C[C@@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C CHEMBL395414 Kd 0.0289 nM
C/C=C1\[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O CHEMBL3289607 Kd 2.59 nM
O=C(Nc1c(F)cccc1F)c1ccc(-c2cc(C(F)(F)F)ccc2Cl)s1 CHEMBL3646774 IC50 3.0 nM
COC(=O)c1ccc(C)c(-c2ccc(C(=O)Nc3c(F)cccc3F)s2)c1 CHEMBL3646776 IC50 6.4 nM
O=C(Nc1ccc(-c2cc(C(F)(F)F)ccc2Cl)cc1)c1c(F)cccc1F CHEMBL4857063 IC50 8.0 nM
C[C@H]1CC(=O)c2ccc(Nc3cc4c([C@](C)(N)C5CC5)cnc(OC5CC5)c4cn3)cc2C12CC2 CHEMBL5205694 EC50 9.4 nM
Cc1cc2[nH]c(-c3n[nH]c4c3C[C@@H]3C(F)(F)[C@]3(C)C4)nc2cc1N(C)C(=O)[C@H](C)N1CCOCC1 CHEMBL5087453 IC50 10.0 nM
Cc1c(-c2ccc(NC(=O)c3c(F)cccc3F)cc2)cccc1-c1nn(C)c(=O)o1 CHEMBL4868242 IC50 11.0 nM
C[C@@H](C(=O)N(C)c1ccc2[nH]c(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)nc2c1)C1CCOCC1 CHEMBL5090091 IC50 13.0 nM
Cc1cnccc1NC(=O)c1ccc(-c2cc(C(F)(F)F)ccc2Cl)s1 CHEMBL3646775 IC50 14.0 nM
Cc1c(-c2ccc(NC(=O)c3c(F)cccc3Cl)cc2)cccc1-c1nn(C)c(=O)o1 CHEMBL4869725 IC50 14.0 nM
O=C(Nc1ccc(-c2cccc(C(F)(F)F)c2)s1)c1c(F)cccc1F CHEMBL3646778 IC50 16.5 nM
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12 CHEMBL233929 Kd 20.0 nM
CN(CCCCCC(=O)Nc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](c1ccccc1)n1cc(NC(=O)c2n[nH]c3c2CCC(C)(C)C3)cn1 CHEMBL5398436 EC50 25.3 nM
CCc1ccc(C2=NOC(C)(C)C2=O)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1 CHEMBL4868367 IC50 32.0 nM
Cc1ccc(C2=NOC(C)(C)C2=O)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1 CHEMBL4848840 IC50 34.0 nM
Cc1ccc(-c2nn(C)c(=O)o2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1 CHEMBL4861512 IC50 34.0 nM
CN(C(=O)C(F)(F)C1CCOCC1)c1ccc2[nH]c(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)nc2c1 CHEMBL5088468 IC50 34.0 nM
CC1(C)CCc2c(C(=O)Nc3cnn([C@@H](CCN4CCN(CCC5CCN(c6ccc7c(c6)C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CC4)c4ccccc4)c3)n[nH]c2C1 CHEMBL5404419 EC50 35.2 nM
COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3c2=O)cc1O CHEMBL3289608 Kd 35.6 nM
Cc1cc2[nH]c(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)nc2cc1N(C)C(=O)[C@H](C)N1CCOCC1 CHEMBL5084598 IC50 39.0 nM
Cc1c(N(C)C(=O)[C@H](C)N2CCOCC2)cc2nc(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)[nH]c2c1F CHEMBL5074957 IC50 47.0 nM
COc1ccc(C2=NOC(C)(C)C2=O)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1 CHEMBL4868517 IC50 50.0 nM
N=C(N)NC(C(=O)NCC(=O)N1CCC(c2cc(-c3cccc(Cl)c3Cl)n[nH]2)CC1)C1CCCCC1 CHEMBL3289611 Kd 54.9 nM
Cc1c(C2=NOC(C)(C)C2=O)cccc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1 CHEMBL4859192 IC50 55.0 nM
COC(=O)c1ccc(C)c(-c2ccc(C(=O)Nc3ccncc3C)s2)c1 CHEMBL3646777 IC50 58.5 nM
CC(C)C[C@@H](NC(=N)N)C(=O)NCC(=O)N1CCC(c2cc(-c3ccc(OCc4ccc(C(=O)O)o4)c(Cl)c3Cl)nn2C)CC1 CHEMBL429852 Ki 60.0 nM
Cc1ccc(-c2nn(C)c(=O)o2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1 CHEMBL4859714 IC50 64.0 nM
Cc1ccc(C2=NOC(C)(C)C2=O)cc1-c1cnc(NC(=O)c2c(F)cccc2Cl)cn1 CHEMBL4855379 IC50 64.8 nM
Cc1ccc(C2=NOC(C)(C)C2=O)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1 CHEMBL4854994 IC50 69.0 nM
CCn1nc(-c2ccc(C)c(-c3ccc(NC(=O)c4c(F)cccc4F)cc3)c2)oc1=O CHEMBL4872086 IC50 78.0 nM
Cn1c(Cc2nn(C)c(=O)c3ccccc23)nnc1SCCCCCCCC(=O)Nc1ccc(C(=O)c2ccccc2)cc1 CHEMBL4857666 IC50 80.0 nM
C[C@@H](C(=O)N(C)c1cc(O)c2[nH]c(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)nc2c1)N1CCOCC1 CHEMBL5079033 IC50 82.0 nM
COC(=O)c1cccc(-c2sc(NC(=O)c3c(F)cccc3F)cc2C)c1 CHEMBL3646781 IC50 87.0 nM
CCc1cc2[nH]c(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)nc2cc1N(C)C(=O)[C@H](C)N1CCOCC1 CHEMBL5082562 IC50 91.0 nM
Cc1ccc(C2=NOC(C)(C)C2=O)cc1-c1cnc(NC(=O)c2c(F)cncc2F)cn1 CHEMBL4868543 IC50 94.4 nM
Cc1ccc(-c2ncco2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)s1 CHEMBL3646780 IC50 94.8 nM
Cc1cc2[nH]c(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)nc2cc1N(C)C(=O)CN1CCOCC1=O CHEMBL5086824 IC50 96.0 nM
COC(=O)c1ccc(C)c(-c2ccc(NC(=O)c3c(F)cccc3F)s2)c1 CHEMBL3646779 IC50 103.6 nM
Cc1cc2[nH]c(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)nc2cc1N(C)C(=O)[C@@H](C)N1CCOCC1 CHEMBL5080834 IC50 113.0 nM
COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3c2=O)cc1 CHEMBL465980 Kd 120.0 nM
Cc1ccc(C2=NOC(C)(C)C2=O)cc1-c1cnc(C(=O)Nc2c(F)cccc2F)cn1 CHEMBL4848699 IC50 150.0 nM
O=C(Nc1ccc(-c2cccc(-c3cnco3)c2)s1)c1c(F)cccc1F CHEMBL3646782 IC50 164.4 nM
Cc1ccc(C2=NOC(C)(C)C2=O)cc1-c1cnc(NC(=O)c2ccccc2Cl)cn1 CHEMBL4862512 IC50 171.0 nM
Cc1ccc(C2=NOC(C)(C)C2=O)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1 CHEMBL4874097 IC50 178.0 nM
O=C(N[C@H](Cc1ccc(O)c(I)c1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4866037 Kd 210.0 nM
Cc1ccc(-c2n[nH]c(=O)o2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1 CHEMBL4872805 IC50 227.0 nM
COc1cc(C)c(Sc2cnc(NC(=O)c3ccc(CNC(C)C(C)(C)C)cc3)s2)cc1C(=O)N1CCN(C(C)=O)CC1 CHEMBL209148 EC50 237.6 nM
O=C(N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4877313 Kd 250.0 nM
O=C(N[C@@H](Cc1cccc(I)c1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4874500 Kd 250.0 nM
O=C(N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O)c1cc2ccc(F)cc2[nH]1 CHEMBL4845813 Kd 280.0 nM
O=C(N[C@@H](Cc1ccc(O)c(Br)c1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4855828 Kd 300.0 nM
C[C@H](C(=O)N(C)c1cc(F)c2[nH]c(-c3n[nH]c4c3C[C@@H]3C[C@]3(C)C4)nc2c1)N1CCOCC1=O CHEMBL5083169 IC50 304.0 nM
Cc1ccc(C2=NOC(C)(C)C2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1 CHEMBL4871844 IC50 328.0 nM
O=C(N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O)c1cc2cc(F)ccc2[nH]1 CHEMBL4866759 Kd 330.0 nM
N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccc(O)c(I)c1)NC(=O)c1cc2c(F)cccc2[nH]1)C(=O)O CHEMBL4851618 Kd 340.0 nM
Cn1c(Cc2nn(C)c(=O)c3ccccc23)nnc1SCCCCCCCC(=O)Nc1ccc(Cl)cc1Cl CHEMBL4103753 IC50 350.0 nM
O=C(N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O)c1cc2cccc(F)c2[nH]1 CHEMBL4870031 Kd 390.0 nM
O=C(N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O)c1cc2ccccc2[nH]1 CHEMBL4869829 Kd 420.0 nM
Cn1nc(Cc2nnc(SCCCCCCCC(=O)Nc3ccc(Cl)cc3Cl)[nH]2)c2ccccc2c1=O CHEMBL4846844 IC50 450.0 nM
O=C(N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O)c1c[nH]c2cccc(F)c12 CHEMBL4870525 Kd 510.0 nM
O=C(N[C@@H](Cc1ccc(O)c(Cl)c1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4873867 Kd 590.0 nM
O=C(N[C@@H](Cc1ccc(I)cc1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4852232 Kd 640.0 nM
N=C(N)NCCC[C@@H](NC(=O)[C@@H](Cc1ccc(O)c(I)c1)NC(=O)c1cc2c(F)cccc2[nH]1)C(=O)O CHEMBL4871406 Kd 710.0 nM
O=C(N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4856339 Kd 720.0 nM
O=C(N[C@@H](Cc1ccc2ccccc2c1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4875916 Kd 750.0 nM
Cc1n[nH]c(C)c1CCCOc1cc(OCCCc2cn(CCOCCOCCOCCOCCNC(=O)C3CCC(CN4C(=O)C=CC4=O)CC3)nn2)cc(C(=O)O)c1 CHEMBL5081901 Kd 851.0 nM
N=C(N)NCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)c(I)c1)NC(=O)c1cc2c(F)cccc2[nH]1)C(=O)O CHEMBL4846246 Kd 870.0 nM
O=C(N[C@@H](Cc1ccc(O)c(F)c1)C(=O)O)c1cc2c(F)cccc2[nH]1 CHEMBL4872601 Kd 920.0 nM
Cn1nc(Cc2nnc(SCCCCCCCC(=O)Nc3ccc(Cl)cc3Cl)n2CCC=O)c2ccccc2c1=O CHEMBL4851186 IC50 960.0 nM