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P51449 | RORG_HUMAN | Nuclear receptor ROR-gamma (RORC)

3D structures mapped by conservation among orthologs

[ Domain: "Nuclear receptor ligand-binding domain" // Hormone_recep_1 ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4127127 OBDepict NH 2 O H 3 C H 3 C NH O N S S HN O O CH 3 CH 3 CH 3 IC50 = 0.37 nM 584.81 CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)NCC(C)(C)C(N)=O)nc2CC2CCCCC2)c2ccccc12 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4125757 OBDepict O N H N S O S HN O O CH 3 CH 3 CH 3 IC50 = 0.69 nM 569.79 CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)NC3CCOCC3)nc2CC2CCCCC2)c2ccccc12 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4128575 OBDepict CH 3 HN CH 3 CH 3 S O O S N HN O H H O HO IC50 = 0.71 nM 597.8 CCC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4128926 OBDepict OH O H H N H O N S S HN O O CH 3 CH 3 CH 3 IC50 = 0.94 nM 583.78 CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4439154 OBDepict Cl N O N N F H HO H O OH IC50 = 1.0 nM 457.89 O=C(O)[C@@H]1CCN(c2nn(C(=O)c3c(Cl)cccc3C3CC3)c3cccc(F)c23)C[C@H]1O Homo sapiens CHEMBL4338899 assay format
CHEMBL3314026 OBDepict H 3 C CH 3 HN N CH 3 O CH 3 O HO H 3 C N CH 3 O IC50 = 1.0 nM 489.62 Cc1cnc(C(CCC(C)C)NC(=O)Cc2ccc3oc(C(O)c4c(C)noc4C)cc3c2)c(C)c1 Homo sapiens CHEMBL3369181 cell-based format
CHEMBL3314028 OBDepict CH 3 N H O N O OH CH 3 O H 3 C N IC50 = 1.0 nM 497.6 Cc1ccc(C(NC(=O)Cc2ccc(N(CC(=O)O)Cc3c(C)noc3C)cc2)c2ccccc2)cc1 Homo sapiens CHEMBL3369181 cell-based format
CHEMBL3314027 OBDepict H 2 N N O N N H O H H 3 C CH 3 IC50 = 1.0 nM 530.67 Cc1ccc([C@@H](NC(=O)Cc2ccc3oc(C(c4ccncc4)N4CC(N)C4)cc3c2)c2ccccc2)c(C)c1 Homo sapiens CHEMBL3369181 cell-based format
CHEMBL4578385 OBDepict OH O N F O Cl Cl IC50 = 1.0 nM 428.25 O=C(O)c1ccc(-n2cc(C(=O)c3c(Cl)cccc3Cl)c3cccc(F)c32)cc1 Homo sapiens CHEMBL4349912 single protein format
CHEMBL3314025 OBDepict Cl HN CH 3 O Cl O CH 3 O H 3 C N IC50 = 1.0 nM 509.43 Cc1cc(Cl)ccc1C(NC(=O)Cc1ccc(OCc2c(C)noc2C)cc1)c1ccc(Cl)cc1 Homo sapiens CHEMBL3369181 cell-based format
CHEMBL3314023 OBDepict O HN CH 3 O H 3 C OH H 3 C N IC50 = 1.0 nM 480.61 Cc1ccc(C(NC(=O)Cc2ccc(OCC(O)c3cccnc3C)cc2)c2ccccc2)c(C)c1 Homo sapiens CHEMBL3369181 cell-based format
CHEMBL3314002 OBDepict CH 3 HN CH 3 CH 3 S O O CH 3 Cl S N HN O H H O HO IC50 = 1.1 nM 596.22 CCC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c(Cl)c1C Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4570491 OBDepict F N O HO O Cl Cl IC50 = 1.1 nM 428.25 O=C(O)c1ccc(-n2cc(C(=O)c3c(Cl)cccc3Cl)c3ccccc32)c(F)c1 Homo sapiens CHEMBL4349912 single protein format
CHEMBL4128042 OBDepict O N H S N H H O HO N H O H 3 C CH 3 H F F F IC50 = 1.2 nM 591.7 C[C@H](NC(=O)c1cc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)cc(C2(C)CC2)c1)C(F)(F)F Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4128363 OBDepict O HN N S S O O S HN O O CH 3 CH 3 CH 3 IC50 = 1.4 nM 589.81 CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)NC3CS(=O)(=O)C3)nc2CC2CCCCC2)c2ccccc12 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4126366 OBDepict O NH N S H H O HO S HN O O CH 3 CH 3 CH 3 IC50 = 1.4 nM 587.81 CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2c1CCCC2 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4647899 OBDepict CH 3 HN H F F F S O O Cl Cl S N H 3 C H 3 C O HO IC50 = 1.6 nM 587.51 CC[C@H](NS(=O)(=O)c1ccc(-c2sc(CC(C)(C)C(=O)O)nc2CC2CCC2)c(Cl)c1Cl)C(F)(F)F Homo sapiens CHEMBL4623385 cell-based format
CHEMBL4454027 OBDepict Cl Cl O N O OH IC50 = 1.6 nM 410.26 O=C(O)c1ccc(-n2cc(C(=O)c3c(Cl)cccc3Cl)c3ccccc32)cc1 Homo sapiens CHEMBL4349912 single protein format
CHEMBL4099342 OBDepict H 3 C O N H N NH O O H F H H 3 C CH 3 O HO IC50 = 1.9 nM 509.58 COc1ccc2c(n1)CCN(C(=O)[C@H]1C[C@@H](CC(=O)O)C1)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL4061503 OBDepict H 3 C O H N NH O O O F N OH H 3 C H 3 C CH 3 IC50 = 1.9 nM 481.52 COc1ccc2c(c1)CCN(C(=O)Cc1cc(O)no1)[C@H]2C(=O)Nc1ccc(C(C)(C)C)c(F)c1 Homo sapiens CHEMBL4038090 assay format
CHEMBL4167096 OBDepict N N O S N H F F F O S O O CH 3 IC50 = 2.0 nM 509.53 CCS(=O)(=O)c1ccc(CC(=O)Nc2cc(-c3cc(C#N)cnc3OCC(F)(F)F)cs2)cc1 Homo sapiens CHEMBL4151884 single protein format
CHEMBL3105692 OBDepict CH 3 S O O N H O S O Cl Cl IC50 = 2.0 nM 558.51 CCS(=O)(=O)c1ccc(CC(=O)Nc2cc(-c3cccc(Cl)c3)c(C(=O)c3ccccc3Cl)s2)cc1 Homo sapiens CHEMBL4151884 single protein format
CHEMBL4446417 OBDepict Cl N O N F F F N F H OH H O HO IC50 = 2.0 nM 485.82 O=C(O)[C@@H]1CCN(c2nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c3cccc(F)c23)C[C@H]1O Homo sapiens CHEMBL4338899 assay format
CHEMBL4073449 OBDepict H 3 C O N H N NH O O H F H O HO H 3 C CH 3 IC50 = 2.0 nM 495.55 COc1ccc2c(n1)CCN(C(=O)[C@H]1C[C@@H](C(=O)O)C1)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL4567440 OBDepict OH O N F O Cl F F F IC50 = 2.0 nM 461.8 O=C(O)c1ccc(-n2cc(C(=O)c3c(Cl)cccc3C(F)(F)F)c3cccc(F)c32)cc1 Homo sapiens CHEMBL4349912 single protein format
CHEMBL3598140 OBDepict OH O N N O Cl F F F IC50 = 2.0 nM 444.8 O=C(O)c1ccc(-c2nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c3ccccc23)cc1 Homo sapiens CHEMBL4338899 assay format
CHEMBL4226373 OBDepict N Cl N H O CH 3 N H O N O N CH 3 O IC50 = 2.5 nM 522.01 CCn1c(=O)n(CC2CC2)c(=O)c2cc(NC(=O)CC(C)CC(=O)Nc3ccc(C#N)c(Cl)c3)ccc21 Homo sapiens CHEMBL4220523 single protein format
CHEMBL4062088 OBDepict H 3 C O CH 3 H 3 C F F N H O H N O O CH 3 O HO IC50 = 2.5 nM 518.56 COCC(C)(C)c1c(F)cc(NC(=O)[C@H]2c3ccc(OC)cc3CCN2C(=O)CCCC(=O)O)cc1F Homo sapiens CHEMBL4038090 assay format
CHEMBL3358455 OBDepict CH 3 O N Cl HO N S F F F N H 3 C N H 3 C N CH 3 IC50 = 2.5 nM 574.03 COc1nc2ccc(C(O)(c3sc(C)nc3C)c3cnnn3C)cc2c(Cl)c1Cc1ccc(C(F)(F)F)cc1 Homo sapiens CHEMBL3362088 cell-based format
CHEMBL4127698 OBDepict O N H S N OH CH 3 CH 3 F F Cl S NH O O H 3 C H 3 C CH 3 IC50 = 2.6 nM 592.17 CC(C)(O)CNC(=O)c1nc(CC2CCCCC2)c(-c2ccc(S(=O)(=O)NC(C)(C)C)c(Cl)c2C(F)F)s1 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4129202 OBDepict O N H N S OH CH 3 CH 3 S NH O O H 3 C H 3 C CH 3 IC50 = 2.6 nM 557.78 CC(C)(O)CNC(=O)c1nc(CC2CCCCC2)c(-c2ccc(S(=O)(=O)NC(C)(C)C)c3ccccc23)s1 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL4081322 OBDepict H 3 C O N H N NH O O H F H O HO H 3 C CH 3 IC50 = 2.6 nM 495.55 COc1ccc2c(n1)CCN(C(=O)[C@H]1C[C@H](C(=O)O)C1)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL4074514 OBDepict H 3 C O N H N NH O O H F H H 3 C H 3 C O HO IC50 = 3.0 nM 509.58 COc1ccc2c(n1)CCN(C(=O)C[C@H]1C[C@H](C(=O)O)C1)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL3109228 OBDepict H 3 C S O O HN O N IC50 = 3.0 nM 446.57 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3ccccc3)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL3598047 OBDepict H 3 C N H O N N H 3 C CH 3 N N D D D O F Cl IC50 = 3.0 nM 513.03 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(C)=O)nn2C(C)C)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL3596639 OBDepict NH 2 O Cl N N CH 3 O F Cl IC50 = 3.0 nM 500.4 CN(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(C(N)=O)ccc2Cl)cc1N1CCCCC1 Homo sapiens CHEMBL3598804 single protein format
CHEMBL3596638 OBDepict CH 3 N H 3 C N CH 3 O Cl F Cl O NH 2 IC50 = 3.0 nM 488.39 CCN(CC)c1cc(-c2cc(C(N)=O)ccc2Cl)ccc1N(C)C(=O)c1c(F)cccc1Cl Homo sapiens CHEMBL3598804 single protein format
CHEMBL4584679 OBDepict OH O N N F O Cl F F F IC50 = 3.0 nM 462.79 O=C(O)c1ccc(-c2nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c3cccc(F)c23)cc1 Homo sapiens CHEMBL4338899 assay format
CHEMBL3314007 OBDepict OH O HO N N F O Cl F F F IC50 = 3.0 nM 478.79 O=C(O)c1ccc(-c2nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c3cccc(F)c23)cc1O Homo sapiens CHEMBL4338899 assay format
CHEMBL4449356 OBDepict OH O F N N F O Cl F F F IC50 = 3.0 nM 480.78 O=C(O)c1ccc(-c2nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c3cccc(F)c23)c(F)c1 Homo sapiens CHEMBL4338899 assay format
CHEMBL4087736 OBDepict H 3 C O H N N H O O F F Si O OH CH 3 H 3 C CH 3 IC50 = 3.0 nM 504.61 COc1ccc2c(c1)CCN(C(=O)CCCC(=O)O)[C@H]2C(=O)Nc1cc(F)c([Si](C)(C)C)c(F)c1 Homo sapiens CHEMBL4038090 assay format
CHEMBL4171857 OBDepict CH 3 S O O NH O N Cl O IC50 = 3.1 nM 444.94 CCS(=O)(=O)c1ccc(CC(=O)Nc2cnc(OCc3ccccc3)c(Cl)c2)cc1 Homo sapiens CHEMBL4137934 single protein format
CHEMBL4070717 OBDepict H 3 C O N H N NH O O H F H H 3 C CH 3 O HO IC50 = 3.1 nM 509.58 COc1ccc2c(n1)CCN(C(=O)[C@H]1C[C@H](CC(=O)O)C1)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL4083828 OBDepict H 3 C O N H N N H O O F F Si O OH CH 3 H 3 C CH 3 IC50 = 3.2 nM 505.59 COc1ccc2c(n1)CCN(C(=O)CCCC(=O)O)[C@H]2C(=O)Nc1cc(F)c([Si](C)(C)C)c(F)c1 Homo sapiens CHEMBL4038090 assay format
CHEMBL4100286 OBDepict CH 3 O N H N NH O O F O HO H 3 C H 3 C IC50 = 3.2 nM 483.54 COc1ccc2c(n1)CCN(C(=O)CCCC(=O)O)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL3598077 OBDepict H 3 C N H O S N H 3 C CH 3 N N N CH 3 O F Cl IC50 = 3.2 nM 530.07 CC(=O)Nc1nc(C(C)C)c(-c2cnc(N(C)C(=O)c3c(F)cccc3Cl)c(N3CCCCC3)c2)s1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4091605 OBDepict H 3 C O N H N NH O O H F H H 3 C H 3 C O HO IC50 = 3.3 nM 509.58 COc1ccc2c(n1)CCN(C(=O)C[C@H]1C[C@@H](C(=O)O)C1)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL3598061 OBDepict HO N H O N N H 3 C CH 3 N N D D D O F Cl IC50 = 3.3 nM 529.03 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(=O)CO)nn2C(C)C)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4290728 OBDepict N NH O CH 3 N H 3 C N O IC50 = 3.3 nM 468.6 Cc1c(NC(=O)c2cccc(C#N)c2)ccc2c1c(C1CCN(C(=O)C3CCCC3)CC1)cn2C Homo sapiens CHEMBL4266710 cell-based format
CHEMBL4129634 OBDepict OH O H H N H O N S S HN O O CH 3 H F F F IC50 = 3.4 nM 595.67 C[C@H](NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCC2)c2ccccc12)C(F)(F)F Homo sapiens CHEMBL4121349 cell-based format
CHEMBL3598052 OBDepict H 3 C N H O N N H 3 C CH 3 N N D D D O Cl Cl IC50 = 3.4 nM 529.49 [2H]C([2H])([2H])N(C(=O)c1c(Cl)cccc1Cl)c1ccc(-c2cc(NC(C)=O)nn2C(C)C)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4226313 OBDepict N Cl N H O CH 3 N H O N O N CH 3 O CH 3 IC50 = 3.6 nM 495.97 CCn1c(=O)c2cc(NC(=O)CC(C)CC(=O)Nc3ccc(C#N)c(Cl)c3)ccc2n(CC)c1=O Homo sapiens CHEMBL4220523 single protein format
CHEMBL4540580 OBDepict Cl Cl O N N O OH IC50 = 3.8 nM 411.24 O=C(O)c1ccc(-n2nc(C(=O)c3c(Cl)cccc3Cl)c3ccccc32)cc1 Homo sapiens CHEMBL4349912 single protein format
CHEMBL3598049 OBDepict CH 3 N H O N N CH 3 H 3 C N N D D D O F Cl IC50 = 3.8 nM 515.05 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(C)=O)nn2C(C)C)cc1N1CCCCC1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4225541 OBDepict N Cl N H O CH 3 N H O N O N O CH 3 IC50 = 3.9 nM 522.01 CCn1c(=O)c2cc(NC(=O)CC(C)CC(=O)Nc3ccc(C#N)c(Cl)c3)ccc2n(CC2CC2)c1=O Homo sapiens CHEMBL4220523 single protein format
CHEMBL3905654 OBDepict CH 3 O N Cl HO N F F F N H 3 C N H 3 C N H 3 C IC50 = 3.9 nM 568.0 COc1nc2ccc(C(O)(c3ccc(C)nc3C)c3cnnn3C)cc2c(Cl)c1Cc1ccc(C(F)(F)F)cc1 Homo sapiens CHEMBL4341725 cell-based format
CHEMBL4093539 OBDepict H 3 C O H N N H O O F F O OH H 3 C CH 3 H 3 C IC50 = 4.0 nM 488.53 COc1ccc2c(c1)CCN(C(=O)CCCC(=O)O)[C@H]2C(=O)Nc1cc(F)c(C(C)(C)C)c(F)c1 Homo sapiens CHEMBL4038090 assay format
CHEMBL3632716 OBDepict OH F F O N S H CH 3 O O H IC50 = 4.0 nM 465.56 C[C@H]1CC[C@H](c2ccccc2)S(=O)(=O)N1Cc1cc(F)c(C(CO)CC2COC2)cc1F Homo sapiens CHEMBL3636893 assay format
CHEMBL3109230 OBDepict H 3 C S O O HN O N Cl IC50 = 4.0 nM 481.02 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3ccc(Cl)cc3)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL4547016 OBDepict OH O N N F O Cl F F F IC50 = 4.0 nM 466.82 O=C(O)C1CC=C(c2nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c3cccc(F)c23)CC1 Homo sapiens CHEMBL4338899 assay format
CHEMBL3956592 OBDepict CH 3 H 3 C N S O O O H H N H S O O H 3 C IC50 = 4.0 nM 520.72 CC(C)CN(Cc1ccc(O[C@@H]2C[C@@H]3CC[C@H](C2)N3S(C)(=O)=O)cc1)S(=O)(=O)Cc1ccccc1 Homo sapiens CHEMBL3887749 single protein format
CHEMBL3109234 OBDepict H 3 C S O O HN O N F F F IC50 = 4.0 nM 514.57 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3cccc(C(F)(F)F)c3)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL4455132 OBDepict OH O F N F O Cl Cl IC50 = 4.0 nM 446.24 O=C(O)c1ccc(-n2cc(C(=O)c3c(Cl)cccc3Cl)c3cccc(F)c32)c(F)c1 Homo sapiens CHEMBL4349912 single protein format
CHEMBL4278903 OBDepict N HN O N F F F N CH 3 N O CH 3 H 3 C IC50 = 4.1 nM 497.52 CC(C)C(=O)N1CCC(c2cn(C)c3ncc(NC(=O)c4cccc(C#N)c4)c(C(F)(F)F)c23)CC1 Homo sapiens CHEMBL4266702 cell-based format
CHEMBL4647734 OBDepict OH O H 3 C H 3 C N S Cl Cl S HN O O CH 3 H F F F IC50 = 4.3 nM 573.49 C[C@H](NS(=O)(=O)c1ccc(-c2sc(CC(C)(C)C(=O)O)nc2CC2CCC2)c(Cl)c1Cl)C(F)(F)F Homo sapiens CHEMBL4623385 cell-based format
CHEMBL4286190 OBDepict CH 3 S O O N H O CH 3 H 3 C HN O F IC50 = 4.4 nM 482.58 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc(C(C)(C)C(=O)Nc3ccccc3F)cc2)cc1 Homo sapiens CHEMBL4264789 cell-based format
CHEMBL4094983 OBDepict H 3 C O N H N NH O N O F H 3 C CH 3 O OH IC50 = 4.4 nM 510.57 COc1ccc2c(n1)CCN(C(=O)N1CC(CC(=O)O)C1)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL4128262 OBDepict N NH S O O S N NH O OH CH 3 H 3 C IC50 = 4.4 nM 566.75 CC(C)(O)CNC(=O)c1nc(CC2CCCCC2)c(-c2ccc(S(=O)(=O)NC3(C#N)CC3)c3ccccc23)s1 Homo sapiens CHEMBL4121349 cell-based format
CHEMBL3598053 OBDepict H 3 C N H O N N H 3 C CH 3 N N D D D O CH 3 F IC50 = 4.8 nM 492.61 [2H]C([2H])([2H])N(C(=O)c1c(C)cccc1F)c1ccc(-c2cc(NC(C)=O)nn2C(C)C)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4072831 OBDepict CH 3 O H N NH O O F O HO H 3 C H 3 C IC50 = 4.8 nM 482.55 COc1ccc2c(c1)CCN(C(=O)CCCC(=O)O)[C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C Homo sapiens CHEMBL4038090 assay format
CHEMBL4228907 OBDepict N Cl N H O CH 3 N H O N O N O IC50 = 4.9 nM 548.04 CC(CC(=O)Nc1ccc(C#N)c(Cl)c1)CC(=O)Nc1ccc2c(c1)c(=O)n(CC1CC1)c(=O)n2CC1CC1 Homo sapiens CHEMBL4220523 single protein format
CHEMBL3598051 OBDepict CH 3 HN O N N H 3 C CH 3 N N CH 3 O F Cl IC50 = 4.9 nM 510.01 CC(=O)Nc1cc(-c2ccc(N(C)C(=O)c3c(F)cccc3Cl)c(N3CC4CC4C3)c2)n(C(C)C)n1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL3598056 OBDepict H 3 C N H O N N H 3 C CH 3 N N D D D O F Cl IC50 = 4.9 nM 527.06 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(=O)CC)nn2C(C)C)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL3598055 OBDepict O N H N N H 3 C CH 3 N N D D D O F Cl IC50 = 4.9 nM 499.0 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC=O)nn2C(C)C)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4454020 OBDepict Cl Cl O N OH O HO IC50 = 5.0 nM 426.26 O=C(O)c1ccc(-n2cc(C(=O)c3c(Cl)cccc3Cl)c3ccccc32)cc1O Homo sapiens CHEMBL4349913 cell-based format
CHEMBL3109227 OBDepict H 3 C S O O HN O N F F F IC50 = 5.0 nM 514.57 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3ccc(C(F)(F)F)cc3)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL3634609 OBDepict F N N F S O O H H H H N N N IC50 = 5.0 nM 499.59 O=S1(=O)[C@H](c2ccccc2)CCCCN1Cc1cc(F)c(N2C[C@H]3[C@H](n4cnnc4)[C@H]3C2)cc1F Homo sapiens CHEMBL3636893 assay format
CHEMBL3598057 OBDepict O HN N N H 3 C CH 3 N N D D D O F Cl IC50 = 5.0 nM 539.07 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(=O)C3CC3)nn2C(C)C)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4441287 OBDepict CH 3 O N N Cl HO N F F F N H 3 C N H 3 C N CH 3 IC50 = 5.1 nM 575.04 COc1nc2ccc(C(O)(c3cc(C)nc(C)c3)c3cnnn3C)cc2c(Cl)c1CN1CCC(C(F)(F)F)CC1 Homo sapiens CHEMBL4341731 cell-based format
CHEMBL3598070 OBDepict CH 3 N H O N N N N D D D O F Cl IC50 = 5.1 nM 539.07 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(C)=O)nn2C2CCCC2)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL3598071 OBDepict CH 3 N H O N N N N D D D O F Cl IC50 = 5.2 nM 525.04 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(C)=O)nn2C2CCC2)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4205065 OBDepict Cl N Cl OH N N CH 3 N IC50 = 5.5 nM 511.41 Cn1cncc1C(O)(c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1)c1ccnc2ccccc12 Homo sapiens CHEMBL4180674 cell-based format
CHEMBL3558130 OBDepict OH O F N N N O Cl F F F IC50 = 6.0 nM 463.77 O=C(O)c1ccc(-c2nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c3cccnc23)c(F)c1 Homo sapiens CHEMBL4338899 assay format
CHEMBL3894302 OBDepict H 3 C CH 3 N S O O N H N S O O CH 3 IC50 = 6.0 nM 493.7 CC(C)CN(Cc1ccc(NC2CCN(S(C)(=O)=O)CC2)cc1)S(=O)(=O)Cc1ccccc1 Homo sapiens CHEMBL3887749 single protein format
CHEMBL3109231 OBDepict N N N H O S O O CH 3 IC50 = 6.0 nM 471.58 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3ccc(C#N)cc3)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL3109232 OBDepict H 3 C S O O HN O N O H 3 C CH 3 IC50 = 6.0 nM 504.65 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3ccc(OC(C)C)cc3)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL3581543 OBDepict Cl Cl S N O O F N N O CH 3 IC50 = 6.0 nM 514.45 CC(=O)N1CCN(c2ccc(CN(C3CCC3)S(=O)(=O)c3cc(Cl)cc(Cl)c3)c(F)c2)CC1 Homo sapiens CHEMBL3582669 assay format
CHEMBL3109324 OBDepict H 3 C S O O HN O N Cl Cl IC50 = 6.0 nM 515.46 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3ccc(Cl)c(Cl)c3)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL3314036 OBDepict H 3 C CH 3 N S O O O N S O O CH 3 IC50 = 6.0 nM 494.68 CC(C)CN(Cc1ccc(OC2CCN(S(C)(=O)=O)CC2)cc1)S(=O)(=O)Cc1ccccc1 Homo sapiens CHEMBL3370843 single protein format
CHEMBL3109329 OBDepict CH 3 N N H F F F O S O O H 3 C IC50 = 6.0 nM 532.63 CCCN(Cc1ccc(NC(=O)Cc2ccc(S(=O)(=O)CC)cc2)cc1)Cc1ccc(C(F)(F)F)cc1 Homo sapiens CHEMBL3110541 assay format
CHEMBL4446140 OBDepict H 3 C O N N H O H N O N O CH 3 O OH IC50 = 6.0 nM 572.66 CCOc1ccccc1CN1CCc2cc(NC(=O)[C@H]3c4ccc(OC)nc4CCN3C(=O)CCCC(=O)O)ccc21 Homo sapiens CHEMBL4370422 single protein format
CHEMBL3109233 OBDepict CH 3 S O O N H O N F F F IC50 = 6.0 nM 514.57 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3ccccc3C(F)(F)F)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL3109235 OBDepict CH 3 S O O N H O N Cl Cl IC50 = 6.0 nM 515.46 CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(ccn3CCc3ccc(Cl)cc3Cl)c2)cc1 Homo sapiens CHEMBL3110543 assay format
CHEMBL3598063 OBDepict H 3 C N H N H O N N H 3 C CH 3 N N D D D O F Cl IC50 = 6.0 nM 528.05 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(=O)NC)nn2C(C)C)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL4456513 OBDepict OH O F N N O N Cl F F F IC50 = 6.0 nM 463.77 O=C(O)c1ccc(-c2nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c3cnccc23)c(F)c1 Homo sapiens CHEMBL4338899 assay format
CHEMBL3361050 OBDepict H 3 C CH 3 N S O O N H N S O O H 3 C F F F IC50 = 6.0 nM 547.66 CC(C)CN(Cc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(NC2CCN(S(C)(=O)=O)CC2)cc1 Homo sapiens CHEMBL3375302 assay format
CHEMBL3361052 OBDepict H 3 C CH 3 N S O O O N S O O H 3 C F F F IC50 = 6.0 nM 548.65 CC(C)CN(Cc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(OC2CCN(S(C)(=O)=O)CC2)cc1 Homo sapiens CHEMBL3375302 assay format
CHEMBL4206093 OBDepict CH 3 O H N N H O O O N F F HO Si CH 3 CH 3 CH 3 IC50 = 6.1 nM 501.56 COc1ccc2c(c1)CCN(C(=O)c1cc(O)no1)[C@H]2C(=O)Nc1cc(F)c([Si](C)(C)C)c(F)c1 Homo sapiens CHEMBL4182989 cell-based format
CHEMBL3598076 OBDepict H 3 C HN O N N H 3 C CH 3 N N N CH 3 O F Cl IC50 = 6.2 nM 513.02 CC(=O)Nc1cc(-c2cnc(N(C)C(=O)c3c(F)cccc3Cl)c(N3CCCCC3)c2)n(C(C)C)n1 Homo sapiens CHEMBL3599133 single protein format
CHEMBL3598074 OBDepict CH 3 HN O N N N N D D D O F Cl IC50 = 6.4 nM 525.04 [2H]C([2H])([2H])N(C(=O)c1c(F)cccc1Cl)c1ccc(-c2cc(NC(C)=O)nn2CC2CC2)cc1N1CC2CC2C1 Homo sapiens CHEMBL3599133 single protein format