=C\Nc1ccc(Sc2ccc(Cl)cc2)nc1)/NC(=O)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D04 compound treatment 0.065 -0.00134 -0.09 0.077 0.0115 0.81 0.5085 0.6276 1031898 Maybridge3_000422 CC1(C)OCC(O1)C(O)C(O)C2COC(C)(C)O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D05 compound treatment 0.079 0.0127 0.81 0.073 0.00753 0.53 0.9481 0.9776 1325167 Maybridge3_000423 CN1C2CCC1CC(C2)NC(=O)c3c(F)cccc3F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D06 compound treatment 0.104 0.0377 2.42 0.118 0.0525 3.67 4.3088 0.9797 1092418 Maybridge3_000424 OCc1ccccc1Sc2ccccc2CO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D07 compound treatment 0.104 0.0377 2.42 0.118 0.0525 3.67 4.3088 0.9797 1360357 Maybridge3_000425 Cc1cc(=O)oc2c(CC=C)c(O)ccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D08 compound treatment 0.066 -3.44E-4 -0.02 0.066 5.31E-4 0.04 0.0106 0.2453 1038220 Maybridge3_000426 Oc1ccc(cc1)C(=O)Cc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D09 compound treatment 0.098 0.0317 2.04 0.1 0.0345 2.41 3.1466 0.9965 2075401 Maybridge3_000427 COc1cccc(NC(=O)C(C)(C)C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D10 compound treatment 0.638 0.572 36.79 0.585 0.52 36.29 51.6817 1.0 2075402 Maybridge3_000428 C/C(=C/1\N=C(OC1=O)c2ccccc2)/Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D11 compound treatment 0.067 6.56E-4 0.04 0.072 0.00653 0.46 0.3525 0.7693 2075403 Maybridge3_000429 c1cc(sc1c2ccccn2)c3ccccn3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D12 compound treatment 0.736 0.67 43.1 0.806 0.741 51.73 67.059 0.9959 2075404 Maybridge3_000430 CC(CC(=O)c1cccs1)C(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D13 compound treatment 0.136 0.0697 4.48 0.153 0.0875 6.11 7.4942 0.9884 1537471 Maybridge3_000431 Oc1c(Cc2ccccc2)c(=O)n3CCCc4cccc1c43 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D14 compound treatment 1.093 1.03 66.08 1.088 1.02 71.43 97.2375 0.9992 2075405 Maybridge3_000432 CC(C)OC(=O)c1cccc2-c3ccccc3C(=O)c21 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D15 compound treatment 0.039 -0.0273 -1.76 0.039 -0.0265 -1.85 -2.552 -0.9997 2075406 Maybridge3_000433 Fc1ccc(cc1)C(=O)/C=C/S(=O)(=O)c2ccc(Br)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D16 compound treatment 0.059 -0.00734 -0.47 0.056 -0.00947 -0.66 -0.802 -0.9864 2075407 Maybridge3_000434 CCCC(=O)Oc1c[nH]c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D17 compound treatment 0.068 0.00166 0.11 0.068 0.00253 0.18 0.2004 0.9706 1272565 Maybridge3_000435 CNC(=O)c1ccccc1Sc2ccc(Cl)cc2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D18 compound treatment 0.064 -0.00234 -0.15 0.067 0.00153 0.11 -0.031 -0.1678 1116545 Maybridge3_000436 CC(N)C(=O)OCc1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D19 compound treatment 0.072 0.00566 0.36 0.067 0.00153 0.11 0.3331 0.8778 1407680 Maybridge3_000437 OCCc1ccccc1S(=O)c2ccccc2C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D20 compound treatment 0.063 -0.00334 -0.22 0.06 -0.00547 -0.38 -0.4223 -0.9631 1488771 Maybridge3_000438 Nc1ccc(Oc2cccc(Oc3ccc(N)cc3)c2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D21 compound treatment 0.063 -0.00334 -0.22 0.065 -4.69E-4 -0.03 -0.1753 -0.8054 1095526 Maybridge3_000439 OC1C=COC2COC(OC12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D22 compound treatment 0.057 -0.00934 -0.6 0.051 -0.0145 -1.01 -1.14 -0.9692 2075408 Maybridge3_000440 CC1(C)NC(C)(C)C(=C1)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D23 mock treatment 0.065 -0.00134 -0.09 0.059 -0.00647 -0.45 -0.3807 -0.8274 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 D24 mock treatment 0.06 -0.00634 -0.41 0.062 -0.00347 -0.24 -0.4601 -0.969 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E01 compound treatment 0.075 0.00866 0.56 0.073 0.00753 0.53 0.766 0.9996 1396970 Maybridge3_000441 CC1CCN(CC1)c2ccc(nn2)n3nc(C)cc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E02 compound treatment 0.122 0.0557 3.58 0.094 0.0285 1.99 3.9425 0.9617 2075409 Maybridge3_000442 O=C(CSc1ssc(=S)c1c2ccccc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E03 compound treatment 0.053 -0.0133 -0.86 0.05 -0.0155 -1.08 -1.3714 -0.9935 1322883 Maybridge3_000443 CC(Sc1ncccc1C(=O)O)c2cc(C)ccc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E04 compound treatment 0.042 -0.0243 -1.57 0.042 -0.0235 -1.64 -2.2673 -0.9997 1644141 Maybridge3_000444 CN(C)C=C=C(O)c1ccccc1C(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E05 compound treatment 0.079 0.0127 0.81 0.069 0.00353 0.25 0.7505 0.8817 2075410 Maybridge3_000445 CCCc1cc(O)nc(SCC(=O)Nc2cc(Cl)cc(Cl)c2)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E06 compound treatment 0.077 0.0107 0.69 0.072 0.00653 0.46 0.8076 0.9804 2075411 Maybridge3_000446 CC(=O)OCCS(=O)(=O)c1ccc(cn1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E07 compound treatment 0.083 0.0167 1.07 0.067 0.00153 0.11 0.8337 0.7738 2075412 Maybridge3_000447 Cc1cc(=O)oc2n(C)nc(c12)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E08 compound treatment 0.113 0.0467 3.0 0.103 0.0375 2.62 3.9774 0.9977 1691409 Maybridge3_000448 COC(=O)CNC(=O)c1cccnc1SC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E09 compound treatment 0.059 -0.00734 -0.47 0.068 0.00253 0.18 -0.2092 -0.4145 1455911 Maybridge3_000449 Cc1nn(nc1C(=O)Oc2ccc(CC#N)cc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E10 compound treatment 0.856 0.79 50.83 0.761 0.696 48.59 70.2976 0.9997 1176197 Maybridge3_000450 COC(=O)CNC(=O)c1cccnc1Oc2ccc(C)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E11 compound treatment 0.061 -0.00534 -0.34 0.061 -0.00447 -0.31 -0.464 -0.9988 2075413 Maybridge3_000451 Cc1ccc(Sc2ccc(N)cn2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E12 compound treatment 0.092 0.0257 1.65 0.1 0.0345 2.41 2.8735 0.9829 2075414 Maybridge3_000452 Cc1cc(OCC(=O)c2ccc(cc2)C(F)(F)F)n3cnnc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E13 compound treatment 0.334 0.268 17.23 0.375 0.31 21.62 27.4721 0.9937 1231742 Maybridge3_000453 N#CCc1cccc(OCc2ccccc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E14 compound treatment 0.087 0.0207 1.33 0.086 0.0205 1.43 1.9543 0.9993 2075415 Maybridge3_000454 CSc1nc(nc(Nc2ccccc2)c1C#N)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E15 compound treatment 0.07 0.00366 0.24 0.07 0.00453 0.32 0.3902 0.9893 1386414 Maybridge3_000455 CSc1nnc(SC)n1CCNS(=O)(=O)c2cccc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E16 compound treatment 0.084 0.0177 1.14 0.078 0.0125 0.88 1.4226 0.9917 2075416 Maybridge3_000456 Clc1ccc(SCCOC(=O)c2cccc(Cl)c2)nc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E17 compound treatment 0.599 0.533 34.28 0.51 0.445 31.05 46.2018 0.9988 2075417 Maybridge3_000457 Cc1cc(ccc1Cl)c2csc(=S)n2Nc3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E18 compound treatment 0.081 0.0147 0.94 0.081 0.0155 1.09 1.4343 0.9976 2075418 Maybridge3_000458 Cc1cc(cc(n1)S(=O)(=O)CCOC(=O)c2cccc(Cl)c2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E19 compound treatment 0.071 0.00466 0.3 0.067 0.00153 0.11 0.2876 0.9037 2075419 Maybridge3_000459 N/C(=N\O)/CC(=O)Nc1ccc(F)c(F)c1F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E20 compound treatment 0.08 0.0137 0.88 0.08 0.0145 1.02 1.3394 0.9974 1540377 Maybridge3_000460 O=C(CSc1ccccc1)c2ccc3NC(=O)CCc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E21 compound treatment 0.075 0.00866 0.56 0.07 0.00453 0.32 0.6178 0.9641 2075420 Maybridge3_000461 CSC1=C(C(=SS1)SC)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E22 compound treatment 0.065 -0.00134 -0.09 0.067 0.00153 0.11 0.0145 0.1053 2075421 Maybridge3_000462 Cn1nc(OCC(=O)O)cc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E23 mock treatment 0.059 -0.00734 -0.47 0.059 -0.00647 -0.45 -0.6538 -0.9997 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 E24 mock treatment 0.066 -3.44E-4 -0.02 0.068 0.00253 0.18 0.1094 0.6138 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F01 compound treatment 0.079 0.0127 0.81 0.09 0.0245 1.71 1.7878 0.9422 2075422 Maybridge3_000463 O/N=C/Nc1nc(cs1)c2ccc3NC(=O)CCc3c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F02 compound treatment 0.105 0.0387 2.49 0.1 0.0345 2.41 3.4651 0.9999 1508220 Maybridge3_000464 Oc1c(c2ccccc2)c(=O)[nH]c3cc(F)ccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F03 compound treatment 0.081 0.0147 0.94 0.078 0.0125 0.88 1.2861 0.9993 2075423 Maybridge3_000465 FC(F)(F)c1cc(Br)c2[nH]c(=O)c(=O)[nH]c2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F04 compound treatment 0.081 0.0147 0.94 0.07 0.00453 0.32 0.8909 0.8953 2075424 Maybridge3_000466 CC(C)SC1OC(CO)C(O)C(O)C1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F05 compound treatment 0.079 0.0127 0.81 0.076 0.0105 0.74 1.0962 0.9987 1273132 Maybridge3_000467 COc1ccccc1CC(=O)NC2CC3CCC(C2)N3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F06 compound treatment 0.069 0.00266 0.17 0.081 0.0155 1.09 0.8881 0.8086 2075425 Maybridge3_000468 CC(=O)Nc1ccccc1OCCOc2ccccc2NC(=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F07 compound treatment 1.01 0.944 60.74 0.984 0.919 64.17 88.3225 0.9996 1315554 Maybridge3_000469 CCCc1cc(=O)c2c(O)cccc2o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F08 compound treatment 1.182 1.12 71.81 1.12 1.05 73.67 102.8689 0.9999 1133392 Maybridge3_000470 O=c1c(Cc2ccccc2)coc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F09 compound treatment 0.051 -0.0153 -0.99 0.056 -0.00947 -0.66 -1.1661 -0.981 1004558 Maybridge3_000471 CN(C)C(c1ccccc1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F10 compound treatment 0.14 0.0737 4.74 0.155 0.0895 6.25 7.775 0.9907 2075426 Maybridge3_000472 CC1CCCC1/C(=N/O)/c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F11 compound treatment 0.071 0.00466 0.3 0.071 0.00553 0.39 0.4852 0.9921 1635865 Maybridge3_000473 OC(=O)CCCc1ccc2OCOc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F12 compound treatment 0.086 0.0197 1.27 0.097 0.0315 2.2 2.4522 0.9653 1600318 Maybridge3_000474 CCOC(=O)COc1ccccc1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F13 compound treatment 0.211 0.145 9.31 0.166 0.101 7.02 11.5498 0.9903 1026021 Maybridge3_000475 Cc1nc2ccccc2c(=O)n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F14 compound treatment 0.124 0.0577 3.71 0.092 0.0265 1.85 3.9347 0.9485 1081820 Maybridge3_000476 CC(C)NC(=O)Oc1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F15 compound treatment 0.072 0.00566 0.36 0.083 0.0175 1.22 1.1234 0.8793 1476519 Maybridge3_000477 CNC(=O)c1cccc2cccc(Sc3ccccc3C(=O)O)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F16 compound treatment 0.072 0.00566 0.36 0.075 0.00953 0.67 0.7283 0.9596 1494580 Maybridge3_000478 Fc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)C4CCCCC4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F17 compound treatment 0.062 -0.00434 -0.28 0.071 0.00553 0.39 0.0755 0.1584 1725347 Maybridge3_000479 OC(=O)CCSc1ccccc1C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F18 compound treatment 0.49 0.424 27.27 0.381 0.316 22.04 34.8685 0.9944 1051989 Maybridge3_000480 Fc1ccc(cc1)c2cc(=O)c3ccccc3o2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F19 compound treatment 0.065 -0.00134 -0.09 0.066 5.31E-4 0.04 -0.0349 -0.371 1534976 Maybridge3_000481 CC(=O)N1Cc2ccccc2S31OC(=O)c4ccccc43 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F20 compound treatment 0.069 0.00266 0.17 0.071 0.00553 0.39 0.3941 0.9327 1570526 Maybridge3_000482 COC(=O)C1=C(N)CCCC1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F21 compound treatment 0.059 -0.00734 -0.47 0.064 -0.00147 -0.1 -0.4068 -0.841 2075427 Maybridge3_000483 CC(=O)NC(c1ccc(Cl)cc1)n2ccnc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F22 compound treatment 0.067 6.56E-4 0.04 0.064 -0.00147 -0.1 -0.0427 -0.3847 1077803 Maybridge3_000484 COc1cc(CC(=O)O)ccc1OCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F23 mock treatment 0.063 -0.00334 -0.22 0.062 -0.00347 -0.24 -0.3235 -0.9982 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 F24 mock treatment 0.068 0.00166 0.11 0.061 -0.00447 -0.31 -0.1454 -0.4407 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G01 compound treatment 0.091 0.0247 1.59 0.095 0.0295 2.06 2.581 0.9916 2075428 Maybridge3_000485 CC1CN(CC(C)O1)c2ccc(nn2)n3nc(C)cc3C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G02 compound treatment 0.126 0.0597 3.84 0.135 0.0695 4.86 6.1499 0.9932 2075429 Maybridge3_000486 Cc1cc(ccc1Cl)C(=O)CSc2c(F)c(F)c(C(=O)O)c(F)c2F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G03 compound treatment 0.067 6.56E-4 0.04 0.07 0.00453 0.32 0.2537 0.7944 1376755 Maybridge3_000487 CSc1ncccc1C(=O)NC(C)(C#N)C(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G04 compound treatment 0.064 -0.00234 -0.15 0.063 -0.00247 -0.17 -0.2286 -0.9978 1363604 Maybridge3_000488 Nc1ncccc1OCc2ccc(Cl)c(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G05 compound treatment 0.085 0.0187 1.2 0.095 0.0295 2.06 2.3079 0.9668 2075430 Maybridge3_000489 FC(F)(F)c1cccc(c1)C(=O)Nc2ccccc2C(=O)NC3CCCCNC3=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G06 compound treatment 0.056 -0.0103 -0.67 0.055 -0.0105 -0.73 -0.9879 -0.9989 1142600 Maybridge3_000490 CCOC(=O)c1cnc2c(F)ccc(F)c2c1Oc3cncc(Cl)c3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G07 compound treatment 0.096 0.0297 1.91 0.094 0.0285 1.99 2.7591 0.9998 2075431 Maybridge3_000491 NS(=O)(=O)c1ccc(cc1)n2nc(cc2c3cccs3)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G08 compound treatment 0.132 0.0657 4.23 0.11 0.0445 3.11 5.188 0.9886 1303519 Maybridge3_000492 OC(=O)CNC(=O)c1cccnc1Oc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G09 compound treatment 0.08 0.0137 0.88 0.073 0.00753 0.53 0.9936 0.9699 1181739 Maybridge3_000493 Clc1c(sc2ccccc12)C(=O)Oc3ccc(CC#N)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G10 compound treatment 0.88 0.814 52.37 0.897 0.832 58.09 78.1081 0.9987 1627842 Maybridge3_000494 COC(=O)CNC(=O)c1cccnc1Oc2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G11 compound treatment 0.061 -0.00534 -0.34 0.063 -0.00247 -0.17 -0.3652 -0.949 1548800 Maybridge3_000495 CC(C)(C)c1ccc(cc1)C(=O)Nc2ccc(Oc3cccnc3)nc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G12 compound treatment 0.085 0.0187 1.2 0.073 0.00753 0.53 1.2211 0.9314 2075432 Maybridge3_000496 OC(=O)CNC(=O)c1ccccc1N(CC=C)C(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G13 compound treatment 0.082 0.0157 1.01 0.087 0.0215 1.5 1.7762 0.981 1461087 Maybridge3_000497 Cc1ccc(C)n1c2ncccc2O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G14 compound treatment 1.056 0.99 63.7 1.052 0.987 68.92 93.7752 0.9992 2075433 Maybridge3_000498 CSc1nc(C)nc(Nc2ccccc2)c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G15 compound treatment 0.041 -0.0253 -1.63 0.041 -0.0245 -1.71 -2.3622 -0.9997 1218801 Maybridge3_000499 CCSc1ncccc1C(=O)Oc2cc(C)nn2c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G16 compound treatment 0.252 0.186 11.95 0.215 0.15 10.45 15.8364 0.9978 2075434 Maybridge3_000500 CN(C)c1nc(nc(Nc2cccc(c2)C(F)(F)F)c1C#N)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G17 compound treatment 0.346 0.28 18.0 0.309 0.244 17.01 24.758 0.9996 2075435 Maybridge3_000501 FC(F)(F)c1ccc(cc1)C(=O)Oc2cccc3[nH]ccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G18 compound treatment 0.073 0.00666 0.43 0.073 0.00753 0.53 0.675 0.9948 1668703 Maybridge3_000502 CCOC(=O)c1c(C)c(C#N)c(NC(=O)C(C)(C)C)n1c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G19 compound treatment 0.091 0.0247 1.59 0.11 0.0445 3.11 3.3219 0.9512 2075436 Maybridge3_000503 O/N=C/Nc1ncc(cc1Cl)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G20 compound treatment 0.064 -0.00234 -0.15 0.063 -0.00247 -0.17 -0.2286 -0.9978 1419348 Maybridge3_000504 CC(C)(C)SCC(=O)c1ccc2NC(=O)CCc2c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G21 compound treatment 0.12 0.0537 3.45 0.127 0.0615 4.3 5.4816 0.9941 2075437 Maybridge3_000505 CS(=O)(=O)N(Cc1ccc(Cl)cc1)c2ncc(cc2Cl)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G22 compound treatment 0.088 0.0217 1.39 0.09 0.0245 1.71 2.1974 0.9947 2075438 Maybridge3_000506 Cn1nc(OCC(=O)Nc2ccc(Cl)cc2Cl)cc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G23 mock treatment 0.062 -0.00434 -0.28 0.06 -0.00547 -0.38 -0.4678 -0.9882 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 G24 mock treatment 0.066 -3.44E-4 -0.02 0.065 -4.69E-4 -0.03 -0.0388 -0.9818 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H01 compound treatment 0.11 0.0437 2.81 0.114 0.0485 3.39 4.3843 0.9956 1528340 Maybridge3_000507 OCc1ccc(OCc2ccc(F)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H02 compound treatment 0.053 -0.0133 -0.86 0.062 -0.00347 -0.24 -0.7787 -0.8725 1058115 Maybridge3_000508 C(N1CCCCC1)n2c3ccccc3c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H03 compound treatment 0.076 0.00966 0.62 0.092 0.0265 1.85 1.7501 0.8952 1676832 Maybridge3_000509 OC(=O)CC(C(=O)NCc1ccccc1)C2=CCCCC2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H04 compound treatment 0.082 0.0157 1.01 0.077 0.0115 0.81 1.2822 0.9938 1087972 Maybridge3_000510 OCC1OC(Sc2ccccc2)C(O)C(O)C1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H05 compound treatment 0.15 0.0837 5.38 0.17 0.105 7.3 8.9711 0.9888 1066281 Maybridge3_000511 c1ccc(cc1)c2cccc(n2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H06 compound treatment 0.085 0.0187 1.2 0.086 0.0205 1.43 1.8633 0.9961 2075439 Maybridge3_000512 CC1(C)SC(NC1C(=O)O)c2ccc(Cl)cc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H07 compound treatment 1.449 1.38 88.99 1.445 1.38 96.37 131.0753 0.9992 1255440 Maybridge3_000513 CCCc1cc(=O)c2c(O)ccc(OC)c2o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H08 compound treatment 0.052 -0.0143 -0.92 0.058 -0.00747 -0.52 -1.0218 -0.9635 1220272 Maybridge3_000514 O=C1C(COc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H09 compound treatment 0.671 0.605 38.92 0.573 0.508 35.46 52.5909 0.9989 1740369 Maybridge3_000515 OCC1c2ccccc2Oc3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H10 compound treatment 0.072 0.00566 0.36 0.079 0.0135 0.95 0.9259 0.914 1408710 Maybridge3_000516 COC(=O)C(CO)NS(=O)(=O)c1ccc(C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H11 compound treatment 0.487 0.421 27.08 0.537 0.472 32.94 42.4382 0.9953 1524491 Maybridge3_000517 CC(=O)Nc1ccc-2c(CCc3ccccc32)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H12 compound treatment 0.06 -0.00634 -0.41 0.064 -0.00147 -0.1 -0.3613 -0.8581 2075440 Maybridge3_000518 CC1(C)CN=C(Nc2ccc(F)c(Cl)c2)S1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H13 compound treatment 0.076 0.00966 0.62 0.086 0.0205 1.43 1.4537 0.93 1072271 Maybridge3_000519 CC(=O)Nc1ccc(CC#N)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H14 compound treatment 0.132 0.0657 4.23 0.145 0.0795 5.56 6.9169 0.9909 1064797 Maybridge3_000520 O=C(NC1CCCCC1)Oc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H15 compound treatment 0.087 0.0207 1.33 0.079 0.0135 0.95 1.6085 0.986 1330529 Maybridge3_000521 CNC(=O)c1cccc2cccc(Sc3ccccc3C(=O)OC)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H16 compound treatment 0.07 0.00366 0.24 0.081 0.0155 1.09 0.9336 0.8409 1425252 Maybridge3_000522 Cc1nnsc1C(=O)N2CCc3[nH]c4ccc(F)cc4c3C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H17 compound treatment 1.123 1.06 68.01 1.198 1.13 79.12 104.0367 0.9972 1731122 Maybridge3_000523 CCOC(=O)c1ccccc1Sc2ccccc2C(=O)OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H18 compound treatment 0.054 -0.0123 -0.79 0.051 -0.0145 -1.01 -1.2765 -0.9929 2075441 Maybridge3_000524 NC1=C(C#N)C(C(=C(N)S1)C#N)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H19 compound treatment 0.062 -0.00434 -0.28 0.065 -4.69E-4 -0.03 -0.2209 -0.7846 2075442 Maybridge3_000525 CN1[S+](c2ccccc2C(=O)O)c3cccc4cccc(C1=O)c34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H20 compound treatment 0.093 0.0267 1.72 0.112 0.0465 3.25 3.5118 0.9554 1741501 Maybridge3_000526 OC(=O)c1ncccc1C(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H21 compound treatment 0.063 -0.00334 -0.22 0.067 0.00153 0.11 -0.0765 -0.3185 1081833 Maybridge3_000527 COC(=S)Nc1ccccc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H22 compound treatment 0.058 -0.00834 -0.54 0.056 -0.00947 -0.66 -0.8475 -0.9947 1016602 Maybridge3_000528 C1CN(CCO1)c2cc(nc3ccccc23)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H23 mock treatment 0.06 -0.00634 -0.41 0.062 -0.00347 -0.24 -0.4601 -0.969 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 H24 mock treatment 0.055 -0.0113 -0.73 0.067 0.00153 0.11 -0.4406 -0.5971 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I01 compound treatment 0.192 0.126 8.09 0.183 0.118 8.21 11.5248 1.0 2075443 Maybridge3_000529 Cc1cc(C)n(n1)c2ccc(SCc3ccc(Cl)cc3)nn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I02 compound treatment 0.122 0.0557 3.58 0.138 0.0725 5.07 6.116 0.9856 2075444 Maybridge3_000530 FC(F)(F)Oc1ccc(N/C=C(\C#N)/c2nc3ccccc3[nH]2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I03 compound treatment 0.178 0.112 7.19 0.125 0.0595 4.16 8.0225 0.9662 2075445 Maybridge3_000531 Cc1cc(SCc2n[nH]c3oc(=O)cc(C)c23)c(C)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I04 compound treatment 0.079 0.0127 0.81 0.073 0.00753 0.53 0.9481 0.9776 2075446 Maybridge3_000532 COC(=O)CSc1nnc(SC)n1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I05 compound treatment 0.556 0.49 31.52 0.574 0.509 35.53 47.4063 0.9982 1695135 Maybridge3_000533 CCCc1cc(OC(=O)c2cccnc2Oc3ccccc3)n(C)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I06 compound treatment 0.32 0.254 16.33 0.242 0.177 12.33 20.265 0.9904 1325490 Maybridge3_000534 COc1ccc(Oc2ccc(NC(=O)Cc3cccs3)cn2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I07 compound treatment 0.093 0.0267 1.72 0.083 0.0175 1.22 2.0792 0.9863 1625906 Maybridge3_000535 Clc1ccc(Cl)c(Oc2ccccc2NC(=O)CC#N)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I08 compound treatment 0.07 0.00366 0.24 0.068 0.00253 0.18 0.2914 0.9901 2075447 Maybridge3_000536 OC(=O)CSc1ccc(F)cc1Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I09 compound treatment 0.055 -0.0113 -0.73 0.315 0.25 17.43 11.8102 0.6769 2075448 Maybridge3_000537 Clc1ccc(OC(=O)NC(=O)c2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I10 compound treatment 0.09 0.0237 1.52 0.076 0.0105 0.74 1.5969 0.9443 1187652 Maybridge3_000538 COc1ccc(OC)c(SCC(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I11 compound treatment 0.077 0.0107 0.69 0.077 0.0115 0.81 1.0546 0.9968 2075449 Maybridge3_000539 FC(F)(F)c1ccc(cc1)C(=O)Nc2ccc(Oc3cccnc3)nc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I12 compound treatment 0.078 0.0117 0.75 0.074 0.00853 0.6 0.9519 0.9935 2075450 Maybridge3_000540 CSc1nc(C)[nH]c(=O)c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I13 compound treatment 0.041 -0.0253 -1.63 0.042 -0.0235 -1.64 -2.3128 -1.0 2075451 Maybridge3_000541 Clc1cncc(OC(=O)c2cc3ccccc3s2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I14 compound treatment 0.766 0.7 45.03 0.7 0.635 44.33 63.1882 1.0 2075452 Maybridge3_000542 Clc1cccc(c1)C(=O)OCCSc2ncccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I15 compound treatment 0.039 -0.0273 -1.76 0.043 -0.0225 -1.57 -2.3544 -0.9984 2075453 Maybridge3_000543 Cc1cc(OC(=O)c2ccccc2)n(n1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I16 compound treatment 0.245 0.179 11.5 0.186 0.121 8.42 14.0852 0.9883 2075454 Maybridge3_000544 CSc1nc(C)nc(N(C)C)c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I17 compound treatment 0.059 -0.00734 -0.47 0.187 0.122 8.49 5.6692 0.6667 1382015 Maybridge3_000545 Cc1ccc(cc1)C(=O)Oc2cccc3[nH]ccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I18 compound treatment 0.063 -0.00334 -0.22 0.058 -0.00747 -0.52 -0.5211 -0.9233 1277053 Maybridge3_000546 NC(=O)c1ccc(cc1)c2ccc(cc2)C(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I19 compound treatment 0.064 -0.00234 -0.15 0.057 -0.00847 -0.59 -0.525 -0.8599 2075455 Maybridge3_000547 FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I20 compound treatment 0.117 0.0507 3.26 0.123 0.0575 4.02 5.1475 0.9946 1327270 Maybridge3_000548 Cc1nc(cs1)c2cc(C#N)c(NCc3ccccc3)nc2C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I21 compound treatment 0.056 -0.0103 -0.67 0.057 -0.00847 -0.59 -0.8891 -0.9983 2075456 Maybridge3_000549 FC(F)(F)c1ccc(nc1)S(=O)(=O)CC(=O)Nc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I22 compound treatment 0.058 -0.00834 -0.54 0.058 -0.00747 -0.52 -0.7487 -0.9999 2075457 Maybridge3_000550 Cn1nc(OCC(=O)NC(C)(C)C)cc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I23 mock treatment 0.064 -0.00234 -0.15 0.056 -0.00947 -0.66 -0.5744 -0.8466 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 I24 mock treatment 0.077 0.0107 0.69 0.081 0.0155 1.09 1.2522 0.9755 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J01 compound treatment 0.068 0.00166 0.11 0.075 0.00953 0.67 0.5462 0.81 1256256 Maybridge3_000551 Cc1cc(Cl)ccc1Oc2ncccc2N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J02 compound treatment 0.204 0.138 8.86 0.245 0.18 12.54 15.1337 0.9855 2075458 Maybridge3_000552 CC(C)n1c2ccccc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J03 compound treatment 0.079 0.0127 0.81 0.074 0.00853 0.6 0.9975 0.9882 1244194 Maybridge3_000553 CC(=CC(=O)ON1C(=O)C2C3OC(C=C3)C2C1=O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J04 compound treatment 0.048 -0.0183 -1.18 0.043 -0.0225 -1.57 -1.9448 -0.9901 2075459 Maybridge3_000554 COc1ccc(cc1)C(=O)/C=C/Nc2ccccc2C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J05 compound treatment 0.064 -0.00234 -0.15 0.069 0.00353 0.25 0.0678 0.2344 2075460 Maybridge3_000555 COc1cc(CCC(C)NCc2ccccc2)ccc1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J06 compound treatment 0.099 0.0327 2.1 0.097 0.0315 2.2 3.0439 0.9997 2075461 Maybridge3_000556 c1ccc(cc1)c2cccnn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J07 compound treatment 0.172 0.106 6.8 0.162 0.0965 6.74 9.5772 1.0 1553196 Maybridge3_000557 CCCc1c(N)ccc2c(=O)cc(oc12)C(=O)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J08 compound treatment 0.147 0.0807 5.19 0.147 0.0815 5.7 7.6984 0.9989 1607994 Maybridge3_000558 COc1ccccc1c2coc3ccccc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J09 compound treatment 0.082 0.0157 1.01 0.088 0.0225 1.57 1.8256 0.9768 1541139 Maybridge3_000559 O=C(Oc1cccnc1)C2c3ccccc3Oc4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J10 compound treatment 0.085 0.0187 1.2 0.084 0.0185 1.29 1.7645 0.9993 1002178 Maybridge3_000560 CCOC(=O)C1CC(=O)C(CC1=O)C(=O)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J11 compound treatment 0.063 -0.00334 -0.22 0.054 -0.0115 -0.8 -0.7187 -0.8663 2075462 Maybridge3_000561 COC(=O)Cc1nc(oc1C)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J12 compound treatment 0.044 -0.0223 -1.44 0.048 -0.0175 -1.22 -1.8799 -0.9967 2075463 Maybridge3_000562 Cc1ccc(SC#N)c(N)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J13 compound treatment 0.079 0.0127 0.81 0.086 0.0205 1.43 1.5902 0.9641 2075464 Maybridge3_000563 c1ccc(cc1)c2cnc(nc2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J14 compound treatment 0.082 0.0157 1.01 0.069 0.00353 0.25 0.887 0.855 1019721 Maybridge3_000564 COc1ccc(NC(=O)Oc2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J15 compound treatment 0.075 0.00866 0.56 0.074 0.00853 0.6 0.8154 0.9994 1367336 Maybridge3_000565 CNC(=O)c1ccccc1Sc2cccc3cccc(COC(=O)C)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J16 compound treatment 0.068 0.00166 0.11 0.063 -0.00247 -0.17 -0.0466 -0.2297 1164670 Maybridge3_000566 Cc1[nH]c2ccccc2c1CC#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J17 compound treatment 0.071 0.00466 0.3 0.078 0.0125 0.88 0.8309 0.898 1265803 Maybridge3_000567 OCc1cccc2cccc(S(=O)c3ccccc3C(=O)O)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J18 compound treatment 0.061 -0.00534 -0.34 0.058 -0.00747 -0.52 -0.6122 -0.9796 2075465 Maybridge3_000568 CCN(CC)S(=O)(=O)C1CCS(=O)(=O)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J19 compound treatment 0.069 0.00266 0.17 0.07 0.00453 0.32 0.3447 0.9582 1431098 Maybridge3_000569 CC(=O)NC(=O)c1cccc2cccc(I)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J20 compound treatment 0.864 0.798 51.34 0.867 0.802 55.99 75.898 0.9991 1588875 Maybridge3_000570 Oc1ccc2OC(CC(=O)c2c1)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J21 compound treatment 0.06 -0.00634 -0.41 0.059 -0.00647 -0.45 -0.6083 -0.9987 1462691 Maybridge3_000571 Oc1ccccc1N2C(=O)c3cccc4cccc(C2=O)c34 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J22 compound treatment 0.059 -0.00734 -0.47 0.056 -0.00947 -0.66 -0.802 -0.9864 1610135 Maybridge3_000572 CN(C)CCNc1cc(nc2ccccc12)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J23 mock treatment 0.057 -0.00934 -0.6 0.061 -0.00447 -0.31 -0.646 -0.9534 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 J24 mock treatment 0.069 0.00266 0.17 0.065 -4.69E-4 -0.03 0.0977 0.5615 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K01 compound treatment 0.121 0.0547 3.52 0.103 0.0375 2.62 4.3415 0.9895 2075466 Maybridge3_000573 Cc1cc(C)n(n1)c2ccc(SCC(=O)Nc3ccc(Cl)cc3)nn2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K02 compound treatment 0.119 0.0527 3.39 0.111 0.0455 3.18 4.6457 0.9995 2075467 Maybridge3_000574 FC(F)(F)c1cccc(N/C=C(\C#N)/c2nc3ccccc3[nH]2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K03 compound treatment 0.202 0.136 8.73 0.185 0.12 8.35 12.0788 0.9998 1376910 Maybridge3_000575 Cc1cc(=O)oc2n(nc(c3ccccc3)c12)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K04 compound treatment 0.052 -0.0143 -0.92 0.052 -0.0135 -0.94 -1.3182 -1.0 2075468 Maybridge3_000576 FC(F)(F)c1ccc(cc1)C(=O)OCCS(=O)(=O)c2ccc(cn2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K05 compound treatment 0.097 0.0307 1.97 0.086 0.0205 1.43 2.4095 0.9877 1638249 Maybridge3_000577 Cc1cc(C)n(n1)c2ccc(cc2)S(=O)(=O)N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K06 compound treatment 0.289 0.223 14.33 0.238 0.173 12.05 18.6565 0.9963 1231832 Maybridge3_000578 Clc1cc(Cl)cc(CNC(=O)Cc2cccs2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K07 compound treatment 0.079 0.0127 0.81 0.062 -0.00347 -0.24 0.4047 0.4761 2075469 Maybridge3_000579 CSc1ncccc1C(=O)N(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K08 compound treatment 0.064 -0.00234 -0.15 0.065 -4.69E-4 -0.03 -0.1298 -0.841 2075470 Maybridge3_000580 OC(=O)CSc1cccc(c1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K09 compound treatment 0.096 0.0297 1.91 0.087 0.0215 1.5 2.4134 0.993 2075471 Maybridge3_000581 Fc1cccc(F)c1OC(=O)NC(=O)c2c(Cl)cccc2Cl 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K10 compound treatment 0.091 0.0247 1.59 0.085 0.0195 1.36 2.087 0.9972 2075472 Maybridge3_000582 Cc1cc(OCC(=O)c2cccc(c2)C(F)(F)F)n3cnnc3n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K11 compound treatment 0.098 0.0317 2.04 0.09 0.0245 1.71 2.6526 0.9963 2075473 Maybridge3_000583 Clc1ccc(cc1)C(=O)Nc2ccc(Oc3cccnc3)nc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K12 compound treatment 0.113 0.0467 3.0 0.113 0.0475 3.32 4.4714 0.9987 2075474 Maybridge3_000584 COC(=O)CSc1nc(C)nc(SC)c1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K13 compound treatment 0.067 6.56E-4 0.04 0.068 0.00253 0.18 0.1549 0.852 2075475 Maybridge3_000585 Clc1cncc(OC(=O)c2cccs2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K14 compound treatment 0.067 6.56E-4 0.04 0.069 0.00353 0.25 0.2043 0.8163 2075476 Maybridge3_000586 FC(F)(F)c1cccnc1S(=O)(=O)CCOC(=O)c2cccc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K15 compound treatment 0.56 0.494 31.77 0.531 0.466 32.52 45.4642 0.9999 1399454 Maybridge3_000587 COC(=O)c1c(OC)ccc(c1OC)n2cccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K16 compound treatment 0.071 0.00466 0.3 0.058 -0.00747 -0.52 -0.157 -0.261 2075477 Maybridge3_000588 COC(=O)C(C)(C)S(=O)(=O)c1ccc(cn1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K17 compound treatment 0.2 0.134 8.6 0.188 0.123 8.56 12.1359 1.0 1203424 Maybridge3_000589 Fc1cccc(F)c1C(=O)Oc2cccc3[nH]ccc23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K18 compound treatment 0.063 -0.00334 -0.22 0.072 0.00653 0.46 0.1704 0.3379 1414362 Maybridge3_000590 CC(=O)Nc1cc(C)ccc1OC(C)(C)C(=O)OC(C)(C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K19 compound treatment 0.059 -0.00734 -0.47 0.062 -0.00347 -0.24 -0.5056 -0.9518 2075478 Maybridge3_000591 Nc1cccnc1Oc2ccc(F)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K20 compound treatment 0.156 0.0897 5.77 0.158 0.0925 6.46 8.6514 0.9984 1605002 Maybridge3_000592 CCOC(=O)c1[nH]c(Cc2[nH]c(C(=O)OCC)c(C)c2C)c(C)c1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K21 compound treatment 0.06 -0.00634 -0.41 0.075 0.00953 0.67 0.1821 0.2331 2075479 Maybridge3_000593 FC(F)(F)c1cccc(c1)S(=O)(=O)N(CCC#N)Cc2ccco2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K22 compound treatment 0.058 -0.00834 -0.54 0.058 -0.00747 -0.52 -0.7487 -0.9999 2075480 Maybridge3_000594 CN(C)C(=O)C(C)(C)Oc1cc(n(C)n1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K23 mock treatment 0.064 -0.00234 -0.15 0.061 -0.00447 -0.31 -0.3274 -0.9443 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 K24 mock treatment 0.071 0.00466 0.3 0.066 5.31E-4 0.04 0.2382 0.7886 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L01 compound treatment 0.298 0.232 14.91 0.106 0.0405 2.83 12.5455 0.8266 1636894 Maybridge3_000595 Cc1nc(c(o1)c2ccccc2)c3ccc(NC(=O)C(C)(C)C)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L02 compound treatment 0.088 0.0217 1.39 0.087 0.0215 1.5 2.0492 0.9993 1057689 Maybridge3_000596 OCn1c2ccccc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L03 compound treatment 0.038 -0.0283 -1.82 0.038 -0.0275 -1.92 -2.6469 -0.9997 1250886 Maybridge3_000597 Clc1ccc(s1)C(=O)ON2C(=O)C3C4OC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L04 compound treatment 0.107 0.0407 2.62 0.114 0.0485 3.39 4.2477 0.9918 1337528 Maybridge3_000598 CCSc1ncc(c2nnnn2c3ccccc3)c(n1)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L05 compound treatment 0.097 0.0307 1.97 0.084 0.0185 1.29 2.3107 0.9791 2075481 Maybridge3_000599 Cc1oc(nc1CCO)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L06 compound treatment 0.138 0.0717 4.61 0.148 0.0825 5.77 7.3382 0.9939 1416638 Maybridge3_000600 CCCCn1c(=O)cc(O)c2ccccc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L07 compound treatment 0.087 0.0207 1.33 0.085 0.0195 1.36 1.9049 0.9999 1179929 Maybridge3_000601 COc1ccc(OCCN)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L08 compound treatment 0.116 0.0497 3.2 0.121 0.0555 3.88 5.0032 0.9954 2075482 Maybridge3_000602 COc1ccc(cc1)c2coc3ccccc3c2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L09 compound treatment 0.039 -0.0273 -1.76 0.04 -0.0255 -1.78 -2.5026 -1.0 1077052 Maybridge3_000603 O=C(C(SC#N)c1ccccc1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L10 compound treatment 0.053 -0.0133 -0.86 0.052 -0.0135 -0.94 -1.2726 -0.999 1077090 Maybridge3_000604 OC(=O)C1CC2CCC1C=C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L11 compound treatment 0.279 0.213 13.69 0.27 0.205 14.29 19.7821 0.9998 2075483 Maybridge3_000605 O=C(CCC(=O)c1ccccc1)OCc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L12 compound treatment 0.076 0.00966 0.62 0.075 0.00953 0.67 0.9103 0.9994 2075484 Maybridge3_000606 O=c1ccc(no1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L13 compound treatment 0.084 0.0177 1.14 0.096 0.0305 2.13 2.3118 0.9566 1703544 Maybridge3_000607 O=c1[nH]c2ccccc2c3oc(nc13)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L14 compound treatment 0.109 0.0427 2.75 0.079 0.0135 0.95 2.6098 0.8988 2075485 Maybridge3_000608 Clc1ccc(OC(=O)NCCc2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L15 compound treatment 0.046 -0.0203 -1.31 0.049 -0.0165 -1.15 -1.7394 -0.9979 1337655 Maybridge3_000609 CNC(=O)c1ccccc1Sc2cccc3cccc(C(=O)NC)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L16 compound treatment 0.061 -0.00534 -0.34 0.072 0.00653 0.46 0.0794 0.139 2075486 Maybridge3_000610 CSC(=S)Nc1ccc(Br)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L17 compound treatment 0.067 6.56E-4 0.04 0.08 0.0145 1.02 0.7477 0.7359 2075487 Maybridge3_000611 COC(=O)c1ccccc1S(=O)c2cccc3cccc(CO)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L18 compound treatment 0.067 6.56E-4 0.04 0.061 -0.00447 -0.31 -0.1909 -0.6059 2075488 Maybridge3_000612 OC(=O)CSC1CCS(=O)(=O)C1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L19 compound treatment 0.059 -0.00734 -0.47 0.072 0.00653 0.46 -0.0116 -0.0177 1640133 Maybridge3_000613 COc1ccc(NC(=O)C)c(c1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L20 compound treatment 0.068 0.00166 0.11 0.06 -0.00547 -0.38 -0.1948 -0.491 2075489 Maybridge3_000614 Nc1nnc(Nc2ccc(Cl)cc2)[nH]1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L21 compound treatment 0.084 0.0177 1.14 0.087 0.0215 1.5 1.8672 0.9904 2075490 Maybridge3_000615 c1c(sc2nc(nnc12)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L22 compound treatment 0.047 -0.0193 -1.25 0.047 -0.0185 -1.29 -1.7927 -0.9998 1005928 Maybridge3_000616 Cc1ccc(CCC(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L23 mock treatment 0.056 -0.0103 -0.67 0.064 -0.00147 -0.1 -0.5433 -0.8066 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 L24 mock treatment 0.067 6.56E-4 0.04 0.062 -0.00347 -0.24 -0.1415 -0.5752 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M01 compound treatment 0.097 0.0307 1.97 0.106 0.0405 2.83 3.3974 0.9844 2075491 Maybridge3_000617 Cn1cc(C(=O)Nc2ccc(F)c(Cl)c2)c(N)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M02 compound treatment 0.077 0.0107 0.69 0.076 0.0105 0.74 1.0052 0.9994 2075492 Maybridge3_000618 CSc1nc2nccc(NC(=O)c3cccc(C)c3)n2n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M03 compound treatment 0.129 0.0627 4.03 0.108 0.0425 2.97 4.9526 0.9887 2075493 Maybridge3_000619 CCCc1cc(=O)oc2n(C)nc(C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M04 compound treatment 0.04 -0.0263 -1.7 0.041 -0.0245 -1.71 -2.4077 -1.0 2075494 Maybridge3_000620 FC(F)(F)c1ccc(nc1)S(=O)(=O)CCOC(=O)Nc2ccc(Cl)cc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M05 compound treatment 0.076 0.00966 0.62 0.074 0.00853 0.6 0.8609 0.9998 2075495 Maybridge3_000621 Fc1ccc(CNC(=O)CC#N)c(F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M06 compound treatment 0.288 0.222 14.27 0.296 0.231 16.1 21.4761 0.9982 1178380 Maybridge3_000622 Fc1ccc(c2ccc(CNC(=O)Cc3cccs3)o2)c(F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M07 compound treatment 0.074 0.00766 0.49 0.079 0.0135 0.95 1.0169 0.9539 1222852 Maybridge3_000623 O=C1CS(=O)(=O)N(Cc2ccccc2)c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M08 compound treatment 0.072 0.00566 0.36 0.084 0.0185 1.29 1.1728 0.8721 1529004 Maybridge3_000624 COc1ccc(OC)c(Sc2ncccc2C(=O)O)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M09 compound treatment 0.041 -0.0253 -1.63 0.041 -0.0245 -1.71 -2.3622 -0.9997 2075496 Maybridge3_000625 Oc1ccc(cc1)/C(=C/c2ccc(cc2)C(F)(F)F)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M10 compound treatment 0.082 0.0157 1.01 0.088 0.0225 1.57 1.8256 0.9768 2075497 Maybridge3_000626 CSc1ncccc1C2=N/C(=C\c3ccc(Cl)cc3)/C(=O)O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M11 compound treatment 0.087 0.0207 1.33 0.084 0.0185 1.29 1.8555 0.9999 1507727 Maybridge3_000627 Cc1ccc(cc1)S(=O)(=O)Nc2ccc(Oc3cccnc3)nc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M12 compound treatment 0.072 0.00566 0.36 0.068 0.00253 0.18 0.3825 0.945 2075498 Maybridge3_000628 CSc1nc(nc(Sc2ccccc2)c1C#N)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M13 compound treatment 0.08 0.0137 0.88 0.09 0.0245 1.71 1.8333 0.9519 1127265 Maybridge3_000629 Clc1cc(Cl)cc(COc2ccc(CC#N)cc2)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M14 compound treatment 0.077 0.0107 0.69 0.069 0.00353 0.25 0.6594 0.9047 2075499 Maybridge3_000630 CSC1=C(C#N)C(=C(C#N)C#N)NC(=N1)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M15 compound treatment 0.074 0.00766 0.49 0.082 0.0165 1.15 1.1651 0.9279 1645179 Maybridge3_000631 O=C(Nc1nnc(SCC#N)s1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M16 compound treatment 0.063 -0.00334 -0.22 0.081 0.0155 1.09 0.615 0.556 2075500 Maybridge3_000632 CC(C)(C(=O)Nc1ccccc1)S(=O)(=O)c2ccc(cn2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M17 compound treatment 0.365 0.299 19.22 0.346 0.281 19.6 27.4505 1.0 1582377 Maybridge3_000633 CCOC(=O)c1cc(NC(=O)C)ccc1Oc2cncc(Cl)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M18 compound treatment 0.062 -0.00434 -0.28 0.057 -0.00847 -0.59 -0.616 -0.9414 2075501 Maybridge3_000634 CC(C)(Oc1ccc(C#N)cc1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M19 compound treatment 0.075 0.00866 0.56 0.078 0.0125 0.88 1.013 0.9762 2075502 Maybridge3_000635 Fc1ccc(Oc2ccc(NC(=O)/C=C/c3ccccc3)cn2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M20 compound treatment 0.079 0.0127 0.81 0.081 0.0155 1.09 1.3432 0.99 2075503 Maybridge3_000636 CCCC1=C(C(=O)NC1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M21 compound treatment 0.229 0.163 10.47 0.228 0.163 11.35 15.4317 0.9992 2075504 Maybridge3_000637 CCOC(=O)NC1=Nc2ccccc2NC=C1C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M22 compound treatment 0.054 -0.0123 -0.79 0.072 0.00653 0.46 -0.2392 -0.261 2075505 Maybridge3_000638 Cn1nc(OC(C)(C)C(=O)NC(C)(C)C)cc1C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M23 mock treatment 0.06 -0.00634 -0.41 0.068 0.00253 0.18 -0.1637 -0.3679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 M24 mock treatment 0.072 0.00566 0.36 0.067 0.00153 0.11 0.3331 0.8778 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N01 compound treatment 0.181 0.115 7.38 0.179 0.114 7.93 10.8266 0.9994 2075506 Maybridge3_000639 CC(=CC(=O)Oc1ccc(cc1)n2nnnc2SCC=C)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N02 compound treatment 0.089 0.0227 1.46 0.094 0.0285 1.99 2.4405 0.9882 2075507 Maybridge3_000640 C(C1CS1)n2c3ccccc3c4ccccc24 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N03 compound treatment 0.068 0.00166 0.11 0.062 -0.00347 -0.24 -0.096 -0.3625 2075508 Maybridge3_000641 FC(F)(F)Oc1ccc(CON2C(=O)C3C4OC(C=C4)C3C2=O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N04 compound treatment 0.068 0.00166 0.11 0.076 0.0105 0.74 0.5956 0.8012 2075509 Maybridge3_000642 CCOC(=O)c1c(O)cc(C)[nH]c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N05 compound treatment 0.075 0.00866 0.56 0.069 0.00353 0.25 0.5684 0.9328 2075510 Maybridge3_000643 CN1C2CCC1CC(C2)NC(=O)c3ccc(Cl)cc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N06 compound treatment 0.074 0.00766 0.49 0.069 0.00353 0.25 0.5229 0.9488 1447827 Maybridge3_000644 OC(=O)C(=C1C2CC3CC(C2)CC1C3)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N07 compound treatment 0.499 0.433 27.85 0.451 0.386 26.93 38.7361 0.9999 1706281 Maybridge3_000645 CCOC(=O)c1c(C)[nH]c2ccc(OCC=C)cc12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N08 compound treatment 1.304 1.24 79.66 1.312 1.25 87.08 117.9059 0.999 1203832 Maybridge3_000646 COc1ccc(Nc2nc3ccccc3nc2c4ccccc4)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N09 compound treatment 0.073 0.00666 0.43 0.073 0.00753 0.53 0.675 0.9948 1034187 Maybridge3_000647 OCc1ccccc1c2ccccc2CO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N10 compound treatment 0.075 0.00866 0.56 0.069 0.00353 0.25 0.5684 0.9328 1363311 Maybridge3_000648 CCOc1ccc(cc1)N2Cc3cc(OCC)ccc3N=C2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N11 compound treatment 0.097 0.0307 1.97 0.104 0.0385 2.69 3.2986 0.9883 2075511 Maybridge3_000649 COc1cccc(c1)/C(=C/O)/C#N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N12 compound treatment 0.09 0.0237 1.52 0.081 0.0155 1.09 1.8439 0.9862 1698210 Maybridge3_000650 O=C(N1CCOCC1)c2cccc3Cc4ccccc4-c32 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N13 compound treatment 0.069 0.00266 0.17 0.073 0.00753 0.53 0.4929 0.891 2075512 Maybridge3_000651 O=C1OCC(=C1)Nc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N14 compound treatment 0.208 0.142 9.12 0.213 0.148 10.31 13.735 0.9981 1185125 Maybridge3_000652 COc1ccc(OC(=O)NCCc2ccccc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N15 compound treatment 0.192 0.126 8.09 0.144 0.0785 5.49 9.5983 0.9821 1092424 Maybridge3_000653 CNC(=O)c1ccccc1Sc2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N16 compound treatment 0.056 -0.0103 -0.67 0.058 -0.00747 -0.52 -0.8397 -0.9927 2075513 Maybridge3_000654 CSC(=S)Nc1ccc(NC(=O)C)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N17 compound treatment 0.061 -0.00534 -0.34 0.078 0.0125 0.88 0.3758 0.3996 1364067 Maybridge3_000655 CNC(=O)c1ccccc1S(=O)c2cccc3cccc(CO)c23 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N18 compound treatment 0.082 0.0157 1.01 0.085 0.0195 1.36 1.6774 0.9889 1191735 Maybridge3_000656 COc1ccc(NC(CC(=O)C2CC2)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N19 compound treatment 0.058 -0.00834 -0.54 0.055 -0.0105 -0.73 -0.8969 -0.9885 2075514 Maybridge3_000657 Cc1ccc(I)c(c1)C(=O)O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N20 compound treatment 0.066 -3.44E-4 -0.02 0.059 -0.00647 -0.45 -0.3352 -0.7408 1028615 Maybridge3_000658 Nc1cc(Nc2ccc(Br)cc2)nc(N)n1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N21 compound treatment 0.062 -0.00434 -0.28 0.059 -0.00647 -0.45 -0.5172 -0.9734 2075515 Maybridge3_000659 COc1ccc(cc1)c2cc3nnc(nc3s2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N22 compound treatment 0.121 0.0547 3.52 0.127 0.0615 4.3 5.5271 0.9951 2075516 Maybridge3_000660 CCOC(=O)c1cc(CO)cc(c1)C(=O)OCC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N23 mock treatment 0.07 0.00366 0.24 0.08 0.0145 1.02 0.8842 0.8485 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 N24 mock treatment 0.07 0.00366 0.24 0.065 -4.69E-4 -0.03 0.1433 0.6029 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O01 compound treatment 0.078 0.0117 0.75 0.088 0.0225 1.57 1.6435 0.9426 1916588 Maybridge3_000661 COC(=O)/C=C/1\Nc2ccccc2NC1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O02 compound treatment 0.08 0.0137 0.88 0.076 0.0105 0.74 1.1418 0.9961 2075517 Maybridge3_000662 COC(=O)CS(=O)(=O)c1nccn1C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O03 compound treatment 0.093 0.0267 1.72 0.097 0.0315 2.2 2.7708 0.9924 2075518 Maybridge3_000663 CCCc1cc(=O)oc2[nH]nc(C)c12 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O04 compound treatment 0.105 0.0387 2.49 0.097 0.0315 2.2 3.317 0.9982 1733743 Maybridge3_000664 CC(C)(C)c1cc(cc(c1)C(=O)Nc2cccnc2)C(=O)Nc3cccnc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O05 compound treatment 0.078 0.0117 0.75 0.074 0.00853 0.6 0.9519 0.9935 2075519 Maybridge3_000665 CN(C(=O)CC#N)c1ccc(F)cc1F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O06 compound treatment 0.042 -0.0243 -1.57 0.046 -0.0195 -1.36 -2.0697 -0.9975 1716609 Maybridge3_000666 CCOC(=O)c1cnc2onc(C)c2c1O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O07 compound treatment 0.166 0.0997 6.41 0.147 0.0815 5.7 8.5632 0.9982 1479341 Maybridge3_000667 CC(C)(C)c1ccc(cc1)c2nnc(o2)c3ccccc3N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O08 compound treatment 0.077 0.0107 0.69 0.068 0.00253 0.18 0.61 0.8612 1483580 Maybridge3_000668 Cc1ccc(Oc2ncccc2C(=O)O)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O09 compound treatment 0.992 0.926 59.58 0.856 0.791 55.23 81.1802 0.9993 2075520 Maybridge3_000669 COc1ccc(/C=C(\C#N)/c2ccc(O)cc2)cc1OC 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O10 compound treatment 0.089 0.0227 1.46 0.078 0.0125 0.88 1.6502 0.9702 2075521 Maybridge3_000670 CSc1ncccc1C2=N/C(=C\c3ccc(C)cc3)/C(=O)O2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O11 compound treatment 0.066 -3.44E-4 -0.02 0.065 -4.69E-4 -0.03 -0.0388 -0.9818 1150800 Maybridge3_000671 CC(=O)Nc1ccc(Oc2cccnc2)nc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O12 compound treatment 0.83 0.764 49.15 0.724 0.659 46.0 67.2866 0.9995 2075522 Maybridge3_000672 O=C(OCCSc1ccccn1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O13 compound treatment 0.086 0.0197 1.27 0.084 0.0185 1.29 1.81 0.9999 1018990 Maybridge3_000673 O=C(C1COC(=O)C1)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O14 compound treatment 0.149 0.0827 5.32 0.144 0.0785 5.49 7.6412 0.9999 1473988 Maybridge3_000674 Nc1n(nc2[nH]c(nc(=O)c12)c3ccccc3)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O15 compound treatment 0.058 -0.00834 -0.54 0.073 0.00753 0.53 -0.0077 -0.0103 1287534 Maybridge3_000675 CC(=O)Nc1nnc(SCC#N)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O16 compound treatment 0.069 0.00266 0.17 0.073 0.00753 0.53 0.4929 0.891 1469722 Maybridge3_000676 CCOC(=O)c1c(C)c2c(=O)[nH]cnc2n1c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O17 compound treatment 0.06 -0.00634 -0.41 0.058 -0.00747 -0.52 -0.6577 -0.9926 2075523 Maybridge3_000677 Cc1ccc(cc1)C(=O)OCCSc2ccc(cn2)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O18 compound treatment 0.076 0.00966 0.62 0.07 0.00453 0.32 0.6633 0.951 1613952 Maybridge3_000678 Cc1[nH]c(=O)c(C#N)cc1c2csc(n2)c3ccccc3 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O19 compound treatment 0.077 0.0107 0.69 0.078 0.0125 0.88 1.104 0.9927 2075524 Maybridge3_000679 Fc1ccc(Oc2ncccc2NC(=O)/C=C/c3ccccc3)c(F)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O20 compound treatment 0.061 -0.00534 -0.34 0.06 -0.00547 -0.38 -0.5134 -0.9986 1551430 Maybridge3_000680 CC(=O)N1CC(=C(C#N)C1O)C 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O21 compound treatment 0.066 -3.44E-4 -0.02 0.074 0.00853 0.6 0.4058 0.6804 1186844 Maybridge3_000681 CCCN(c1ccc(C)cc1)c2nc(=O)c3cccnc3s2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O22 compound treatment 0.073 0.00666 0.43 0.08 0.0145 1.02 1.0208 0.9264 2075525 Maybridge3_000682 Cc1ccc(Oc2ccc(cn2)C(F)(F)F)c3CCCc31 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O23 mock treatment 0.069 0.00266 0.17 0.069 0.00353 0.25 0.2953 0.984 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 O24 mock treatment 0.074 0.00766 0.49 0.073 0.00753 0.53 0.7205 0.9995 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P01 compound treatment 0.087 0.0207 1.33 0.089 0.0235 1.64 2.1025 0.9945 2075526 Maybridge3_000683 Oc1cc(ccn1)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P02 compound treatment 0.262 0.196 12.59 0.149 0.0835 5.84 13.0312 0.9389 1151687 Maybridge3_000684 CC(=O)Oc1cc2sc(=O)oc2c3ccccc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P03 compound treatment 0.081 0.0147 0.94 0.096 0.0305 2.13 2.1752 0.9327 1419965 Maybridge3_000685 Fc1cccc(Cl)c1CON2C(=O)C3C4OC(C=C4)C3C2=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P04 compound treatment 0.079 0.0127 0.81 0.086 0.0205 1.43 1.5902 0.9641 2075527 Maybridge3_000686 CC(=O)Nc1ccc(OCCOc2ccc(NC(=O)C)cc2)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P05 compound treatment 0.108 0.0417 2.68 0.129 0.0635 4.44 5.0342 0.9709 1690708 Maybridge3_000687 CCOC(=O)c1cc(=O)c2c(O)cccc2o1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P06 compound treatment 0.346 0.28 18.0 0.391 0.326 22.74 28.8087 0.9933 1527724 Maybridge3_000688 CC(C)OC(=O)c1cccc2C(=O)c3ccccc3-c21 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P07 compound treatment 0.092 0.0257 1.65 0.096 0.0305 2.13 2.6759 0.992 1338763 Maybridge3_000689 Oc1nc2ccccc2n(c3ccc(Cl)cc3)c1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P08 compound treatment 0.208 0.142 9.12 0.171 0.106 7.37 11.6603 0.9944 2075528 Maybridge3_000690 CSC1=N/C(=C/c2ccco2)/C(=O)N1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P09 compound treatment 0.065 -0.00134 -0.09 0.067 0.00153 0.11 0.0145 0.1053 1009360 Maybridge3_000691 CC(C)C1CCC(C)CC1N 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P10 compound treatment 0.256 0.19 12.21 0.3 0.235 16.38 20.2173 0.9895 2075529 Maybridge3_000692 OC1(CCCCC1)c2cccc(F)c2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P11 compound treatment 0.14 0.0737 4.74 0.116 0.0505 3.53 5.8485 0.9895 1138107 Maybridge3_000693 CCN(CC)C(=O)c1cccc2C(=O)c3ccccc3-c21 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P12 compound treatment 0.089 0.0227 1.46 0.078 0.0125 0.88 1.6502 0.9702 1430738 Maybridge3_000694 CCN(CC)C(=O)c1cccc2-c3ccccc3C(=O)c21 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P13 compound treatment 0.055 -0.0113 -0.73 0.051 -0.0145 -1.01 -1.231 -0.9873 2075530 Maybridge3_000695 CCc1c(O)c2ccccc2oc1=O 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P14 compound treatment 0.07 0.00366 0.24 0.072 0.00653 0.46 0.489 0.9526 1051125 Maybridge3_000696 CNC(=O)Oc1cccc(C)c1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P15 compound treatment 0.068 0.00166 0.11 0.076 0.0105 0.74 0.5956 0.8012 1656319 Maybridge3_000697 CCNC(=O)c1ccccc1Sc2ccccc2CO 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P16 compound treatment 0.211 0.145 9.31 0.265 0.2 13.94 16.4402 0.9808 1286529 Maybridge3_000698 Oc1c(c2ccccc2)c(=O)n(c3ccccc3)c4ccccc14 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P17 compound treatment 0.071 0.00466 0.3 0.064 -0.00147 -0.1 0.1394 0.4399 1429737 Maybridge3_000699 CNC(=O)c1ccccc1S(=O)c2ccccc2 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P18 compound treatment 0.093 0.0267 1.72 0.098 0.0325 2.27 2.8202 0.9904 1600212 Maybridge3_000700 Cc1ccc(NC(CC(=O)C2CC2)c3ccccc3)cc1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P19 compound treatment 0.078 0.0117 0.75 0.072 0.00653 0.46 0.8531 0.9716 1143166 Maybridge3_000701 Oc1cc(=O)n(c2ccccc2)c3CCCCc13 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P20 compound treatment 0.074 0.00766 0.49 0.075 0.00953 0.67 0.8193 0.989 1066953 Maybridge3_000702 CSc1nc(C(=O)N)c(N)s1 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P21 compound treatment 0.076 0.00966 0.62 0.074 0.00853 0.6 0.8609 0.9998 2075531 Maybridge3_000703 Clc1ccc(cc1)c2cc3nnc(nc3s2)c4ccccc4 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P22 compound treatment 0.093 0.0267 1.72 0.1 0.0345 2.41 2.919 0.9861 2075532 Maybridge3_000704 CCC(=O)N1C2CC(C=C2)C1(C(F)(F)F)C(F)(F)F 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P23 mock treatment 0.078 0.0117 0.75 0.076 0.0105 0.74 1.0507 1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.1432 P24 mock treatment 0.079 0.0127 0.81 0.068 0.00253 0.18 0.7011 0.841 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A01 mock treatment 0.056 0.00266 0.17 0.058 0.00504 0.35 0.3704 0.9453 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A02 mock treatment 0.056 0.00266 0.17 0.058 0.00504 0.35 0.3704 0.9453 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A03 mock treatment 0.061 0.00766 0.49 0.051 -0.00196 -0.14 0.2521 0.4925 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A04 mock treatment 0.055 0.00166 0.11 0.059 0.00604 0.42 0.3742 0.8594 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A05 mock treatment 0.054 6.65E-4 0.04 0.056 0.00304 0.21 0.1805 0.8328 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A06 mock treatment 0.061 0.00766 0.49 0.058 0.00504 0.35 0.5979 0.9864 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A07 mock treatment 0.057 0.00366 0.24 0.054 0.00104 0.07 0.2183 0.8842 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A08 mock treatment 0.055 0.00166 0.11 0.054 0.00104 0.07 0.1272 0.9822 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A09 mock treatment 0.057 0.00366 0.24 0.056 0.00304 0.21 0.3171 0.9986 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A10 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A11 mock treatment 0.055 0.00166 0.11 0.056 0.00304 0.21 0.226 0.9498 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A12 mock treatment 0.052 -0.00134 -0.09 0.056 0.00304 0.21 0.0895 0.3905 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A13 mock treatment 0.053 -3.35E-4 -0.02 0.054 0.00104 0.07 0.0362 0.4771 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A14 mock treatment 0.055 0.00166 0.11 0.052 -9.58E-4 -0.07 0.0285 0.2252 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A15 mock treatment 0.053 -3.35E-4 -0.02 0.054 0.00104 0.07 0.0362 0.4771 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A16 mock treatment 0.05 -0.00334 -0.21 0.054 0.00104 0.07 -0.1003 -0.4426 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A17 mock treatment 0.052 -0.00134 -0.09 0.057 0.00404 0.28 0.1389 0.4706 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A18 mock treatment 0.052 -0.00134 -0.09 0.057 0.00404 0.28 0.1389 0.4706 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A19 mock treatment 0.055 0.00166 0.11 0.051 -0.00196 -0.14 -0.0209 -0.1205 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A20 mock treatment 0.056 0.00266 0.17 0.063 0.01 0.7 0.6173 0.8548 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A21 mock treatment 0.056 0.00266 0.17 0.104 0.051 3.57 2.6427 0.7403 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A22 mock treatment 0.057 0.00366 0.24 0.057 0.00404 0.28 0.3665 0.996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A23 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base A24 mock treatment 0.055 0.00166 0.11 0.06 0.00704 0.49 0.4236 0.8414 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B01 mock treatment 0.067 0.0137 0.88 0.057 0.00404 0.28 0.8216 0.8894 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B02 mock treatment 0.058 0.00466 0.3 0.159 0.106 7.41 5.4506 0.7352 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B03 mock treatment 0.056 0.00266 0.17 0.059 0.00604 0.42 0.4198 0.9213 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B04 mock treatment 0.06 0.00666 0.43 0.058 0.00504 0.35 0.5524 0.9952 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B05 mock treatment 0.054 6.65E-4 0.04 0.057 0.00404 0.28 0.2299 0.8051 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B06 mock treatment 0.054 6.65E-4 0.04 0.054 0.00104 0.07 0.0817 0.9679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B07 mock treatment 0.054 6.65E-4 0.04 0.055 0.00204 0.14 0.1311 0.8805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B08 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B09 mock treatment 0.054 6.65E-4 0.04 0.054 0.00104 0.07 0.0817 0.9679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B10 mock treatment 0.053 -3.35E-4 -0.02 0.049 -0.00396 -0.28 -0.2108 -0.76 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B11 mock treatment 0.053 -3.35E-4 -0.02 0.055 0.00204 0.14 0.0856 0.5935 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B12 mock treatment 0.055 0.00166 0.11 0.051 -0.00196 -0.14 -0.0209 -0.1205 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B13 mock treatment 0.05 -0.00334 -0.21 0.056 0.00304 0.21 -0.0015 -0.005 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B14 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B15 mock treatment 0.051 -0.00234 -0.15 0.055 0.00204 0.14 -0.0054 -0.0261 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B16 mock treatment 0.05 -0.00334 -0.21 0.052 -9.58E-4 -0.07 -0.1991 -0.8855 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B17 mock treatment 0.056 0.00266 0.17 0.052 -9.58E-4 -0.07 0.074 0.4017 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B18 mock treatment 0.054 6.65E-4 0.04 0.188 0.135 9.43 6.7011 0.7103 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B19 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B20 mock treatment 0.051 -0.00234 -0.15 0.051 -0.00196 -0.14 -0.203 -0.9989 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B21 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B22 mock treatment 0.053 -3.35E-4 -0.02 0.053 4.2E-5 0.0 -0.0132 -0.6053 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B23 mock treatment 0.052 -0.00134 -0.09 0.053 4.2E-5 0.0 -0.0587 -0.6826 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base B24 mock treatment 0.053 -3.35E-4 -0.02 0.054 0.00104 0.07 0.0362 0.4771 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C01 mock treatment 0.059 0.00566 0.36 0.056 0.00304 0.21 0.4081 0.967 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C02 mock treatment 0.06 0.00666 0.43 0.059 0.00604 0.42 0.6018 1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C03 mock treatment 0.06 0.00666 0.43 0.057 0.00404 0.28 0.503 0.9794 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C04 mock treatment 0.055 0.00166 0.11 0.058 0.00504 0.35 0.3248 0.8823 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C05 mock treatment 0.051 -0.00234 -0.15 0.057 0.00404 0.28 0.0934 0.292 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C06 mock treatment 0.054 6.65E-4 0.04 0.055 0.00204 0.14 0.1311 0.8805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C07 mock treatment 0.055 0.00166 0.11 0.051 -0.00196 -0.14 -0.0209 -0.1205 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C08 mock treatment 0.055 0.00166 0.11 0.054 0.00104 0.07 0.1272 0.9822 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C09 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C10 mock treatment 0.054 6.65E-4 0.04 0.051 -0.00196 -0.14 -0.0665 -0.4637 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C11 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C12 mock treatment 0.055 0.00166 0.11 0.053 4.2E-5 0.0 0.0778 0.7262 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C13 mock treatment 0.05 -0.00334 -0.21 0.055 0.00204 0.14 -0.0509 -0.1976 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C14 mock treatment 0.056 0.00266 0.17 0.057 0.00404 0.28 0.321 0.9715 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C15 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C16 mock treatment 0.05 -0.00334 -0.21 0.053 4.2E-5 0.0 -0.1497 -0.6974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C17 mock treatment 0.052 -0.00134 -0.09 0.054 0.00104 0.07 -0.0093 -0.0825 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C18 mock treatment 0.055 0.00166 0.11 0.055 0.00204 0.14 0.1766 0.9901 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C19 mock treatment 0.051 -0.00234 -0.15 0.051 -0.00196 -0.14 -0.203 -0.9989 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C20 mock treatment 0.056 0.00266 0.17 0.052 -9.58E-4 -0.07 0.074 0.4017 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C21 mock treatment 0.048 -0.00534 -0.34 0.054 0.00104 0.07 -0.1913 -0.5451 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C22 mock treatment 0.05 -0.00334 -0.21 0.053 4.2E-5 0.0 -0.1497 -0.6974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C23 mock treatment 0.053 -3.35E-4 -0.02 0.055 0.00204 0.14 0.0856 0.5935 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base C24 mock treatment 0.057 0.00366 0.24 0.054 0.00104 0.07 0.2183 0.8842 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D01 mock treatment 0.06 0.00666 0.43 0.06 0.00704 0.49 0.6512 0.9977 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D02 mock treatment 0.056 0.00266 0.17 0.08 0.027 1.89 1.4571 0.7681 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D03 mock treatment 0.058 0.00466 0.3 0.056 0.00304 0.21 0.3626 0.9857 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D04 mock treatment 0.059 0.00566 0.36 0.053 4.2E-5 0.0 0.2599 0.7128 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D05 mock treatment 0.053 -3.35E-4 -0.02 0.055 0.00204 0.14 0.0856 0.5935 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D06 mock treatment 0.054 6.65E-4 0.04 0.055 0.00204 0.14 0.1311 0.8805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D07 mock treatment 0.054 6.65E-4 0.04 0.055 0.00204 0.14 0.1311 0.8805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D08 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D09 mock treatment 0.055 0.00166 0.11 0.064 0.011 0.77 0.6212 0.7977 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D10 mock treatment 0.056 0.00266 0.17 0.054 0.00104 0.07 0.1728 0.9272 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D11 mock treatment 0.054 6.65E-4 0.04 0.053 4.2E-5 0.0 0.0323 0.7538 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D12 mock treatment 0.054 6.65E-4 0.04 0.057 0.00404 0.28 0.2299 0.8051 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D13 mock treatment 0.054 6.65E-4 0.04 0.054 0.00104 0.07 0.0817 0.9679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D14 mock treatment 0.051 -0.00234 -0.15 0.054 0.00104 0.07 -0.0548 -0.3282 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D15 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D16 mock treatment 0.054 6.65E-4 0.04 0.055 0.00204 0.14 0.1311 0.8805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D17 mock treatment 0.048 -0.00534 -0.34 0.049 -0.00396 -0.28 -0.4383 -0.9942 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D18 mock treatment 0.052 -0.00134 -0.09 0.05 -0.00296 -0.21 -0.2069 -0.9244 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D19 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D20 mock treatment 0.051 -0.00234 -0.15 0.048 -0.00496 -0.35 -0.3512 -0.9301 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D21 mock treatment 0.052 -0.00134 -0.09 0.055 0.00204 0.14 0.0401 0.2408 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D22 mock treatment 0.051 -0.00234 -0.15 0.051 -0.00196 -0.14 -0.203 -0.9989 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D23 mock treatment 0.052 -0.00134 -0.09 0.049 -0.00396 -0.28 -0.2563 -0.8851 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base D24 mock treatment 0.062 0.00866 0.56 0.054 0.00104 0.07 0.4458 0.7927 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E01 mock treatment 0.065 0.0117 0.75 0.056 0.00304 0.21 0.6812 0.873 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E02 mock treatment 0.057 0.00366 0.24 0.053 4.2E-5 0.0 0.1689 0.7158 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E03 mock treatment 0.049 -0.00434 -0.28 0.053 4.2E-5 0.0 -0.1952 -0.6996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E04 mock treatment 0.057 0.00366 0.24 0.054 0.00104 0.07 0.2183 0.8842 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E05 mock treatment 0.053 -3.35E-4 -0.02 0.05 -0.00296 -0.21 -0.1614 -0.7767 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E06 mock treatment 0.05 -0.00334 -0.21 0.053 4.2E-5 0.0 -0.1497 -0.6974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E07 mock treatment 0.054 6.65E-4 0.04 0.051 -0.00196 -0.14 -0.0665 -0.4637 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E08 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E09 mock treatment 0.05 -0.00334 -0.21 0.052 -9.58E-4 -0.07 -0.1991 -0.8855 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E10 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E11 mock treatment 0.056 0.00266 0.17 0.052 -9.58E-4 -0.07 0.074 0.4017 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E12 mock treatment 0.056 0.00266 0.17 0.052 -9.58E-4 -0.07 0.074 0.4017 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E13 mock treatment 0.05 -0.00334 -0.21 0.049 -0.00396 -0.28 -0.3473 -0.9922 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E14 mock treatment 0.053 -3.35E-4 -0.02 0.048 -0.00496 -0.35 -0.2602 -0.7497 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E15 mock treatment 0.052 -0.00134 -0.09 0.052 -9.58E-4 -0.07 -0.1081 -0.9924 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E16 mock treatment 0.051 -0.00234 -0.15 0.053 4.2E-5 0.0 -0.1042 -0.6932 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E17 mock treatment 0.048 -0.00534 -0.34 0.045 -0.00796 -0.56 -0.6359 -0.9732 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E18 mock treatment 0.05 -0.00334 -0.21 0.053 4.2E-5 0.0 -0.1497 -0.6974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E19 mock treatment 0.049 -0.00434 -0.28 0.052 -9.58E-4 -0.07 -0.2446 -0.8525 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E20 mock treatment 0.048 -0.00534 -0.34 0.053 4.2E-5 0.0 -0.2407 -0.701 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E21 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E22 mock treatment 0.053 -3.35E-4 -0.02 0.054 0.00104 0.07 0.0362 0.4771 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E23 mock treatment 0.048 -0.00534 -0.34 0.05 -0.00296 -0.21 -0.3889 -0.9705 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base E24 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F01 mock treatment 0.06 0.00666 0.43 0.06 0.00704 0.49 0.6512 0.9977 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F02 mock treatment 0.054 6.65E-4 0.04 0.053 4.2E-5 0.0 0.0323 0.7538 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F03 mock treatment 0.057 0.00366 0.24 0.051 -0.00196 -0.14 0.0701 0.257 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F04 mock treatment 0.052 -0.00134 -0.09 0.059 0.00604 0.42 0.2377 0.5518 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F05 mock treatment 0.059 0.00566 0.36 0.055 0.00204 0.14 0.3587 0.9161 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F06 mock treatment 0.057 0.00366 0.24 0.053 4.2E-5 0.0 0.1689 0.7158 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F07 mock treatment 0.056 0.00266 0.17 0.054 0.00104 0.07 0.1728 0.9272 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F08 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F09 mock treatment 0.054 6.65E-4 0.04 0.056 0.00304 0.21 0.1805 0.8328 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F10 mock treatment 0.063 0.00966 0.62 0.051 -0.00196 -0.14 0.3432 0.5388 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F11 mock treatment 0.054 6.65E-4 0.04 0.053 4.2E-5 0.0 0.0323 0.7538 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F12 mock treatment 0.055 0.00166 0.11 0.051 -0.00196 -0.14 -0.0209 -0.1205 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F13 mock treatment 0.052 -0.00134 -0.09 0.057 0.00404 0.28 0.1389 0.4706 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F14 mock treatment 0.05 -0.00334 -0.21 0.05 -0.00296 -0.21 -0.2979 -0.9998 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F15 mock treatment 0.055 0.00166 0.11 0.056 0.00304 0.21 0.226 0.9498 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F16 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F17 mock treatment 0.054 6.65E-4 0.04 0.051 -0.00196 -0.14 -0.0665 -0.4637 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F18 mock treatment 0.048 -0.00534 -0.34 0.05 -0.00296 -0.21 -0.3889 -0.9705 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F19 mock treatment 0.049 -0.00434 -0.28 0.051 -0.00196 -0.14 -0.294 -0.9462 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F20 mock treatment 0.048 -0.00534 -0.34 0.049 -0.00396 -0.28 -0.4383 -0.9942 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F21 mock treatment 0.051 -0.00234 -0.15 0.052 -9.58E-4 -0.07 -0.1536 -0.9336 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F22 mock treatment 0.049 -0.00434 -0.28 0.049 -0.00396 -0.28 -0.3928 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F23 mock treatment 0.05 -0.00334 -0.21 0.052 -9.58E-4 -0.07 -0.1991 -0.8855 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base F24 mock treatment 0.055 0.00166 0.11 0.051 -0.00196 -0.14 -0.0209 -0.1205 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G01 mock treatment 0.058 0.00466 0.3 0.058 0.00504 0.35 0.4614 0.9968 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G02 mock treatment 0.053 -3.35E-4 -0.02 0.054 0.00104 0.07 0.0362 0.4771 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G03 mock treatment 0.056 0.00266 0.17 0.056 0.00304 0.21 0.2716 0.9944 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G04 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G05 mock treatment 0.055 0.00166 0.11 0.057 0.00404 0.28 0.2754 0.912 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G06 mock treatment 0.06 0.00666 0.43 0.051 -0.00196 -0.14 0.2066 0.4589 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G07 mock treatment 0.054 6.65E-4 0.04 0.055 0.00204 0.14 0.1311 0.8805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G08 mock treatment 0.05 -0.00334 -0.21 0.052 -9.58E-4 -0.07 -0.1991 -0.8855 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G09 mock treatment 0.052 -0.00134 -0.09 0.049 -0.00396 -0.28 -0.2563 -0.8851 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G10 mock treatment 0.057 0.00366 0.24 0.056 0.00304 0.21 0.3171 0.9986 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G11 mock treatment 0.05 -0.00334 -0.21 0.047 -0.00596 -0.42 -0.4461 -0.9526 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G12 mock treatment 0.052 -0.00134 -0.09 0.054 0.00104 0.07 -0.0093 -0.0825 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G13 mock treatment 0.052 -0.00134 -0.09 0.049 -0.00396 -0.28 -0.2563 -0.8851 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G14 mock treatment 0.051 -0.00234 -0.15 0.05 -0.00296 -0.21 -0.2524 -0.9878 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G15 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G16 mock treatment 0.052 -0.00134 -0.09 0.05 -0.00296 -0.21 -0.2069 -0.9244 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G17 mock treatment 0.05 -0.00334 -0.21 0.049 -0.00396 -0.28 -0.3473 -0.9922 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G18 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G19 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G20 mock treatment 0.05 -0.00334 -0.21 0.049 -0.00396 -0.28 -0.3473 -0.9922 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G21 mock treatment 0.051 -0.00234 -0.15 0.059 0.00604 0.42 0.1922 0.4289 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G22 mock treatment 0.053 -3.35E-4 -0.02 0.055 0.00204 0.14 0.0856 0.5935 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G23 mock treatment 0.052 -0.00134 -0.09 0.05 -0.00296 -0.21 -0.2069 -0.9244 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base G24 mock treatment 0.052 -0.00134 -0.09 0.052 -9.58E-4 -0.07 -0.1081 -0.9924 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H01 mock treatment 0.058 0.00466 0.3 0.058 0.00504 0.35 0.4614 0.9968 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H02 mock treatment 0.06 0.00666 0.43 0.057 0.00404 0.28 0.503 0.9794 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H03 mock treatment 0.059 0.00566 0.36 0.056 0.00304 0.21 0.4081 0.967 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H04 mock treatment 0.052 -0.00134 -0.09 0.052 -9.58E-4 -0.07 -0.1081 -0.9924 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H05 mock treatment 0.049 -0.00434 -0.28 0.055 0.00204 0.14 -0.0964 -0.3077 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H06 mock treatment 0.048 -0.00534 -0.34 0.048 -0.00496 -0.35 -0.4877 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H07 mock treatment 0.052 -0.00134 -0.09 0.055 0.00204 0.14 0.0401 0.2408 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H08 mock treatment 0.051 -0.00234 -0.15 0.052 -9.58E-4 -0.07 -0.1536 -0.9336 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H09 mock treatment 0.054 6.65E-4 0.04 0.056 0.00304 0.21 0.1805 0.8328 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H10 mock treatment 0.052 -0.00134 -0.09 0.053 4.2E-5 0.0 -0.0587 -0.6826 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H11 mock treatment 0.054 6.65E-4 0.04 0.053 4.2E-5 0.0 0.0323 0.7538 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H12 mock treatment 0.052 -0.00134 -0.09 0.056 0.00304 0.21 0.0895 0.3905 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H13 mock treatment 0.05 -0.00334 -0.21 0.055 0.00204 0.14 -0.0509 -0.1976 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H14 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H15 mock treatment 0.053 -3.35E-4 -0.02 0.056 0.00304 0.21 0.135 0.6321 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H16 mock treatment 0.051 -0.00234 -0.15 0.051 -0.00196 -0.14 -0.203 -0.9989 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H17 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H18 mock treatment 0.05 -0.00334 -0.21 0.053 4.2E-5 0.0 -0.1497 -0.6974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H19 mock treatment 0.055 0.00166 0.11 0.056 0.00304 0.21 0.226 0.9498 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H20 mock treatment 0.055 0.00166 0.11 0.047 -0.00596 -0.42 -0.2185 -0.5085 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H21 mock treatment 0.055 0.00166 0.11 0.052 -9.58E-4 -0.07 0.0285 0.2252 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H22 mock treatment 0.05 -0.00334 -0.21 0.052 -9.58E-4 -0.07 -0.1991 -0.8855 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H23 mock treatment 0.055 0.00166 0.11 0.052 -9.58E-4 -0.07 0.0285 0.2252 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base H24 mock treatment 0.055 0.00166 0.11 0.052 -9.58E-4 -0.07 0.0285 0.2252 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I01 mock treatment 0.069 0.0157 1.01 0.056 0.00304 0.21 0.8632 0.8377 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I02 mock treatment 0.063 0.00966 0.62 0.057 0.00404 0.28 0.6395 0.9361 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I03 mock treatment 0.059 0.00566 0.36 0.053 4.2E-5 0.0 0.2599 0.7128 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I04 mock treatment 0.053 -3.35E-4 -0.02 0.055 0.00204 0.14 0.0856 0.5935 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I05 mock treatment 0.054 6.65E-4 0.04 0.055 0.00204 0.14 0.1311 0.8805 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I06 mock treatment 0.057 0.00366 0.24 0.051 -0.00196 -0.14 0.0701 0.257 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I07 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I08 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I09 mock treatment 0.053 -3.35E-4 -0.02 0.05 -0.00296 -0.21 -0.1614 -0.7767 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I10 mock treatment 0.056 0.00266 0.17 0.055 0.00204 0.14 0.2222 0.9958 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I11 mock treatment 0.052 -0.00134 -0.09 0.053 4.2E-5 0.0 -0.0587 -0.6826 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I12 mock treatment 0.058 0.00466 0.3 0.056 0.00304 0.21 0.3626 0.9857 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I13 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I14 mock treatment 0.052 -0.00134 -0.09 0.05 -0.00296 -0.21 -0.2069 -0.9244 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I15 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I16 mock treatment 0.053 -3.35E-4 -0.02 0.056 0.00304 0.21 0.135 0.6321 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I17 mock treatment 0.055 0.00166 0.11 0.055 0.00204 0.14 0.1766 0.9901 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I18 mock treatment 0.057 0.00366 0.24 0.049 -0.00396 -0.28 -0.0287 -0.079 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I19 mock treatment 0.049 -0.00434 -0.28 0.056 0.00304 0.21 -0.047 -0.1341 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I20 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I21 mock treatment 0.059 0.00566 0.36 0.053 4.2E-5 0.0 0.2599 0.7128 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I22 mock treatment 0.053 -3.35E-4 -0.02 0.053 4.2E-5 0.0 -0.0132 -0.6053 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I23 mock treatment 0.051 -0.00234 -0.15 0.052 -9.58E-4 -0.07 -0.1536 -0.9336 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base I24 mock treatment 0.054 6.65E-4 0.04 0.053 4.2E-5 0.0 0.0323 0.7538 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J01 mock treatment 0.053 -3.35E-4 -0.02 0.056 0.00304 0.21 0.135 0.6321 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J02 mock treatment 0.058 0.00466 0.3 0.056 0.00304 0.21 0.3626 0.9857 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J03 mock treatment 0.058 0.00466 0.3 0.051 -0.00196 -0.14 0.1156 0.3503 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J04 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J05 mock treatment 0.052 -0.00134 -0.09 0.052 -9.58E-4 -0.07 -0.1081 -0.9924 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J06 mock treatment 0.055 0.00166 0.11 0.054 0.00104 0.07 0.1272 0.9822 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J07 mock treatment 0.058 0.00466 0.3 0.052 -9.58E-4 -0.07 0.165 0.5363 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J08 mock treatment 0.053 -3.35E-4 -0.02 0.059 0.00604 0.42 0.2832 0.6701 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J09 mock treatment 0.057 0.00366 0.24 0.054 0.00104 0.07 0.2183 0.8842 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J10 mock treatment 0.055 0.00166 0.11 0.077 0.024 1.68 1.2634 0.7507 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J11 mock treatment 0.053 -3.35E-4 -0.02 0.054 0.00104 0.07 0.0362 0.4771 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J12 mock treatment 0.059 0.00566 0.36 0.05 -0.00296 -0.21 0.1117 0.2665 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J13 mock treatment 0.05 -0.00334 -0.21 0.052 -9.58E-4 -0.07 -0.1991 -0.8855 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J14 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J15 mock treatment 0.056 0.00266 0.17 0.055 0.00204 0.14 0.2222 0.9958 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J16 mock treatment 0.049 -0.00434 -0.28 0.05 -0.00296 -0.21 -0.3434 -0.9891 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J17 mock treatment 0.056 0.00266 0.17 0.05 -0.00296 -0.21 -0.0248 -0.0925 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J18 mock treatment 0.054 6.65E-4 0.04 0.049 -0.00396 -0.28 -0.1653 -0.5906 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J19 mock treatment 0.054 6.65E-4 0.04 0.054 0.00104 0.07 0.0817 0.9679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J20 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J21 mock treatment 0.049 -0.00434 -0.28 0.056 0.00304 0.21 -0.047 -0.1341 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J22 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J23 mock treatment 0.055 0.00166 0.11 0.049 -0.00396 -0.28 -0.1197 -0.4038 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base J24 mock treatment 0.05 -0.00334 -0.21 0.054 0.00104 0.07 -0.1003 -0.4426 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K01 mock treatment 0.052 -0.00134 -0.09 0.055 0.00204 0.14 0.0401 0.2408 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K02 mock treatment 0.061 0.00766 0.49 0.056 0.00304 0.21 0.4991 0.9292 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K03 mock treatment 0.055 0.00166 0.11 0.05 -0.00296 -0.21 -0.0703 -0.3022 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K04 mock treatment 0.057 0.00366 0.24 0.052 -9.58E-4 -0.07 0.1195 0.4873 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K05 mock treatment 0.049 -0.00434 -0.28 0.051 -0.00196 -0.14 -0.294 -0.9462 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K06 mock treatment 0.062 0.00866 0.56 0.054 0.00104 0.07 0.4458 0.7927 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K07 mock treatment 0.054 6.65E-4 0.04 0.049 -0.00396 -0.28 -0.1653 -0.5906 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K08 mock treatment 0.052 -0.00134 -0.09 0.05 -0.00296 -0.21 -0.2069 -0.9244 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K09 mock treatment 0.05 -0.00334 -0.21 0.049 -0.00396 -0.28 -0.3473 -0.9922 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K10 mock treatment 0.054 6.65E-4 0.04 0.051 -0.00196 -0.14 -0.0665 -0.4637 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K11 mock treatment 0.053 -3.35E-4 -0.02 0.048 -0.00496 -0.35 -0.2602 -0.7497 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K12 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K13 mock treatment 0.051 -0.00234 -0.15 0.049 -0.00396 -0.28 -0.3018 -0.959 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K14 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K15 mock treatment 0.05 -0.00334 -0.21 0.049 -0.00396 -0.28 -0.3473 -0.9922 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K16 mock treatment 0.052 -0.00134 -0.09 0.052 -9.58E-4 -0.07 -0.1081 -0.9924 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K17 mock treatment 0.048 -0.00534 -0.34 0.05 -0.00296 -0.21 -0.3889 -0.9705 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K18 mock treatment 0.052 -0.00134 -0.09 0.049 -0.00396 -0.28 -0.2563 -0.8851 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K19 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K20 mock treatment 0.053 -3.35E-4 -0.02 0.053 4.2E-5 0.0 -0.0132 -0.6053 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K21 mock treatment 0.05 -0.00334 -0.21 0.046 -0.00696 -0.49 -0.4955 -0.9325 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K22 mock treatment 0.053 -3.35E-4 -0.02 0.053 4.2E-5 0.0 -0.0132 -0.6053 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K23 mock treatment 0.055 0.00166 0.11 0.049 -0.00396 -0.28 -0.1197 -0.4038 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base K24 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L01 mock treatment 0.067 0.0137 0.88 0.059 0.00604 0.42 0.9204 0.9434 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L02 mock treatment 0.055 0.00166 0.11 0.055 0.00204 0.14 0.1766 0.9901 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L03 mock treatment 0.051 -0.00234 -0.15 0.051 -0.00196 -0.14 -0.203 -0.9989 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L04 mock treatment 0.056 0.00266 0.17 0.056 0.00304 0.21 0.2716 0.9944 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L05 mock treatment 0.052 -0.00134 -0.09 0.053 4.2E-5 0.0 -0.0587 -0.6826 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L06 mock treatment 0.05 -0.00334 -0.21 0.054 0.00104 0.07 -0.1003 -0.4426 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L07 mock treatment 0.052 -0.00134 -0.09 0.05 -0.00296 -0.21 -0.2069 -0.9244 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L08 mock treatment 0.049 -0.00434 -0.28 0.054 0.00104 0.07 -0.1458 -0.5057 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L09 mock treatment 0.06 0.00666 0.43 0.05 -0.00296 -0.21 0.1572 0.3302 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L10 mock treatment 0.047 -0.00634 -0.41 0.05 -0.00296 -0.21 -0.4344 -0.9504 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L11 mock treatment 0.055 0.00166 0.11 0.051 -0.00196 -0.14 -0.0209 -0.1205 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L12 mock treatment 0.051 -0.00234 -0.15 0.056 0.00304 0.21 0.044 0.169 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L13 mock treatment 0.055 0.00166 0.11 0.054 0.00104 0.07 0.1272 0.9822 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L14 mock treatment 0.056 0.00266 0.17 0.052 -9.58E-4 -0.07 0.074 0.4017 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L15 mock treatment 0.047 -0.00634 -0.41 0.052 -9.58E-4 -0.07 -0.3357 -0.8123 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L16 mock treatment 0.049 -0.00434 -0.28 0.053 4.2E-5 0.0 -0.1952 -0.6996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L17 mock treatment 0.05 -0.00334 -0.21 0.053 4.2E-5 0.0 -0.1497 -0.6974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L18 mock treatment 0.05 -0.00334 -0.21 0.052 -9.58E-4 -0.07 -0.1991 -0.8855 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L19 mock treatment 0.056 0.00266 0.17 0.051 -0.00196 -0.14 0.0246 0.112 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L20 mock treatment 0.052 -0.00134 -0.09 0.049 -0.00396 -0.28 -0.2563 -0.8851 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L21 mock treatment 0.053 -3.35E-4 -0.02 0.055 0.00204 0.14 0.0856 0.5935 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L22 mock treatment 0.05 -0.00334 -0.21 0.048 -0.00496 -0.35 -0.3967 -0.9735 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L23 mock treatment 0.056 0.00266 0.17 0.049 -0.00396 -0.28 -0.0742 -0.2281 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base L24 mock treatment 0.048 -0.00534 -0.34 0.052 -9.58E-4 -0.07 -0.2901 -0.8293 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M01 mock treatment 0.052 -0.00134 -0.09 0.053 4.2E-5 0.0 -0.0587 -0.6826 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M02 mock treatment 0.057 0.00366 0.24 0.054 0.00104 0.07 0.2183 0.8842 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M03 mock treatment 0.048 -0.00534 -0.34 0.049 -0.00396 -0.28 -0.4383 -0.9942 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M04 mock treatment 0.054 6.65E-4 0.04 0.051 -0.00196 -0.14 -0.0665 -0.4637 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M05 mock treatment 0.05 -0.00334 -0.21 0.054 0.00104 0.07 -0.1003 -0.4426 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M06 mock treatment 0.05 -0.00334 -0.21 0.053 4.2E-5 0.0 -0.1497 -0.6974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M07 mock treatment 0.053 -3.35E-4 -0.02 0.047 -0.00596 -0.42 -0.3096 -0.7428 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M08 mock treatment 0.053 -3.35E-4 -0.02 0.048 -0.00496 -0.35 -0.2602 -0.7497 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M09 mock treatment 0.054 6.65E-4 0.04 0.052 -9.58E-4 -0.07 -0.0171 -0.2148 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M10 mock treatment 0.051 -0.00234 -0.15 0.05 -0.00296 -0.21 -0.2524 -0.9878 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M11 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M12 mock treatment 0.049 -0.00434 -0.28 0.048 -0.00496 -0.35 -0.4422 -0.9943 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M13 mock treatment 0.053 -3.35E-4 -0.02 0.049 -0.00396 -0.28 -0.2108 -0.76 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M14 mock treatment 0.054 6.65E-4 0.04 0.054 0.00104 0.07 0.0817 0.9679 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M15 mock treatment 0.053 -3.35E-4 -0.02 0.047 -0.00596 -0.42 -0.3096 -0.7428 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M16 mock treatment 0.048 -0.00534 -0.34 0.053 4.2E-5 0.0 -0.2407 -0.701 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M17 mock treatment 0.048 -0.00534 -0.34 0.047 -0.00596 -0.42 -0.5371 -0.9954 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M18 mock treatment 0.049 -0.00434 -0.28 0.049 -0.00396 -0.28 -0.3928 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M19 mock treatment 0.054 6.65E-4 0.04 0.049 -0.00396 -0.28 -0.1653 -0.5906 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M20 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M21 mock treatment 0.05 -0.00334 -0.21 0.05 -0.00296 -0.21 -0.2979 -0.9998 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M22 mock treatment 0.051 -0.00234 -0.15 0.046 -0.00696 -0.49 -0.45 -0.8844 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M23 mock treatment 0.047 -0.00634 -0.41 0.053 4.2E-5 0.0 -0.2863 -0.702 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base M24 mock treatment 0.049 -0.00434 -0.28 0.049 -0.00396 -0.28 -0.3928 -1.0 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N01 mock treatment 0.052 -0.00134 -0.09 0.057 0.00404 0.28 0.1389 0.4706 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N02 mock treatment 0.052 -0.00134 -0.09 0.052 -9.58E-4 -0.07 -0.1081 -0.9924 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N03 mock treatment 0.052 -0.00134 -0.09 0.056 0.00304 0.21 0.0895 0.3905 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N04 mock treatment 0.058 0.00466 0.3 0.055 0.00204 0.14 0.3132 0.9421 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N05 mock treatment 0.055 0.00166 0.11 0.056 0.00304 0.21 0.226 0.9498 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N06 mock treatment 0.055 0.00166 0.11 0.057 0.00404 0.28 0.2754 0.912 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N07 mock treatment 0.053 -3.35E-4 -0.02 0.058 0.00504 0.35 0.2338 0.6626 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N08 mock treatment 0.051 -0.00234 -0.15 0.054 0.00104 0.07 -0.0548 -0.3282 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N09 mock treatment 0.051 -0.00234 -0.15 0.058 0.00504 0.35 0.1428 0.3729 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N10 mock treatment 0.053 -3.35E-4 -0.02 0.052 -9.58E-4 -0.07 -0.0626 -0.8899 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N11 mock treatment 0.052 -0.00134 -0.09 0.052 -9.58E-4 -0.07 -0.1081 -0.9924 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N12 mock treatment 0.055 0.00166 0.11 0.051 -0.00196 -0.14 -0.0209 -0.1205 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N13 mock treatment 0.052 -0.00134 -0.09 0.056 0.00304 0.21 0.0895 0.3905 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N14 mock treatment 0.053 -3.35E-4 -0.02 0.055 0.00204 0.14 0.0856 0.5935 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N15 mock treatment 0.054 6.65E-4 0.04 0.051 -0.00196 -0.14 -0.0665 -0.4637 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N16 mock treatment 0.05 -0.00334 -0.21 0.048 -0.00496 -0.35 -0.3967 -0.9735 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N17 mock treatment 0.05 -0.00334 -0.21 0.05 -0.00296 -0.21 -0.2979 -0.9998 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N18 mock treatment 0.115 0.0617 3.97 0.048 -0.00496 -0.35 2.5616 0.643 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N19 mock treatment 0.051 -0.00234 -0.15 0.052 -9.58E-4 -0.07 -0.1536 -0.9336 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N20 mock treatment 0.047 -0.00634 -0.41 0.049 -0.00396 -0.28 -0.4838 -0.9821 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N21 mock treatment 0.052 -0.00134 -0.09 0.05 -0.00296 -0.21 -0.2069 -0.9244 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N22 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N23 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base N24 mock treatment 0.05 -0.00334 -0.21 0.047 -0.00596 -0.42 -0.4461 -0.9526 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O01 mock treatment 0.057 0.00366 0.24 0.058 0.00504 0.35 0.4159 0.981 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O02 mock treatment 0.056 0.00266 0.17 0.054 0.00104 0.07 0.1728 0.9272 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O03 mock treatment 0.047 -0.00634 -0.41 0.05 -0.00296 -0.21 -0.4344 -0.9504 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O04 mock treatment 0.056 0.00266 0.17 0.056 0.00304 0.21 0.2716 0.9944 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O05 mock treatment 0.054 6.65E-4 0.04 0.057 0.00404 0.28 0.2299 0.8051 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O06 mock treatment 0.054 6.65E-4 0.04 0.056 0.00304 0.21 0.1805 0.8328 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O07 mock treatment 0.053 -3.35E-4 -0.02 0.049 -0.00396 -0.28 -0.2108 -0.76 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O08 mock treatment 0.056 0.00266 0.17 0.055 0.00204 0.14 0.2222 0.9958 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O09 mock treatment 0.129 0.0757 4.87 0.051 -0.00196 -0.14 3.347 0.687 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O10 mock treatment 0.054 6.65E-4 0.04 0.051 -0.00196 -0.14 -0.0665 -0.4637 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O11 mock treatment 0.049 -0.00434 -0.28 0.05 -0.00296 -0.21 -0.3434 -0.9891 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O12 mock treatment 0.052 -0.00134 -0.09 0.054 0.00104 0.07 -0.0093 -0.0825 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O13 mock treatment 0.051 -0.00234 -0.15 0.051 -0.00196 -0.14 -0.203 -0.9989 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O14 mock treatment 0.05 -0.00334 -0.21 0.05 -0.00296 -0.21 -0.2979 -0.9998 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O15 mock treatment 0.051 -0.00234 -0.15 0.051 -0.00196 -0.14 -0.203 -0.9989 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O16 mock treatment 0.053 -3.35E-4 -0.02 0.051 -0.00196 -0.14 -0.112 -0.8086 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O17 mock treatment 0.049 -0.00434 -0.28 0.053 4.2E-5 0.0 -0.1952 -0.6996 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O18 mock treatment 0.051 -0.00234 -0.15 0.052 -9.58E-4 -0.07 -0.1536 -0.9336 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O19 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O20 mock treatment 0.051 -0.00234 -0.15 0.052 -9.58E-4 -0.07 -0.1536 -0.9336 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O21 mock treatment 0.052 -0.00134 -0.09 0.05 -0.00296 -0.21 -0.2069 -0.9244 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O22 mock treatment 0.05 -0.00334 -0.21 0.053 4.2E-5 0.0 -0.1497 -0.6974 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O23 mock treatment 0.052 -0.00134 -0.09 0.049 -0.00396 -0.28 -0.2563 -0.8851 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base O24 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P01 mock treatment 0.059 0.00566 0.36 0.056 0.00304 0.21 0.4081 0.967 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P02 mock treatment 0.055 0.00166 0.11 0.052 -9.58E-4 -0.07 0.0285 0.2252 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P03 mock treatment 0.055 0.00166 0.11 0.056 0.00304 0.21 0.226 0.9498 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P04 mock treatment 0.055 0.00166 0.11 0.053 4.2E-5 0.0 0.0778 0.7262 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P05 mock treatment 0.076 0.0227 1.46 0.059 0.00604 0.42 1.33 0.8758 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P06 mock treatment 0.057 0.00366 0.24 0.052 -9.58E-4 -0.07 0.1195 0.4873 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P07 mock treatment 0.055 0.00166 0.11 0.059 0.00604 0.42 0.3742 0.8594 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P08 mock treatment 0.055 0.00166 0.11 0.056 0.00304 0.21 0.226 0.9498 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P09 mock treatment 0.058 0.00466 0.3 0.056 0.00304 0.21 0.3626 0.9857 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P10 mock treatment 0.051 -0.00234 -0.15 0.052 -9.58E-4 -0.07 -0.1536 -0.9336 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P11 mock treatment 0.053 -3.35E-4 -0.02 0.053 4.2E-5 0.0 -0.0132 -0.6053 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P12 mock treatment 0.052 -0.00134 -0.09 0.053 4.2E-5 0.0 -0.0587 -0.6826 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P13 mock treatment 0.053 -3.35E-4 -0.02 0.057 0.00404 0.28 0.1844 0.6512 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P14 mock treatment 0.05 -0.00334 -0.21 0.051 -0.00196 -0.14 -0.2485 -0.9763 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P15 mock treatment 0.05 -0.00334 -0.21 0.056 0.00304 0.21 -0.0015 -0.005 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P16 mock treatment 0.049 -0.00434 -0.28 0.051 -0.00196 -0.14 -0.294 -0.9462 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P17 mock treatment 0.052 -0.00134 -0.09 0.051 -0.00196 -0.14 -0.1575 -0.9749 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P18 mock treatment 0.049 -0.00434 -0.28 0.052 -9.58E-4 -0.07 -0.2446 -0.8525 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P19 mock treatment 0.053 -3.35E-4 -0.02 0.053 4.2E-5 0.0 -0.0132 -0.6053 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P20 mock treatment 0.049 -0.00434 -0.28 0.051 -0.00196 -0.14 -0.294 -0.9462 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P21 mock treatment 0.053 -3.35E-4 -0.02 0.055 0.00204 0.14 0.0856 0.5935 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P22 mock treatment 0.049 -0.00434 -0.28 0.05 -0.00296 -0.21 -0.3434 -0.9891 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P23 mock treatment 0.053 -3.35E-4 -0.02 0.053 4.2E-5 0.0 -0.0132 -0.6053 1091.0049 OpticalDensity(1091.0049) PDERegulators 1091.0049.Base P24 mock treatment 0.048 -0.00534 -0.34 0.049 -0.00396 -0.28 -0.4383 -0.9942