COc1ccc(/C=C/c2c(CC=C(C)C)c(O)cc(O)c2CC=C(C)C)cc1 CHEMBL4553272 pIC50 2.673e-05 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccc(F)c3)oc12 CHEMBL3421639 IC50 0.043 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(F)cn3)oc12 CHEMBL4749123 IC50 0.07 nM
c1cn(-c2ccc(Nc3nc(-c4nccs4)cs3)cc2)cn1 CHEMBL5279681 IC50 0.09 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(Cl)cn3)oc12 CHEMBL4798651 IC50 0.14 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(Cl)cc3)oc12 CHEMBL3422338 IC50 0.2 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccccc3F)oc12 CHEMBL3422258 IC50 0.2 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccccc3)oc12 CHEMBL3422257 IC50 0.2 nM
COc1ccc(-c2nc(-c3ccc(C#N)cc3)cs2)c(OC)c1 CHEMBL5394220 IC50 0.2 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(O)c(-c3cccc(F)c3)oc12 CHEMBL3422349 IC50 0.3 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccc(Cl)c3)oc12 CHEMBL3422337 IC50 0.3 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(F)cc3)oc12 CHEMBL3422335 IC50 0.3 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccc(Cl)n3)oc12 CHEMBL4759410 IC50 0.3 nM
COc1ccc(/C=C/c2ccncc2)c(OC)c1 CHEMBL5403545 IC50 0.31 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccc(F)n3)oc12 CHEMBL4799247 IC50 0.38 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(-c4c[nH]nn4)cc3)oc12 CHEMBL4748722 IC50 0.4 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccnc(Br)c3)oc12 CHEMBL4782753 IC50 0.46 nM
O=c1cc(-c2cccc(Cl)c2)oc2c1ccc1ccccc12 CHEMBL368236 IC50 0.49 nM
O=c1cc(-c2cccc(C(F)(F)F)c2)oc2c1ccc1ccccc12 CHEMBL4064195 IC50 0.52 nM
Fc1cccc(Nc2nc(-c3nc(-c4cccnc4)cs3)cs2)c1 CHEMBL5287897 IC50 0.551 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccccn3)oc12 CHEMBL4755282 IC50 0.6 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(OCCOCCOCCOCCN)c3)oc12 CHEMBL5422312 IC50 0.67 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(O)c(-c3ccc(F)cc3)oc12 CHEMBL3422350 IC50 0.8 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(Cl)ccn3)oc12 CHEMBL4798694 IC50 0.84 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc4ccccc4o3)oc12 CHEMBL4747913 IC50 0.87 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccnc(F)c3)oc12 CHEMBL4799346 IC50 0.93 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc4cc[nH]c4c3)oc12 CHEMBL4746733 IC50 0.95 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cncc(F)c3)oc12 CHEMBL4759778 IC50 0.98 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(N)nc3)oc12 CHEMBL4745341 IC50 0.98 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc4ccccc4n3)oc12 CHEMBL4742050 IC50 1.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccnc3)oc12 CHEMBL4781895 IC50 1.0 nM
COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)c(OC)c1 CHEMBL5412548 IC50 1.0 nM
COc1ccc(-c2cc(=O)c3cc(OC)c4c(OC)ccc(OC)c4c3o2)cc1 CHEMBL3422340 IC50 1.1 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccccc3Cl)oc12 CHEMBL3422336 IC50 1.1 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cncc(Br)c3)oc12 CHEMBL4750829 IC50 1.1 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccnc(Cl)c3)oc12 CHEMBL4799305 IC50 1.1 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(O)c(-c3ccccc3F)oc12 CHEMBL3422348 IC50 1.2 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccco3)oc12 CHEMBL4744690 IC50 1.2 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccncc3)oc12 CHEMBL4744264 IC50 1.2 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccc(C)n3)oc12 CHEMBL4750507 IC50 1.2 nM
COc1cc(Nc2nc(-c3nccs3)cs2)cc(OC)c1 CHEMBL5290149 IC50 1.21 nM
O=c1cc(-c2ccccc2)oc2c1ccc1ccccc12 CHEMBL283196 IC50 1.3 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cncc(C)c3)oc12 CHEMBL4791264 IC50 1.3 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(Br)cn3)oc12 CHEMBL4753119 IC50 1.3 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(NC(=O)COCCOCCOCCN)c3)oc12 CHEMBL5405256 IC50 1.44 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(O)c(-c3ccccc3Cl)oc12 CHEMBL3422351 IC50 1.6 nM
S=c1cc(-c2ccc(Cl)cc2)oc2c1ccc1ccccc12 CHEMBL4474545 IC50 1.6 nM
Clc1cc(Cl)cc(Nc2nc(-c3nccs3)cs2)c1 CHEMBL5280516 IC50 1.764 nM
COc1ccc(/C=C/c2c(OC)cccc2OC)c(OC)c1 CHEMBL3132932 IC50 1.77 nM
[N-]=[N+]=Nc1cccc(-c2cc(=O)c3ccc4ccccc4c3o2)c1 CHEMBL4514232 IC50 1.8 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc4ncccc4c3)oc12 CHEMBL4753629 IC50 1.8 nM
COc1cc(/C=C/c2cccs2)cc(OC)c1 CHEMBL42428 IC50 2.0 nM
c1cc2ccc3cccc4ccc(c1)c2c34 CHEMBL279564 IC50 2.0 nM
COc1cc(/C=C\c2cccs2)cc(OC)c1 CHEMBL122532 IC50 2.0 nM
COc1cc(/C=C/c2ccc(OC)cc2OC)cc(OC)c1 CHEMBL46909 IC50 2.0 nM
C#CCOc1ccc(-c2nc3ccccc3c(=O)[nH]2)cc1 CHEMBL4074105 IC50 2.0 nM
O=c1cc(-c2cccc(N3CCOCC3)c2)oc2c1ccc1ccccc12 CHEMBL4532886 IC50 2.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc4[nH]ncc4c3)oc12 CHEMBL4759437 IC50 2.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccnnc3)oc12 CHEMBL4749988 IC50 2.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(N)cc(F)c3)oc12 CHEMBL5400922 IC50 2.03 nM
C#Cc1ccc(-c2cc(=O)c3cc(OC)c4c(OC)ccc(OC)c4c3o2)cc1 CHEMBL4792004 IC50 2.1 nM
O=c1cc(-c2cccc(F)c2)oc2c1ccc1ccccc12 CHEMBL436080 IC50 2.2 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(O)c(-c3ccccc3)oc12 CHEMBL3422347 IC50 2.3 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(N)c(F)c3)oc12 CHEMBL5412492 IC50 2.47 nM
COc1ccc(-c2cc(=O)c3cc(OC)c4c(OC)ccc(OC)c4c3o2)cc1OC CHEMBL3422341 IC50 2.5 nM
[N-]=[N+]=Nc1ccc(-c2cc(=O)c3ccc4ccccc4c3o2)cc1 CHEMBL4474660 IC50 2.6 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cscn3)oc12 CHEMBL4781932 IC50 2.6 nM
O=c1cc(-c2ccc(F)cc2)oc2c1ccc1ccccc12 CHEMBL359819 IC50 2.7 nM
O=c1[nH]c(-c2ccc(Br)cc2)nc2ccccc12 CHEMBL2058057 IC50 3.0 nM
O=c1c(O)c(-c2ccccc2)oc2cc(O)cc(O)c12 CHEMBL309490 IC50 3.0 nM
COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O CHEMBL379064 Ki 3.0 nM
O/N=c1\cc(-c2ccccc2)oc2c1ccc1ccccc12 CHEMBL4434863 IC50 3.2 nM
COc1cc(Cl)cc(-c2cc(=O)c3ccc4ccccc4c3o2)c1 CHEMBL4541619 IC50 3.2 nM
O=c1cc(-c2ccccc2F)oc2c1ccc1ccccc12 CHEMBL361608 IC50 3.3 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(NC(=O)CCCCCCCCN)c3)oc12 CHEMBL5421843 IC50 3.37 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(O)c(-c3cccc(Cl)c3)oc12 CHEMBL3422352 IC50 3.5 nM
O=c1cc(-c2ccccn2)oc2c1ccc1ccccc12 CHEMBL4466261 IC50 3.5 nM
COc1cc2c(=O)cc(-c3cccc(Br)c3)[nH]c2c2c(OC)cccc12 CHEMBL4532099 IC50 3.6 nM
COc1cccc(-c2cc(=O)c3ccc4ccccc4c3o2)c1 CHEMBL3230194 IC50 3.8 nM
COc1cc2c(=O)cc(-c3ccc(F)cc3)[nH]c2c2c(OC)cccc12 CHEMBL4539787 IC50 3.9 nM
COc1cc(Nc2nc(-c3nc(-c4ccccc4)cs3)cs2)cc(OC)c1 CHEMBL5289888 IC50 3.915 nM
COc1ccccc1/C=C/c1ccc(OC)c(OC)c1 CHEMBL3132924 IC50 4.0 nM
COc1ccc2cc(C(=O)/C=C/c3cccnc3)ccc2c1 CHEMBL4092737 IC50 4.0 nM
O=C(/C=C/c1ccc2ccccc2c1)c1cccnc1 CHEMBL4059677 IC50 4.0 nM
O=c1[nH]c(-c2ccc(Oc3ccc(Cl)cc3Cl)cc2)nc2ccccc12 CHEMBL4100866 IC50 4.0 nM
COc1cc(/C=C/c2cccs2)cc(OCCn2ccnc2)c1 CHEMBL4447260 IC50 4.0 nM
COc1ccc(-c2cc(=O)c3cc(OC)c4cccc(OC)c4c3[nH]2)cc1 CHEMBL4456952 IC50 4.1 nM
CN(C)c1cccc(-c2cc(=O)c3ccc4ccccc4c3o2)c1 CHEMBL4558857 IC50 4.1 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3c[nH]c4ccccc34)oc12 CHEMBL4753083 IC50 4.1 nM
O=c1cc(-c2ccc(Cl)cc2)oc2c1ccc1ccccc12 CHEMBL425868 IC50 4.2 nM
O=c1cc(-c2cc(Cl)cc(Cl)c2)oc2c1ccc1ccccc12 CHEMBL4545007 IC50 4.2 nM
Cc1ccc(C(=O)Cn2c3c(sc2=N)CCCC3)cc1 CHEMBL556353 Ki 4.38 nM
[N-]=[N+]=N[C@H]1CC[C@@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1 CHEMBL4444783 IC50 4.4 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(NC(=O)COCCOCCN)c3)oc12 CHEMBL5429019 IC50 4.43 nM
Nc1nc(-c2ccccc2)cc(-c2ccc3ccccc3c2)n1 CHEMBL4563547 IC50 4.8 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccs3)oc12 CHEMBL4746097 IC50 4.8 nM
COc1ccc(OC)c2c(O)c(C(=O)/C=C/c3ccccc3)cc(OC)c12 CHEMBL4454231 IC50 4.9 nM
c1cn(Cc2ccc(Nc3nc(-c4nccs4)cs3)cc2)cn1 CHEMBL5280415 IC50 4.964 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(O)c(-c3ccc(Cl)cc3)oc12 CHEMBL3422353 IC50 5.0 nM
Fc1cccc(-c2cc(=S)c3ccc4ccccc4c3o2)c1 CHEMBL4556419 IC50 5.0 nM
COc1cc(OC)cc(-c2cncc(-c3cc(OC)cc(OC)c3)c2)c1 CHEMBL5405212 IC50 5.0 nM
COc1ccc(-c2nc(-c3cccnc3)cs2)c(OC)c1 CHEMBL5406710 IC50 5.0 nM
COc1cc(-c2cc(=O)c3ccc4ccccc4c3o2)cc(OC)c1OC CHEMBL4457289 IC50 5.1 nM
O=c1cc(-c2ccccc2)oc2c3c(cc(O)c12)OCC=C3 CHEMBL2347912 Ki 5.6 nM
O=c1cc(-c2ccc(F)c(F)c2)oc2c1ccc1ccccc12 CHEMBL4062213 IC50 5.6 nM
COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1 CHEMBL40919 IC50 6.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(N)cn3)oc12 CHEMBL4792471 IC50 6.0 nM
COc1ccc(-c2nc(-c3ccc(F)cc3)cs2)c(OC)c1 CHEMBL5401046 IC50 6.0 nM
Fc1ccccc1-c1csc(-c2csc(Nc3cc(Cl)cc(Cl)c3)n2)n1 CHEMBL5283668 IC50 6.062 nM
O=c1cc(-c2cccnc2)oc2c1ccc1ccccc12 CHEMBL177938 IC50 6.2 nM
Clc1ccc(Nc2nc(-c3nccs3)cs2)cc1 CHEMBL5289447 IC50 6.311 nM
Fc1cccc(Nc2nc(-c3nc(-c4ccccc4)cs3)cs2)c1 CHEMBL5272094 IC50 6.494 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccc(N)n3)oc12 CHEMBL4761904 IC50 6.5 nM
COc1cc(Nc2nc(-c3nc(-c4ccccc4F)cs3)cs2)cc(OC)c1 CHEMBL5280088 IC50 6.6 nM
Clc1cc(Cl)cc(Nc2nc(-c3nc(-c4ccccc4Cl)cs3)cs2)c1 CHEMBL5282966 IC50 6.636 nM
COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1 CHEMBL243664 IC50 7.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(-c4cn(CCCCCCOc5cccc6c5C(=O)N(C5CCC(=O)NC5=O)C6=O)nn4)cc3)oc12 CHEMBL4757820 IC50 7.01 nM
Fc1cccc(Nc2nc(-c3nc(-c4ccncc4)cs3)cs2)c1 CHEMBL5287228 IC50 7.137 nM
COc1ccc(-c2cc(=O)c3ccc4ccccc4c3o2)cc1 CHEMBL2420082 IC50 7.3 nM
Clc1cc(Nc2nc(-c3nccs3)cs2)cc(Cl)c1Cl CHEMBL5266178 IC50 7.452 nM
Clc1cccc(Nc2nc(-c3nccs3)cs2)c1 CHEMBL5276078 IC50 7.6 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccc(O)n3)oc12 CHEMBL4745897 IC50 7.7 nM
S=c1cc(-c2ccccc2)oc2c1ccc1ccccc12 CHEMBL4461997 IC50 7.8 nM
c1csc(-c2csc(Nc3ccc(N4CCOCC4)cc3)n2)n1 CHEMBL5287748 IC50 7.875 nM
O/N=c1\cc(-c2ccc(Cl)cc2)oc2c1ccc1ccccc12 CHEMBL4466582 IC50 8.0 nM
COc1cc(Nc2nc(-c3nc(-c4ccccc4Cl)cs3)cs2)cc(OC)c1 CHEMBL5269203 IC50 8.074 nM
Clc1ccccc1-c1csc(-c2csc(Nc3ccc(N4CCOCC4)cc3)n2)n1 CHEMBL5273468 IC50 8.672 nM
COc1ccccc1-c1cc(=O)c2cc(OC)c3c(OC)ccc(OC)c3c2o1 CHEMBL3422339 IC50 9.0 nM
c1ccc2c(c1)ccc1cc3c(ccc4ccccc43)cc12 CHEMBL1346946 IC50 9.0 nM
c1csc(-c2csc(Nc3ccc4c(c3)OCO4)n2)n1 CHEMBL5278329 IC50 9.0 nM
c1csc(-c2csc(Nc3ccc(Cn4cncn4)cc3)n2)n1 CHEMBL5290366 IC50 9.093 nM
COc1cccc(-c2cc(=S)c3ccc4ccccc4c3o2)c1 CHEMBL4551672 IC50 9.1 nM
O=c1cc(-c2ccncc2)oc2c1ccc1ccccc12 CHEMBL177991 IC50 9.3 nM
S=c1cc(-c2cccc(Cl)c2)oc2c1ccc1ccccc12 CHEMBL4553927 IC50 9.4 nM
COc1cc(Nc2nc(-c3nc(-c4cccc(OC)c4)cs3)cs2)cc(OC)c1 CHEMBL5282286 IC50 9.5 nM
COc1cc(-c2cc(=O)c3cc(OC)c4c(OC)ccc(OC)c4c3o2)cc(OC)c1OC CHEMBL3422342 IC50 9.8 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cncc(O)c3)oc12 CHEMBL4781446 IC50 10.3 nM
O/N=c1\cc(-c2cccc(Cl)c2)oc2c1ccc1ccccc12 CHEMBL4458757 IC50 10.4 nM
Fc1ccccc1-c1cc(=S)c2ccc3ccccc3c2o1 CHEMBL4562047 IC50 10.6 nM
CCc1sc(-c2csc(Nc3cc(OC)cc(OC)c3)n2)nc1-c1ccccc1 CHEMBL5268876 IC50 10.85 nM
Clc1ccc(-c2cc(Cl)c(Cl)c(Cl)c2)cc1Cl CHEMBL342696 IC50 11.0 nM
C[C@]12CC[C@@H]3c4cc(-c5cccnc5)c(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O CHEMBL4161655 IC50 11.0 nM
COc1cc(Nc2nc(-c3nc(-c4cccc(F)c4)cs3)cs2)cc(OC)c1 CHEMBL5288164 IC50 11.06 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(NC(=O)COCCN)c3)oc12 CHEMBL5426998 IC50 11.31 nM
c1ccc(-c2csc(-c3csc(Nc4ccc(N5CCOCC5)cc4)n3)n2)cc1 CHEMBL5268442 IC50 11.58 nM
Fc1cccc(Nc2nc(-c3nc(-c4ccccn4)cs3)cs2)c1 CHEMBL5280764 IC50 11.78 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(OCCOCCOCCOCCOC(=O)CN)c(-c3cccc(F)c3)oc12 CHEMBL3422358 IC50 12.3 nM
COc1cc(Nc2nc(-c3nc(-c4ccc(Cl)cc4F)cs3)cs2)cc(OC)c1 CHEMBL5276233 IC50 12.72 nM
c1ccc(-c2csc(-c3csc(Nc4ccc(N5CCOCC5)cc4)n3)n2)nc1 CHEMBL5276009 IC50 12.91 nM
Fc1ccccc1-c1csc(-c2csc(Nc3ccc(N4CCOCC4)cc3)n2)n1 CHEMBL5278091 IC50 12.91 nM
Fc1ccc(-c2cc(=S)c3ccc4ccccc4c3o2)cc1 CHEMBL4465703 IC50 13.3 nM
C=C=C[C@H]1CC[C@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1 CHEMBL4579760 IC50 13.4 nM
Clc1cc(Cl)cc(Nc2nc(-c3nc(-c4ccncc4)cs3)cs2)c1 CHEMBL5268036 IC50 14.44 nM
O=c1cc(-c2cccc(O)c2)oc2c1ccc1ccccc12 CHEMBL1801014 IC50 14.8 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccc(N4CCOCC4)c3)oc12 CHEMBL4740535 IC50 14.9 nM
O=C(/C=C/c1cccnc1)c1ccc2ccccc2c1 CHEMBL4063333 IC50 15.0 nM
COc1ccccc1/C=C/C(=O)c1cccnc1 CHEMBL4072091 IC50 15.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc4[nH]cnc4c3)oc12 CHEMBL4745122 IC50 15.6 nM
COc1cc(Nc2nc(-c3nc(-c4cccc(Cl)c4)cs3)cs2)cc(OC)c1 CHEMBL5290026 IC50 15.85 nM
c1cncc(-c2csc(-c3csc(Nc4ccc(N5CCOCC5)cc4)n3)n2)c1 CHEMBL5290901 IC50 15.93 nM
O=c1cc(-c2ccccc2)oc2cc(O)cc(O)c12 CHEMBL117 Ki 16.0 nM
COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1O CHEMBL90568 Ki 16.0 nM
O=C(/C=C/c1cccnc1)c1ccc2ccccc2c1O CHEMBL4559128 IC50 16.7 nM
COc1cc(Nc2nc(-c3nc(-c4cccc(C#N)c4)cs3)cs2)cc(OC)c1 CHEMBL5270385 IC50 16.7 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(NC(=O)CCCCN)c3)oc12 CHEMBL5435493 IC50 17.93 nM
COc1cc(-c2cc(=S)c3ccc4ccccc4c3o2)cc(OC)c1OC CHEMBL4483482 IC50 18.8 nM
COc1ccc(/C=C/C(=O)c2cccnc2)cc1OC CHEMBL4063471 IC50 19.0 nM
COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1OC CHEMBL76426 IC50 19.0 nM
COc1cc(OC)cc(-c2ccnc(-c3cc(OC)cc(OC)c3)n2)c1 CHEMBL5418617 IC50 19.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(OCCOC(=O)CN)c(-c3cccc(F)c3)oc12 CHEMBL3422354 IC50 19.6 nM
COc1cc(-c2cc(=O)c3c(O)cc(O)cc3o2)ccc1O CHEMBL214321 IC50 19.7 nM
COc1ccc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc1O CHEMBL226034 IC50 20.0 nM
Clc1cc(Cl)cc(Nc2nc(-c3nc(-c4ccccc4)cs3)cs2)c1 CHEMBL5281938 IC50 20.14 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccnc(N)c3)oc12 CHEMBL4740802 IC50 20.6 nM
O=c1cc(-c2ccccc2Cl)oc2c1ccc1ccccc12 CHEMBL175450 IC50 21.6 nM
COc1ccc(/C=C/C(=O)c2ccncc2)c(OC)c1OC CHEMBL2237710 IC50 22.0 nM
C#CCOc1ccccc1-c1csc(-c2csc(Nc3cccc(F)c3)n2)n1 CHEMBL5280421 IC50 22.19 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cncc(N)c3)oc12 CHEMBL4741985 IC50 22.9 nM
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 CHEMBL50 Ki 23.0 nM
O=C(/C=C/c1cccnc1)c1cccc2ccccc12 CHEMBL4071959 IC50 23.0 nM
Cc1sc(-c2csc(Nc3cc(Cl)cc(Cl)c3)n2)nc1-c1ccccc1 CHEMBL5270417 IC50 23.34 nM
[N-]=[N+]=NCC1CCC(c2cc(=O)c3ccc4ccccc4c3o2)CC1 CHEMBL4571646 IC50 23.5 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(-c4cn(CCOc5cccc6c5C(=O)N(C5CCC(=O)NC5=O)C6=O)nn4)cc3)oc12 CHEMBL4749570 IC50 24.2 nM
CC(=O)S[C@H]1CC[C@@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1 CHEMBL4470607 IC50 24.3 nM
CN1CCN(c2cccc(-c3cc(=O)c4ccc5ccccc5c4o3)c2)CC1 CHEMBL4585810 IC50 24.6 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccncc3N)oc12 CHEMBL4746873 IC50 24.8 nM
O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12 CHEMBL28 IC50 25.0 nM
COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)cc1 CHEMBL5425709 IC50 25.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(OCCOCCN)c3)oc12 CHEMBL5418796 IC50 25.88 nM
COc1cccc(-c2csc(-c3csc(Nc4ccc(N5CCOCC5)cc4)n3)n2)c1 CHEMBL5268929 IC50 26.82 nM
O=c1c(O)c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c12 CHEMBL164 Ki 27.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(-c4cn(CCCCCOc5cccc6c5C(=O)N(C5CCC(=O)NC5=O)C6=O)nn4)cc3)oc12 CHEMBL4763775 IC50 28.25 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(NC(=O)CCCCCCN)c3)oc12 CHEMBL5396845 IC50 28.73 nM
O=C(/C=C/c1ccc2c(c1)OCO2)c1cccnc1 CHEMBL1413330 IC50 29.0 nM
CC(=O)S[C@H]1CC[C@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1 CHEMBL4547387 IC50 29.4 nM
CCc1sc(-c2csc(Nc3cc(Cl)cc(Cl)c3)n2)nc1-c1ccccc1 CHEMBL5267009 IC50 29.51 nM
CC#Cc1ccc2c(ccc3ccccc32)c1 CHEMBL253346 IC50 30.0 nM
COc1cccc(/C=C/c2ccc(SC)cc2)c1 CHEMBL2071344 Ki 30.0 nM
C#Cc1cc2ccc3cccc4ccc(c1)c2c34 CHEMBL3215302 IC50 30.0 nM
COc1c(-c2ccccc2)oc2c(ccc3occc32)c1=O CHEMBL208484 IC50 30.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cncc(C(=O)O)c3)oc12 CHEMBL4763388 IC50 30.1 nM
COc1ccc(/C=C/C(=O)c2cccnc2)c(OC)c1OC CHEMBL2237709 IC50 31.0 nM
COc1cc(-c2nc3ccccc3c(=O)[nH]2)ccc1O CHEMBL4081914 IC50 31.0 nM
COc1cc(/C=C/C(=O)c2ccncc2)cc(OC)c1 CHEMBL4214111 IC50 31.0 nM
COc1cccc(/C=C/C(=O)c2cccnc2)c1 CHEMBL4099058 IC50 32.0 nM
C[C@]12CC[C@@H]3c4cc(-c5ccncc5)c(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O CHEMBL4172273 IC50 32.0 nM
Clc1cc(Cl)cc(Nc2nc(-c3nc(-c4cccnc4)cs3)cs2)c1 CHEMBL5275398 IC50 33.14 nM
COc1ccc(-c2cc(=O)c3c(O)c(OC)c(OC)cc3o2)cc1O CHEMBL487402 Ki 35.0 nM
Fc1ccc(Nc2nc(-c3nccs3)cs2)cc1 CHEMBL5279084 IC50 35.65 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(-c4cn(CCCCCCCCOc5cccc6c5C(=O)N(C5CCC(=O)NC5=O)C6=O)nn4)cc3)oc12 CHEMBL4746654 IC50 36.93 nM
O=c1c2ccc(Cl)cc2nc2n1CCc1c-2[nH]c2ccccc12 CHEMBL86078 IC50 37.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(OCCOCCOC(=O)CN)c(-c3cccc(F)c3)oc12 CHEMBL3422357 IC50 37.02 nM
COc1ccccc1/C=C/C(=O)c1ccc2ccccc2c1O CHEMBL4514655 IC50 37.8 nM
COc1cc(OC)cc(-c2cccc(-c3cc(OC)cc(OC)c3)c2)c1 CHEMBL5395150 IC50 38.0 nM
O=c1cc([C@H]2CC[C@@H](S)CC2)oc2c1ccc1ccccc12 CHEMBL4441141 IC50 38.8 nM
Clc1cc(Cl)cc(Nc2nc(-c3nc(-c4ccccc4)c(-c4ccccc4)s3)cs2)c1 CHEMBL5270072 IC50 39.02 nM
O=C(/C=C/c1ccc(Cl)cc1)c1ccc2ccccc2c1O CHEMBL1935214 IC50 40.2 nM
O=c1cc([C@H]2CC[C@H](S)CC2)oc2c1ccc1ccccc12 CHEMBL4476231 IC50 40.3 nM
O=c1cc(-c2cccc(Cl)c2)sc2c1ccc1ccccc12 CHEMBL4438763 IC50 40.5 nM
COc1ccccc1/C=C/c1ccc(SC)cc1 CHEMBL2071343 Ki 41.0 nM
O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12 CHEMBL150 Ki 43.0 nM
O=c1cc(-c2ccc(O)cc2)oc2c1ccc1ccccc12 CHEMBL1315298 IC50 43.4 nM
COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2 CHEMBL295124 Ki 44.0 nM
Clc1cc(Cl)cc(Nc2nc(-c3nc(-c4ccccn4)cs3)cs2)c1 CHEMBL5276124 IC50 44.79 nM
O=C(/C=C/c1cccc(Cl)c1)c1ccc2ccccc2c1O CHEMBL4566283 IC50 46.6 nM
FCCOc1nc(-c2ccc(Br)cc2)nc2ccccc12 CHEMBL5434263 IC50 47.3 nM
CN1CCN(c2cc(Cl)cc(-c3cc(=O)c4ccc5ccccc5c4o3)c2)CC1 CHEMBL4518052 IC50 47.7 nM
O=C(/C=C/c1cccnc1)c1ccc2ccc3ccccc3c2c1 CHEMBL4080095 IC50 48.0 nM
COc1ccccc1/C=C/C(=O)c1ccncc1 CHEMBL4209004 IC50 48.0 nM
FCCOCCOCCOc1nc(-c2ccc(Br)cc2)nc2ccccc12 CHEMBL5402440 IC50 48.2 nM
O=C(/C=C/c1ccc(F)cc1)c1ccc2ccccc2c1O CHEMBL4549846 IC50 48.31 nM
O=c1cc(-c2ccc3ccccc3c2)oc2c1ccc1ccccc12 CHEMBL3230195 IC50 48.4 nM
O=c1[nH]c(-c2ccc(OCCF)cc2)nc2ccccc12 CHEMBL5437218 IC50 49.4 nM
Brc1ccc(/N=N/Nc2ccc(Br)cc2)cc1 CHEMBL5179953 IC50 51.0 nM
COc1ccc(-c2csc(-c3csc(Nc4cc(OC)cc(OC)c4)n3)n2)cc1 CHEMBL5280700 IC50 51.28 nM
COc1c(C(=O)/C=C/c2ccccc2)ccc2ccccc12 CHEMBL4468505 IC50 51.4 nM
O=C(/C=C/c1ccc[nH]1)c1ccc2ccccc2c1O CHEMBL4566759 IC50 51.8 nM
O=c1cc(-c2ccc(Cl)cc2)sc2c1ccc1ccccc12 CHEMBL4471231 IC50 51.9 nM
O=c1cc(-c2ccccc2)oc2c3c(ccc12)OCC=C3 CHEMBL2347756 Ki 53.0 nM
COc1ccc(-c2nc3ccccc3c(=O)[nH]2)cc1O CHEMBL3289112 IC50 54.0 nM
COc1cccc(/C=C/C(=O)c2ccncc2)c1 CHEMBL4212722 IC50 54.0 nM
COc1cc(OC)cc(-c2csc(-c3cc(OC)cc(OC)c3)n2)c1 CHEMBL5406117 IC50 54.0 nM
O=c1c2ccccc2nc2n1CCc1c-2[nH]c2ccccc12 CHEMBL85139 IC50 55.0 nM
O=c1c2ccccc2nc2c3[nH]c4ccccc4c3ccn12 CHEMBL4098122 IC50 55.0 nM
O=C(/C=C/c1ccccc1Cl)c1ccc2ccccc2c1O CHEMBL1935213 IC50 55.4 nM
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 CHEMBL151 Ki 56.0 nM
O=c1cc(-c2ccccc2)sc2c1ccc1ccccc12 CHEMBL4568026 IC50 57.0 nM
O=C(/C=C/c1cccnc1)c1cccc(Cl)c1 CHEMBL4065284 IC50 59.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccnc(O)c3)oc12 CHEMBL4740805 IC50 61.5 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccccc3O)oc12 CHEMBL3422346 IC50 62.9 nM
C[C@]12CC[C@@H]3c4cc(-c5cccnc5)c(O)cc4CC[C@H]3[C@@H]1CCC2=O CHEMBL4165068 IC50 63.0 nM
CN1CCN(c2ccc(-c3cc(=O)c4ccc5ccccc5c4o3)cc2)CC1 CHEMBL4470790 IC50 63.8 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccnc3Br)oc12 CHEMBL4754216 IC50 63.9 nM
O=C(/C=C/c1cccnc1)c1cccc(Br)c1 CHEMBL4084977 IC50 64.0 nM
COc1cc(Nc2nc(-c3nc(-c4ccccc4)c(C)s3)cs2)cc(OC)c1 CHEMBL5272757 IC50 64.8 nM
COc1cc(Nc2nc(-c3nc(-c4ccc(F)cc4)cs3)cs2)cc(OC)c1 CHEMBL5285319 IC50 65.1 nM
O=c1cc(C2CCCC(S)C2)oc2c1ccc1ccccc12 CHEMBL4573324 IC50 66.1 nM
C=C=C[C@H]1CC[C@@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1 CHEMBL4541853 IC50 68.1 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(OCCOCCOCCOC(=O)CN)c(-c3cccc(F)c3)oc12 CHEMBL3421640 IC50 68.81 nM
Oc1c2ccccc2nc2c3nc4ccccc4c-3ccn12 CHEMBL413956 IC50 69.0 nM
COc1cccc2c(=O)n3c(nc12)-c1[nH]c2ccccc2c1CC3 CHEMBL314132 IC50 71.0 nM
Cc1sc(-c2csc(Nc3cccc(F)c3)n2)nc1-c1ccncc1 CHEMBL5275310 IC50 73.34 nM
COc1cccc(Nc2nc(-c3nccs3)cs2)c1 CHEMBL5268347 IC50 76.81 nM
O=C(/C=C/c1ccccc1O)c1ccc2ccccc2c1O CHEMBL4476356 IC50 76.9 nM
O=C(/C=C/c1ccccc1)c1cccnc1 CHEMBL4087973 IC50 77.0 nM
C#CCOc1ccccc1-c1csc(-c2csc(Nc3cc(OC)cc(OC)c3)n2)n1 CHEMBL5270659 IC50 77.56 nM
COc1ccc(/C=C/c2cc(OC)c(OC)cc2OC)c(OC)c1 CHEMBL3220148 IC50 78.4 nM
COc1cc(OC)c2nc3n(c(=O)c2c1)CCc1c-3[nH]c2ccccc12 CHEMBL314445 IC50 80.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(F)cc(OCCOCCOCCN)c3)oc12 CHEMBL5426732 IC50 81.67 nM
O=C(/C=C/c1cccc(F)c1)c1ccc2ccccc2c1O CHEMBL4518018 IC50 81.9 nM
COc1ccc2[nH]c3c(c2c1)CCn1c-3nc2ccccc2c1=O CHEMBL85826 IC50 84.0 nM
COc1cc(Nc2nc(-c3nc(-c4ccccc4)c(-c4ccccc4)s3)cs2)cc(OC)c1 CHEMBL5278510 IC50 86.24 nM
O=c1cc(-c2ccccc2Cl)sc2c1ccc1ccccc12 CHEMBL4446470 IC50 89.7 nM
O=c1c2cc(Cl)ccc2nc2n1CCc1c-2[nH]c2ccccc12 CHEMBL85106 IC50 90.0 nM
O=c1c(O)c(-c2ccccc2)oc2ccccc12 CHEMBL294009 IC50 90.0 nM
O=c1c2ccccc2nc2n1CCc1c-2[nH]c2ccc(O)cc12 CHEMBL4076052 IC50 90.0 nM
Nc1ccc2[nH]c3c(c2c1)CCn1c-3nc2ccccc2c1=O CHEMBL5269513 IC50 90.0 nM
O=C(/C=C/c1ccccc1F)c1ccc2ccccc2c1O CHEMBL4581268 IC50 90.2 nM
O=C(/C=C/c1ccncc1)c1ccc2ccccc2c1O CHEMBL4469707 IC50 90.2 nM
[N-]=[N+]=NC1CCCC(c2cc(=O)c3ccc4ccccc4c3o2)C1 CHEMBL4436010 IC50 90.3 nM
COc1ccc(C(=O)/C=C/c2cccnc2)c(OC)c1 CHEMBL427692 IC50 93.0 nM
CCN1/C(=C/C=C/C=C/C2=[N+](CCCCCC(=O)NCCOCCOCCOCCOc3cc(F)cc(-c4cc(=O)c5cc(OC)c6c(OC)ccc(OC)c6c5o4)c3)c3ccc4c(S(=O)(=O)[O-])cc(S(=O)(=O)O)cc4c3C2(C)C)C(C)(C)c2c1ccc1c(S(=O)(=O)O)cc(S(=O)(=O)O)cc21 CHEMBL5410375 Kd(app) 93.7 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(O)cc(F)c3)oc12 CHEMBL5404201 IC50 95.05 nM
O=C(/C=C/c1ccccc1)c1ccc2ccccc2c1 CHEMBL17200 IC50 95.5 nM
O=C(/C=C/c1ccc(Cl)c(Cl)c1)c1cccnc1 CHEMBL4068333 IC50 96.0 nM
COc1cc(/C=C/c2ccc(OC)cc2F)cc(OC)c1 CHEMBL43740 IC50 97.0 nM
COc1cccc(/C=C/c2ccc(OC)cc2OC)c1 CHEMBL3220143 IC50 98.2 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(OCCOC(=O)[C@H](C)N)c(-c3cccc(F)c3)oc12 CHEMBL3422355 IC50 98.4 nM
Cc1cc2c(cc(O)c3c(=O)cc(-c4ccccc4)oc32)o1 CHEMBL3601434 Ki 100.0 nM
COc1cc(OC)cc(-c2cc(-c3cc(OC)cc(OC)c3)ncn2)c1 CHEMBL5438759 IC50 100.0 nM
O=c1cc(-c2ccccc2F)sc2c1ccc1ccccc12 CHEMBL4546511 IC50 103.6 nM
COc1cc(OC)cc(C(=O)/C=C/c2cccnc2)c1 CHEMBL4093676 IC50 106.0 nM
COc1ccc2c3c([nH]c2c1)-c1nc2ccccc2c(=O)n1CC3 CHEMBL312149 IC50 110.0 nM
COc1ccc(/C=C/C(=O)c2cccnc2)cc1O CHEMBL4091327 IC50 112.0 nM
Nc1c(C(=O)/C=C/c2ccccc2)ccc2ccccc12 CHEMBL4473797 IC50 112.4 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(O)c(F)c3)oc12 CHEMBL5411203 IC50 112.63 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)c(OCCOC(=O)[C@@H](N)C(C)C)c(-c3cccc(F)c3)oc12 CHEMBL3422356 IC50 114.5 nM
O=c1c2cc(Br)ccc2nc2n1CCc1c-2[nH]c2ccccc12 CHEMBL85960 IC50 120.0 nM
O=c1cc(-c2ccccc2)oc2c1ccc1ncccc12 CHEMBL3601435 Ki 120.0 nM
O=C(/C=C/c1ccc(F)c(F)c1)c1cccnc1 CHEMBL4095688 IC50 120.0 nM
O=c1[nH]c(-c2ccc(OCc3ccc(F)cc3F)cc2)nc2ccccc12 CHEMBL4084413 IC50 120.0 nM
C[C@]12CC[C@@H]3c4cc(-c5ccncc5)c(O)cc4CC[C@H]3[C@@H]1CCC2=O CHEMBL4175688 IC50 120.0 nM
COc1cccc(C(=O)/C=C/c2cccnc2)c1 CHEMBL4095308 IC50 130.0 nM
N#C[Se]Cc1ccccc1 CHEMBL1806721 IC50 130.0 nM
N#C[Se]Cc1ccccc1C[Se]C#N CHEMBL4099741 IC50 130.0 nM
N#C[Se]Cc1cccc(C[Se]C#N)c1 CHEMBL4075813 IC50 130.0 nM
N#C[Se]Cc1ccc(C[Se]C#N)cc1 CHEMBL113478 IC50 130.0 nM
O=C(/C=C/c1cccnc1)c1cc2ccccc2c2ccccc12 CHEMBL4098125 IC50 133.0 nM
[N-]=[N+]=N[C@H]1CC[C@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1 CHEMBL4464279 IC50 134.6 nM
O=C(/C=C/c1ccccn1)c1ccc2ccccc2c1O CHEMBL4554686 IC50 135.0 nM
COc1ccc(C(=O)/C=C/c2cccnc2)c(OC)c1OC CHEMBL509932 IC50 137.0 nM
COc1ccc2nc3n(c(=O)c2c1OC)CCc1c-3[nH]c2ccccc12 CHEMBL86022 IC50 140.0 nM
COc1ccc2nc3n(c(=O)c2c1)CCc1c-3[nH]c2ccccc12 CHEMBL312848 IC50 140.0 nM
C/C(=C\C(=O)c1cc(O)c(Br)cc1O)CCCC(C)(C)O CHEMBL4092623 IC50 140.0 nM
COc1ccc(/C=C/c2c(OC)cc(OC)cc2OC)c(OC)c1 CHEMBL3220149 IC50 148.0 nM
CCCCCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2 CHEMBL74415 Ki 148.0 nM
O=C(CCc1ccccc1)c1ccc2ccccc2c1O CHEMBL4449722 IC50 151.3 nM
c1cc(-c2csc(-c3csc(Nc4ccc(N5CCOCC5)cc4)n3)n2)ccn1 CHEMBL5276355 IC50 152.7 nM
CCc1sc(-c2csc(Nc3ccc(N4CCOCC4)cc3)n2)nc1-c1ccncc1 CHEMBL5266551 IC50 154.9 nM
COc1cc(Nc2nc(-c3nc(-c4ccc(OC)c(OC)c4)cs3)cs2)cc(OC)c1 CHEMBL5278641 IC50 156.16 nM
O=C(/C=C/c1ccccc1)c1ccc2ccccc2c1O CHEMBL1935209 IC50 157.7 nM
COc1cc2nc3n(c(=O)c2cc1OC)CCc1c-3[nH]c2ccccc12 CHEMBL315422 IC50 160.0 nM
O=C(/C=C/c1cccnc1)c1ccc2ccc3cccc4ccc1c2c34 CHEMBL4069375 IC50 162.0 nM
CCN1/C(=C/C=C/C=C/C2=[N+](CCCCCC(=O)NCCOCCOCCOCC(=O)Nc3cc(F)cc(-c4cc(=O)c5cc(OC)c6c(OC)ccc(OC)c6c5o4)c3)c3ccc4c(S(=O)(=O)[O-])cc(S(=O)(=O)O)cc4c3C2(C)C)C(C)(C)c2c1ccc1c(S(=O)(=O)O)cc(S(=O)(=O)O)cc21 CHEMBL5400206 Kd(app) 168.0 nM
COc1ccc2c(=O)n3c(nc2c1)-c1[nH]c2ccccc2c1CC3 CHEMBL312248 IC50 170.0 nM
COc1ccc(/C=C/C(=O)c2ccncc2)cc1OC CHEMBL4202990 IC50 170.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cccnc3N)oc12 CHEMBL4746672 IC50 175.2 nM
COc1ccc(C(=O)/C=C/c2cccnc2)cc1OC CHEMBL1970023 IC50 176.0 nM
Cc1cc2c(ccc3c(=O)cc(-c4ccccc4)oc32)o1 CHEMBL3601433 Ki 180.0 nM
O=C(/C=C/c1ccncc1)c1ccc2ccccc2c1 CHEMBL4082447 IC50 187.0 nM
O=C(/C=C/c1cccnc1)c1ccc(-c2ccccc2)cc1 CHEMBL4100464 IC50 189.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3c[nH]c4ncccc34)oc12 CHEMBL4795310 IC50 189.4 nM
COc1ccc(/C=C/c2ccc(OC)c(OC)c2)c(OC)c1 CHEMBL3132926 IC50 190.0 nM
COc1ccc(/C=C/c2cccc(OC)c2OC)c(OC)c1 CHEMBL3220146 IC50 192.0 nM
O=C(/C=C/c1ccccc1Cl)c1ccc[nH]1 CHEMBL1335197 IC50 200.0 nM
Cc1sc(-c2csc(Nc3ccc(N4CCOCC4)cc3)n2)nc1-c1ccncc1 CHEMBL5278741 IC50 202.6 nM
O=c1cc(-c2ccccc2)oc2cccc(O)c12 CHEMBL16807 IC50 210.0 nM
CCN1/C(=C/C=C/C=C/C2=[N+](CCCCCC(=O)NCCCCCCCCC(=O)Nc3cc(F)cc(-c4cc(=O)c5cc(OC)c6c(OC)ccc(OC)c6c5o4)c3)c3ccc4c(S(=O)(=O)[O-])cc(S(=O)(=O)O)cc4c3C2(C)C)C(C)(C)c2c1ccc1c(S(=O)(=O)O)cc(S(=O)(=O)O)cc21 CHEMBL5411486 Kd(app) 212.8 nM
Nc1nccc(-c2c[nH]c3ccc(Br)cc23)n1 CHEMBL44541 IC50 213.0 nM
O=c1cc(-c2ccc(O)cc2)oc2cc(O)c(O)c(O)c12 CHEMBL55415 Ki 220.0 nM
COc1c(-c2ccccc2)oc2c(ccc3ccoc32)c1=O CHEMBL4282750 IC50 220.0 nM
COc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12 CHEMBL452751 IC50 220.0 nM
COc1ccc(/C=C/c2ccc(OC)cc2OC)c(OC)c1 CHEMBL3220145 IC50 222.0 nM
O=C1C=C(c2ccccc2)S(=O)(=O)c2c1ccc1ccccc21 CHEMBL4462604 IC50 222.9 nM
COc1cc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)ccc1O CHEMBL490170 IC50 240.0 nM
C[C@]12CC[C@@H]3c4cc(-c5ccc(F)cc5)c(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O CHEMBL4215891 IC50 240.0 nM
CCc1sc(-c2csc(Nc3cccc(F)c3)n2)nc1-c1ccccc1 CHEMBL5267964 IC50 245.9 nM
O=c1cc(-c2ccccc2)oc2cc(O)ccc12 CHEMBL276915 IC50 250.0 nM
O=C1C=C(c2cccc(Cl)c2)S(=O)(=O)c2c1ccc1ccccc21 CHEMBL4471332 IC50 250.4 nM
O=c1cc(-c2ccccc2)oc2cc(O)c(O)c(O)c12 CHEMBL8260 Ki 260.0 nM
O=c1cc(-c2ccccc2)oc2c1ccc1occc12 CHEMBL224157 IC50 290.0 nM
CSc1ccc(/C=C/c2ccccc2Cl)cc1 CHEMBL2071353 IC50 300.0 nM
COc1cc(OC)c(/C=C/c2ccc(OC)c(OC)c2)c(OC)c1 CHEMBL3132931 IC50 300.0 nM
COc1ccc(/C=C/c2ccccc2)cc1OC CHEMBL327223 IC50 300.0 nM
COc1ccc(/C=C/c2cc(OC)c(OC)c(OC)c2)c(OC)c1 CHEMBL3220147 IC50 301.0 nM
COc1ccc(/C=C/c2c(OC)cccc2OC)cc1OC CHEMBL3132928 IC50 310.0 nM
C[n+]1c2n(c(=O)c3ccccc31)CCc1c-2[nH]c2ccccc12 CHEMBL81923 IC50 330.0 nM
COc1ccc(/C=C/c2ccccc2OC)c(OC)c1 CHEMBL2043279 IC50 336.0 nM
COc1cc(/C=C/C(=O)c2cccnc2)cc(OC)c1OC CHEMBL4079191 IC50 349.0 nM
COc1ccc(OC)c(/C=C/c2ccc(OC)cc2OC)c1 CHEMBL3220144 IC50 350.0 nM
COc1ccc(/C=C/c2cccc(OC)c2OC)cc1OC CHEMBL3132925 IC50 370.0 nM
C#C[C@]1(O)CC[C@H]2[C@@H]3CCc4cc(O)c(-c5ccc(OC)cc5)cc4[C@H]3CC[C@@]21C CHEMBL4218514 IC50 370.0 nM
COc1cc(/C=C/c2ccc(OC)cc2O)cc(OC)c1 CHEMBL43395 IC50 390.0 nM
COc1ccc(/C=C/c2c(OC)ccc(OC)c2OC)c(OC)c1 CHEMBL3220150 IC50 420.0 nM
COc1cc(/C=C/c2ccncc2)cc(OC)c1 CHEMBL43013 IC50 460.0 nM
O=C(/C=C/c1cccc(O)c1)c1cccnc1 CHEMBL1517429 IC50 466.0 nM
O=c1cc(-c2ccccc2)oc2c3c(ccc12)OCO3 CHEMBL3601436 Ki 480.0 nM
COc1ccc(/C=C/c2ccccc2)c(OC)c1 CHEMBL3219852 IC50 493.0 nM
COc1cc(OC)c(/C=C/c2ccc(SC)cc2)c(OC)c1 CHEMBL2071352 IC50 500.0 nM
O=C1c2ccccc2C(=O)c2c1ccc(O)c2O CHEMBL55814 Ki 500.0 nM
C[C@]12CCCCC1=CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)[C@H](F)C[C@@H]12 CHEMBL4441355 IC50 500.0 nM
COc1ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)cc1O CHEMBL399121 IC50 511.0 nM
Fc1cccc(Nc2nc(-c3nc(-c4ccccc4)c(-c4ccccc4)s3)cs2)c1 CHEMBL5276131 IC50 517.9 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3cc(Cl)cc(N4CCN(C)CC4)c3)oc12 CHEMBL4778382 IC50 519.4 nM
COc1ccc(C(=O)/C=C/c2cccnc2)cc1 CHEMBL4074953 IC50 525.0 nM
CC(C)c1sc(-c2csc(Nc3cccc(F)c3)n2)nc1-c1ccccc1 CHEMBL5268218 IC50 528.1 nM
Fc1cc(Cl)ccc1-c1csc(-c2csc(Nc3ccc(N4CCOCC4)cc3)n2)n1 CHEMBL5266418 IC50 534.3 nM
O=c1cc(C2CCCCC2)oc2c1ccc1ccccc12 CHEMBL1223487 IC50 539.8 nM
C[C@]12CC[C@@H]3c4ccc(OCc5cccnc5)cc4CC[C@H]3[C@@H]1CC[C@@H]2O CHEMBL4205335 IC50 540.0 nM
COc1ccc(-c2csc(-c3csc(Nc4cccc(F)c4)n3)n2)cc1OC CHEMBL5277075 IC50 566.8 nM
CC(=O)c1ccc(/N=N/Nc2ccc(C(C)=O)cc2)cc1 CHEMBL5194993 IC50 590.0 nM
O=c1cc(-c2ccccc2)oc2ccccc12 CHEMBL275638 IC50 600.0 nM
COc1c(C(=O)/C=C(\O)c2ccc3c(c2)OCO3)ccc2occc12 CHEMBL573847 IC50 600.0 nM
COc1ccc(-c2nc(-c3ccc(O)cc3)cs2)c(OC)c1 CHEMBL5406218 IC50 600.0 nM
CCOc1c(OC)cc(/C=C/C(=O)c2ccncc2)cc1OC CHEMBL4213815 IC50 610.0 nM
COc1ccc(OC)c(/C=C/c2ccc(OC)c(OC)c2)c1 CHEMBL3132927 IC50 620.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(O)cc3)oc12 CHEMBL3422345 IC50 642.9 nM
O=C(/C=C/c1cccc2ccccc12)c1ccncc1 CHEMBL1568243 IC50 650.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(O)nc3)oc12 CHEMBL4758643 IC50 658.3 nM
COc1ccc(/C=C/c2ccc(OC)cc2OC)cc1 CHEMBL242396 IC50 666.0 nM
COc1cc(OC)cc(C(=O)Nc2ccc(OC)cc2OC)c1 CHEMBL42427 IC50 670.0 nM
COc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)cc3o2)cc1O CHEMBL124885 Ki 670.0 nM
CN1c2ccccc2C(=O)N2CCc3c([nH]c4ccccc34)[C@@H]21 CHEMBL486598 IC50 690.0 nM
O=C1c2ccccc2C(=O)c2c(O)c(O)cc(O)c21 CHEMBL294264 Ki 700.0 nM
N#Cc1ccc(/N=N/Nc2ccc(C#N)cc2)cc1 CHEMBL5173529 IC50 740.0 nM
Oc1ccc(/C=C/c2cc(O)cc(O)c2)cc1 CHEMBL165 Ki 750.0 nM
COc1ccc(OC)c2c1c(OC)cc1c(=O)cc(-c3ccc(OCc4ccccc4)cc3)oc12 CHEMBL3422343 IC50 771.4 nM
COc1ccc(/C=C/c2cc(OC)cc(OC)c2)cc1 CHEMBL296411 IC50 790.0 nM
COc1ccc(/C=C/c2cc(O)cc(O)c2)cc1 CHEMBL291501 IC50 800.0 nM
COc1cc(OC)c(OC)cc1/C=C/c1ccc(SC)cc1 CHEMBL2071351 IC50 900.0 nM
COc1cc(O)cc(/C=C/c2ccc(O)cc2)c1 CHEMBL498917 Ki 900.0 nM
COc1cc(/C=C/c2ccc(O)cc2)cc(OC)c1 CHEMBL83527 Ki 900.0 nM
COc1ccccc1/C=C/C(=O)c1ccc[nH]1 CHEMBL4105559 IC50 900.0 nM
COc1c(-c2ccc3c(c2)OCO3)oc2c(ccc3occc32)c1=O CHEMBL577397 IC50 950.0 nM
COc1ccc(/C=C/c2ccc(SC)cc2)c(OC)c1OC CHEMBL2071350 IC50 1000.0 nM
CC(C)=CCOc1c2occc2cc2ccc(=O)oc12 CHEMBL453805 Ki 1000.0 nM