HOME LIGAND hPROTEOME OTHERS DOCUMENT

P23946 | CMA1_HUMAN | Chymase (CMA1)

3D structures mapped by conservation among orthologs



[ 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
CHEMBL3640120 OBDepict CH 3 N O N O O HO N N H 3 C CH 3 H 3 C IC50 = 0.3 nM 462.55 CCCCC(CC(=O)O)n1c(=O)c2ncccc2n(Cc2cn(C)c3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640116 OBDepict H 3 C N H O N O O OH N N CH 3 H 3 C CH 3 IC50 = 0.4 nM 434.5 CC[C@H](CC(=O)O)n1c(=O)c2ncccc2n(Cc2cn(C)c3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL1631751 OBDepict CH 3 N N O H N H N H O O H 3 C H IC50 = 0.46 nM 498.63 C[C@@H](NC(=O)N1C(=O)[C@@H](Cc2ccccc2)[C@H]1Oc1ccc(N2CCN(C)CC2)cc1)c1ccccc1 Homo sapiens CHEMBL1639355 single protein format
CHEMBL3640118 OBDepict H 3 C N H O N O O OH N N CH 3 H 3 C CH 3 IC50 = 0.7 nM 434.5 CC[C@H](CC(=O)O)n1c(=O)c2cnccc2n(Cc2cn(C)c3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640115 OBDepict HO O N O N O N N H 3 C CH 3 H 3 C IC50 = 0.7 nM 446.51 Cc1cc(C)c2c(Cn3c(=O)n(C(CC(=O)O)C4CC4)c(=O)c4ncccc43)cn(C)c2c1 Homo sapiens CHEMBL3705301 single protein format
CHEMBL44950 OBDepict O N N O O O O O IC50 = 0.85 nM 354.32 O=C1N(Cc2ccc3c(c2)OCO3)C(=O)N1Cc1ccc2c(c1)OCO2 Homo sapiens CHEMBL883537 single protein format
CHEMBL3640105 OBDepict CH 3 N H O HO O N O N N H 3 C CH 3 IC50 = 0.9 nM 434.5 CCCC[C@H](C(=O)O)n1c(=O)c2cnccc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640121 OBDepict CH 3 N O N O O HO N N H 3 C CH 3 IC50 = 1.3 nM 434.5 CCCC(CC(=O)O)n1c(=O)c2ncccc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640119 OBDepict CH 3 N O N O O HO N N H 3 C CH 3 IC50 = 1.4 nM 448.52 CCCCC(CC(=O)O)n1c(=O)c2ncccc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640110 OBDepict CH 3 N H O N O O OH N N H 3 C CH 3 IC50 = 1.4 nM 420.47 CC[C@H](CC(=O)O)n1c(=O)c2ncccc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL48083 OBDepict H 3 C O N O N O O CH 3 IC50 = 2.0 nM 326.35 COc1ccc(CN2C(=O)N(Cc3ccc(OC)cc3)C2=O)cc1 Homo sapiens CHEMBL883537 single protein format
CHEMBL3640102 OBDepict CH 3 N H O HO O N O N N H 3 C CH 3 IC50 = 2.1 nM 420.47 CCC[C@@H](C(=O)O)n1c(=O)c2cnccc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640111 OBDepict H 3 C N H O N O O OH N N S H 3 C CH 3 IC50 = 2.2 nM 438.51 CC[C@H](CC(=O)O)n1c(=O)c2ncccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL424224 OBDepict O P O OH OH Ki = 2.3 nM 376.35 O=C(c1ccc2ccccc2c1)C(c1cccc2ccccc12)P(=O)(O)O Homo sapiens CHEMBL4327270 cell-based format
CHEMBL45780 OBDepict H 3 C O N O N O O H 3 C IC50 = 2.3 nM 326.35 COc1cccc(CN2C(=O)N(Cc3cccc(OC)c3)C2=O)c1 Homo sapiens CHEMBL883537 single protein format
CHEMBL3639389 OBDepict CH 3 N H O N O O OH N N H 3 C CH 3 IC50 = 2.5 nM 420.47 CC[C@H](CC(=O)O)n1c(=O)c2cnccc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640114 OBDepict H 3 C N H O OH O N O N N S H 3 C CH 3 IC50 = 2.6 nM 424.48 CC[C@H](C(=O)O)n1c(=O)c2cnccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640100 OBDepict CH 3 N H O HO O N O N N S CH 3 H 3 C IC50 = 2.6 nM 452.54 CCCC[C@H](C(=O)O)n1c(=O)c2cnccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL24734 OBDepict Cl N N O NH 2 HN O O F F N H O Ki = 2.62 nM 594.02 Nc1cnc(-c2cccc(Cl)c2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O Homo sapiens CHEMBL807472 single protein format
CHEMBL3640117 OBDepict H 3 C N H O OH O N O N N S H 3 C CH 3 IC50 = 2.7 nM 424.48 CC[C@@H](C(=O)O)n1c(=O)c2ncccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640107 OBDepict CH 3 N H O N O O OH N N H 3 C CH 3 IC50 = 3.0 nM 420.47 CC[C@@H](CC(=O)O)n1c(=O)c2ncccc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL1631756 OBDepict CH 3 O H O N H O N H O O OH IC50 = 3.1 nM 550.61 CCOc1ccccc1C[C@@H]1C(=O)N(C(=O)NC(c2ccccc2)c2ccccc2)[C@@H]1Oc1ccc(C(=O)O)cc1 Homo sapiens CHEMBL1639355 single protein format
CHEMBL3640095 OBDepict O N N O H O HO N N CH 3 H 3 C IC50 = 3.1 nM 454.49 Cc1cccc2c1c(Cn1c(=O)n([C@H](C(=O)O)c3ccccc3)c(=O)c3cnccc31)cn2C Homo sapiens CHEMBL3705301 single protein format
CHEMBL373916 OBDepict Cl N H O P O OH CH 3 S Cl IC50 = 3.5 nM 440.29 CP(=O)(O)C(C(=O)N/C=C/c1cccc(Cl)c1)c1csc2ccc(Cl)cc12 Homo sapiens CHEMBL915852 single protein format
CHEMBL47394 OBDepict O N N O IC50 = 4.0 nM 266.3 O=C1N(Cc2ccccc2)C(=O)N1Cc1ccccc1 Homo sapiens CHEMBL883537 single protein format
CHEMBL3640103 OBDepict CH 3 N H O HO O N O N N S CH 3 H 3 C IC50 = 4.0 nM 438.51 CCC[C@H](C(=O)O)n1c(=O)c2cnccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640104 OBDepict CH 3 N H O HO O N O N N S CH 3 H 3 C IC50 = 4.8 nM 438.51 CCC[C@@H](C(=O)O)n1c(=O)c2cnccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL402185 OBDepict CH 3 O N N O NH 2 N H O H O O N O O H 3 C Ki = 4.8 nM 581.59 COC(=O)c1ccc2oc(C(=O)[C@H](Cc3ccccc3)NC(=O)Cn3c(-c4cccc(OC)c4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL948942 single protein format
CHEMBL26285 OBDepict H 3 C O N N O NH 2 N H O O O N O O CH 3 Ki = 4.85 nM 581.59 COC(=O)c1ccc2oc(C(=O)C(Cc3ccccc3)NC(=O)Cn3c(-c4cccc(OC)c4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL872602 single protein format
CHEMBL335675 OBDepict CH 3 HN H 3 C H 3 C O O O H 3 C H 3 C N H O CH 3 O IC50 = 5.0 nM 536.71 CCCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCC)NC(=O)c1ccccc1 Homo sapiens CHEMBL844230 single protein format
CHEMBL26297 OBDepict CH 3 O O N O O NH O N N O NH 2 Ki = 5.57 nM 551.56 COC(=O)c1ccc2oc(C(=O)C(Cc3ccccc3)NC(=O)Cn3c(-c4ccccc4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL872602 single protein format
CHEMBL436591 OBDepict H 3 C HN O CH 3 CH 3 O O O H 3 C CH 3 HN O CH 3 IC50 = 5.6 nM 564.77 CCCC(=O)NC(CCc1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCc1ccccc1)NC(=O)CCC Homo sapiens CHEMBL844230 single protein format
CHEMBL256270 OBDepict CH 3 O O N O O N H H O N N O NH 2 Ki = 5.6 nM 551.56 COC(=O)c1ccc2oc(C(=O)[C@H](Cc3ccccc3)NC(=O)Cn3c(-c4ccccc4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL948942 single protein format
CHEMBL26127 OBDepict CH 3 O O N O O N H O N N O H 2 N NH 2 Ki = 5.6 nM 566.57 COC(=O)c1ccc2oc(C(=O)C(Cc3ccccc3)NC(=O)Cn3c(-c4cccc(N)c4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL872602 single protein format
CHEMBL3640094 OBDepict OH O N O N O N N CH 3 H 3 C IC50 = 6.1 nM 378.39 Cc1cccc2c1c(Cn1c(=O)n(CC(=O)O)c(=O)c3ncccc31)cn2C Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640106 OBDepict CH 3 N H O N O O OH N N H 3 C CH 3 IC50 = 6.1 nM 420.47 CC[C@H](CC(=O)O)n1c(=O)c2ccncc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640101 OBDepict CH 3 N H O HO O N O N N S CH 3 H 3 C IC50 = 7.0 nM 452.54 CCCC[C@@H](C(=O)O)n1c(=O)c2cnccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3691804 OBDepict OH O N N O N CH 3 H 3 C IC50 = 7.0 nM 437.5 Cc1cccc2c1c(Cc1nn(C(C(=O)O)c3ccccc3)c(=O)c3ccccc13)cn2C Homo sapiens CHEMBL3705371 single protein format
CHEMBL3640099 OBDepict H 3 C N H O OH O N O N N S H 3 C CH 3 IC50 = 7.0 nM 424.48 CC[C@@H](C(=O)O)n1c(=O)c2cnccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3657206 OBDepict H 3 C N H H N O H 2 N O O OH N N O O O Cl CH 3 IC50 = 7.0 nM 572.02 CCC[C@@H](NC(=O)N1CC2=NOCC(=O)N2CC(Cc2cc(Cl)ccc2OC)C1=O)c1ccc(C(=O)O)c(N)c1 Homo sapiens CHEMBL3705415 single protein format
CHEMBL3640113 OBDepict CH 3 N H O N O O OH N N H 3 C CH 3 IC50 = 7.4 nM 420.47 CC[C@@H](CC(=O)O)n1c(=O)c2ccncc2n(Cc2cn(C)c3cccc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL25199 OBDepict H 3 C HN O N H O F F O NH O N N O H 2 N CH 3 Ki = 7.71 nM 568.58 CCNC(=O)CNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(-c2cccc(C)c2)ncc(N)c1=O Homo sapiens CHEMBL807472 single protein format
CHEMBL3640097 OBDepict H 3 C N H O N O O OH N N S H 3 C CH 3 IC50 = 8.0 nM 438.51 CC[C@@H](CC(=O)O)n1c(=O)c2ncccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL4206099 OBDepict H 3 C O Cl H N H O N N NH O O H CH 3 NH 2 O OH IC50 = 8.9 nM 594.07 CC[C@@H](NC(=O)N1C/C(=N/Oc2ccccc2)NC[C@@H](Cc2cc(Cl)ccc2OC)C1=O)c1ccc(C(=O)O)c(N)c1 Homo sapiens CHEMBL4182330 single protein format
CHEMBL3657204 OBDepict H 3 C O Cl N H O N N N H O O H H 3 C H 2 N O OH IC50 = 9.0 nM 594.07 CC[C@@H](NC(=O)N1C/C(=N/Oc2ccccc2)NCC(Cc2cc(Cl)ccc2OC)C1=O)c1ccc(C(=O)O)c(N)c1 Homo sapiens CHEMBL3705415 single protein format
CHEMBL3691803 OBDepict H 3 C N N O HO O N CH 3 H 3 C IC50 = 9.0 nM 403.48 CCCC(C(=O)O)n1nc(Cc2cn(C)c3cccc(C)c23)c2ccccc2c1=O Homo sapiens CHEMBL3705371 single protein format
CHEMBL25884 OBDepict CH 3 N O CH 3 N H O F F O HN O N N O NH 2 H 3 C Ki = 9.32 nM 596.64 CCN(CC)C(=O)CNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(-c2cccc(C)c2)ncc(N)c1=O Homo sapiens CHEMBL807472 single protein format
CHEMBL3640093 OBDepict OH O N O N O N N CH 3 H 3 C IC50 = 9.6 nM 378.39 Cc1cccc2c1c(Cn1c(=O)n(CC(=O)O)c(=O)c3cnccc31)cn2C Homo sapiens CHEMBL3705301 single protein format
CHEMBL3640109 OBDepict H 3 C N H O N O O OH N N S H 3 C CH 3 IC50 = 9.9 nM 438.51 CC[C@H](CC(=O)O)n1c(=O)c2cnccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL374087 OBDepict Cl N CH 3 P O OH H 3 C N H O IC50 = 10.0 nM 426.84 Cn1cc(C(C(=O)Nc2ccc3ccccc3c2)P(C)(=O)O)c2cc(Cl)ccc21 Homo sapiens CHEMBL915852 single protein format
CHEMBL3653524 OBDepict CH 3 O Cl HN O N N HN O O H 3 C H N NH 2 O OH IC50 = 10.0 nM 581.03 COc1ccc(Cl)cc1CC1CN/C(=NOc2ccccn2)CN(C(=O)N[C@H](C)c2ccc(C(=O)O)c(N)c2)C1=O Homo sapiens CHEMBL3705415 single protein format
CHEMBL3653522 OBDepict H 3 C O Cl NH O N N NH O O CH 3 H H 2 N F O HO IC50 = 10.0 nM 598.03 COc1ccc(Cl)cc1CC1CN/C(=NOc2ccc(F)cc2)CN(C(=O)N[C@H](C)c2ccc(C(=O)O)c(N)c2)C1=O Homo sapiens CHEMBL3705415 single protein format
CHEMBL3657194 OBDepict H 3 C O Cl NH O N N N H O O CH 3 H F O HO IC50 = 10.0 nM 597.04 COc1ccc(Cl)cc1CC1CN/C(=NOc2ccc(F)cc2)CN(C(=O)N[C@H](C)c2ccc(CC(=O)O)cc2)C1=O Homo sapiens CHEMBL3705415 single protein format
CHEMBL26182 OBDepict H 3 C O O HN O F F O N H O N O N NH 2 H 3 C Ki = 10.2 nM 555.54 COC(=O)CNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(-c2cccc(C)c2)ncc(N)c1=O Homo sapiens CHEMBL807472 single protein format
CHEMBL374504 OBDepict F Cl N H O P O OH CH 3 S Cl Ki = 11.0 nM 458.28 CP(=O)(O)C(C(=O)N/C=C/c1cc(F)cc(Cl)c1)c1csc2ccc(Cl)cc12 Homo sapiens CHEMBL915852 single protein format
CHEMBL373898 OBDepict O N H P O OH HO S Cl F F IC50 = 11.0 nM 443.8 O=C(N/C=C/c1ccc(F)c(F)c1)C(c1csc2ccc(Cl)cc12)P(=O)(O)O Homo sapiens CHEMBL915852 single protein format
CHEMBL3640096 OBDepict CH 3 O HO N O O N N N H 3 C CH 3 IC50 = 11.0 nM 448.52 CCCCC(Cn1c(=O)c2cnccc2n(Cc2cn(C)c3cccc(C)c23)c1=O)C(=O)O Homo sapiens CHEMBL3705301 single protein format
CHEMBL25169 OBDepict O NH N N O O H 2 N F F N H O O NH 2 CH 3 Ki = 12.0 nM 540.53 Cc1cccc(-c2ncc(N)c(=O)n2CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCC(N)=O)c1 Homo sapiens CHEMBL807472 single protein format
CHEMBL424453 OBDepict H 3 C N H H 3 C H 3 C O O O CH 3 H 3 C NH O CH 3 O IC50 = 13.0 nM 564.77 CCCCCC(NC(=O)c1ccccc1)C(C)(C)C(=O)OC(=O)C(C)(C)C(CCCCC)NC(=O)c1ccccc1 Homo sapiens CHEMBL844230 single protein format
CHEMBL223530 OBDepict Cl N CH 3 P O OH HO N H O IC50 = 13.0 nM 428.81 Cn1cc(C(C(=O)Nc2ccc3ccccc3c2)P(=O)(O)O)c2cc(Cl)ccc21 Homo sapiens CHEMBL915852 single protein format
CHEMBL171676 OBDepict HO O NH O F F O HN O H N O N H H H 3 C CH 3 O O H 3 C H 3 C H 3 C Ki = 13.1 nM 596.63 CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccccc1)C(=O)C(F)(F)C(=O)NCC(=O)O Homo sapiens CHEMBL659791 single protein format
CHEMBL26494 OBDepict CH 3 N N O NH 2 N H O O F F O NH 2 Ki = 13.3 nM 483.48 Cc1cccc(-c2ncc(N)c(=O)n2CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(N)=O)c1 Homo sapiens CHEMBL807472 single protein format
CHEMBL283786 OBDepict CH 3 O N N O NH 2 HN O O F F HN O Ki = 13.8 nM 589.6 COc1cccc(-c2ncc(N)c(=O)n2CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1 Homo sapiens CHEMBL807472 single protein format
CHEMBL287133 OBDepict CH 3 O O N O O N H O N N O H 2 N F Ki = 14.3 nM 569.55 COC(=O)c1ccc2oc(C(=O)C(Cc3ccccc3)NC(=O)Cn3c(-c4cccc(F)c4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL872602 single protein format
CHEMBL284005 OBDepict F N N O NH 2 HN O O F F N H O Ki = 15.7 nM 577.56 Nc1cnc(-c2cccc(F)c2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O Homo sapiens CHEMBL807472 single protein format
CHEMBL373899 OBDepict O HN P O OH HO N H 3 C Cl F IC50 = 16.0 nM 422.78 Cn1cc(C(C(=O)N/C=C/c2ccc(F)cc2)P(=O)(O)O)c2cc(Cl)ccc21 Homo sapiens CHEMBL915852 single protein format
CHEMBL25833 OBDepict H 3 C N N O NH 2 HN O O F F NH O Ki = 16.9 nM 573.6 Cc1cccc(-c2ncc(N)c(=O)n2CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1 Homo sapiens CHEMBL807472 single protein format
CHEMBL442146 OBDepict O NH N N O O H 2 N F F N H O O OH CH 3 Ki = 16.9 nM 541.51 Cc1cccc(-c2ncc(N)c(=O)n2CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCC(=O)O)c1 Homo sapiens CHEMBL807472 single protein format
CHEMBL374504 OBDepict F Cl N H O P O OH CH 3 S Cl IC50 = 17.0 nM 458.28 CP(=O)(O)C(C(=O)N/C=C/c1cc(F)cc(Cl)c1)c1csc2ccc(Cl)cc12 Homo sapiens CHEMBL915852 single protein format
CHEMBL3640098 OBDepict H 3 C N H O N O O OH N N S H 3 C CH 3 IC50 = 17.0 nM 438.51 CC[C@@H](CC(=O)O)n1c(=O)c2cnccc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL304729 OBDepict Cl Cl S N O O O O N IC50 = 18.0 nM 385.23 O=C1CN(c2ccccc2)C(=O)N1S(=O)(=O)c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL885061 single protein format
CHEMBL245539 OBDepict Cl S N O O O N O H Cl IC50 = 18.0 nM 371.2 O=c1[nH]c2cc(Cl)ccc2c(=O)n1S(=O)(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL886130 single protein format
CHEMBL24697 OBDepict CH 3 N H O F F O HN O N N O NH 2 H 3 C Ki = 18.5 nM 553.61 CCCCCNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)Cn1c(-c2cccc(C)c2)ncc(N)c1=O Homo sapiens CHEMBL807472 single protein format
CHEMBL3651441 OBDepict H 3 C O Cl F N H O N S O O O Cl IC50 = 19.0 nM 475.33 COc1cc(Cl)c(F)cc1CC1CNC(=O)CN(S(=O)(=O)c2ccc(Cl)cc2)C1=O Homo sapiens CHEMBL3705318 single protein format
CHEMBL3651443 OBDepict CH 3 O O H N O N H S O O O Cl H O F CH 3 IC50 = 19.0 nM 512.94 COC(=O)C[C@@H]1C(=O)NC[C@H](Cc2cc(F)ccc2OC)C(=O)N1S(=O)(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL3705318 single protein format
CHEMBL3657196 OBDepict CH 3 O Cl HN O N N HN O O H 3 C H N O OH IC50 = 20.0 nM 580.04 COc1ccc(Cl)cc1CC1CN/C(=NOc2ccccn2)CN(C(=O)N[C@H](C)c2ccc(CC(=O)O)cc2)C1=O Homo sapiens CHEMBL3705415 single protein format
CHEMBL3657200 OBDepict H 3 C O Cl NH O N N N H O O H NH O H 3 C N N N H N IC50 = 20.0 nM 570.01 CC[C@@H](NC(=O)N1C/C(=N/Oc2ccccc2)NCC(Cc2cc(Cl)ccc2OC)C1=O)C(=O)Nc1nnn[nH]1 Homo sapiens CHEMBL3705415 single protein format
CHEMBL442366 OBDepict H 3 C CH 3 N O N O S O O Cl Cl IC50 = 20.0 nM 413.28 Cc1ccc(N2CC(=O)N(S(=O)(=O)c3ccc(Cl)c(Cl)c3)C2=O)cc1C Homo sapiens CHEMBL885061 single protein format
CHEMBL3653514 OBDepict CH 3 N H H N O NH 2 O O HO N H N O H 3 C O Cl CH 3 IC50 = 20.0 nM 560.05 CCC[C@@H](NC(=O)N1C/C(=N/OCC)NCC(Cc2cc(Cl)ccc2OC)C1=O)c1ccc(C(=O)O)c(N)c1 Homo sapiens CHEMBL3705415 single protein format
CHEMBL3640108 OBDepict H 3 C N H O N O O OH N N S H 3 C CH 3 IC50 = 20.0 nM 438.51 CC[C@H](CC(=O)O)n1c(=O)c2ccncc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL3653517 OBDepict CH 3 N H H N O NH 2 O O HO N H N O O OH Cl CH 3 IC50 = 20.0 nM 576.05 CCC[C@@H](NC(=O)N1C/C(=N/OCCO)NCC(Cc2cc(Cl)ccc2OC)C1=O)c1ccc(C(=O)O)c(N)c1 Homo sapiens CHEMBL3705415 single protein format
CHEMBL376054 OBDepict O HN P O OH H 3 C N H 3 C Cl F F IC50 = 21.0 nM 438.8 Cn1cc(C(C(=O)N/C=C/c2ccc(F)c(F)c2)P(C)(=O)O)c2cc(Cl)ccc21 Homo sapiens CHEMBL915852 single protein format
CHEMBL1807642 OBDepict HO O S N N S CH 3 IC50 = 22.0 nM 396.54 Cc1cccc2scc(Cn3c(SCCCC(=O)O)nc4ccccc43)c12 Homo sapiens CHEMBL1811418 single protein format
CHEMBL68915 OBDepict H 3 C O O H 3 C S N O O O O N CH 3 CH 3 IC50 = 22.0 nM 404.44 COc1ccc(S(=O)(=O)N2C(=O)CN(c3ccc(C)c(C)c3)C2=O)cc1OC Homo sapiens CHEMBL885061 single protein format
CHEMBL281124 OBDepict H 3 C O O N O O HN O N O N NH 2 F Ki = 22.6 nM 569.55 COC(=O)c1ccc2oc(C(=O)C(Cc3ccccc3)NC(=O)Cn3c(-c4ccc(F)cc4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL872602 single protein format
CHEMBL256258 OBDepict CH 3 O O N O O NH H O N O N H 2 N F Ki = 23.0 nM 569.55 COC(=O)c1ccc2oc(C(=O)[C@H](Cc3ccccc3)NC(=O)Cn3c(-c4ccc(F)cc4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL948942 single protein format
CHEMBL24071 OBDepict OH O NH O F F O N H O N O N H 2 N CH 3 Ki = 23.0 nM 555.54 Cc1cccc(-c2ncc(N)c(=O)n2CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCCC(=O)O)c1 Homo sapiens CHEMBL807472 single protein format
CHEMBL305800 OBDepict Cl S N O O O O N Cl Cl IC50 = 23.0 nM 419.67 O=C1CN(c2ccc(Cl)c(Cl)c2)C(=O)N1S(=O)(=O)c1ccc(Cl)cc1 Homo sapiens CHEMBL885061 single protein format
CHEMBL428927 OBDepict H 3 C O Cl Cl N H O N S O O O Cl IC50 = 23.0 nM 491.78 COc1cc(Cl)c(Cl)cc1CC1CNC(=O)CN(S(=O)(=O)c2ccc(Cl)cc2)C1=O Homo sapiens CHEMBL886130 single protein format
CHEMBL3651445 OBDepict CH 3 O O O Cl N H O N S O O O Cl IC50 = 24.0 nM 515.37 COC(=O)COc1ccc(Cl)cc1CC1CNC(=O)CN(S(=O)(=O)c2ccc(Cl)cc2)C1=O Homo sapiens CHEMBL3705318 single protein format
CHEMBL1807640 OBDepict OH O N O N N Cl CH 3 H 3 C H 3 C IC50 = 25.0 nM 411.89 Cc1c(C)n(C)c2c(Cn3c(=O)n(CCC(=O)O)c4ccccc43)cc(Cl)cc12 Homo sapiens CHEMBL1811418 single protein format
CHEMBL246965 OBDepict H 3 C O F N H O N S O O O Cl IC50 = 26.0 nM 440.88 COc1ccc(F)cc1CC1CNC(=O)CN(S(=O)(=O)c2ccc(Cl)cc2)C1=O Homo sapiens CHEMBL886130 single protein format
CHEMBL25830 OBDepict CH 3 O O N O O N H O N N O H 2 N Cl Ki = 26.1 nM 586.0 COC(=O)c1ccc2oc(C(=O)C(Cc3ccccc3)NC(=O)Cn3c(-c4cccc(Cl)c4)ncc(N)c3=O)nc2c1 Homo sapiens CHEMBL872602 single protein format
CHEMBL3640112 OBDepict H 3 C N H O N O O OH N N S H 3 C CH 3 IC50 = 27.0 nM 438.51 CC[C@@H](CC(=O)O)n1c(=O)c2ccncc2n(Cc2nsc3cc(C)cc(C)c23)c1=O Homo sapiens CHEMBL3705301 single protein format
CHEMBL247168 OBDepict H 3 C O N N H O N S O O O Cl IC50 = 27.0 nM 447.9 COc1ccc(C#N)cc1CC1CNC(=O)CN(S(=O)(=O)c2ccc(Cl)cc2)C1=O Homo sapiens CHEMBL886130 single protein format
CHEMBL247185 OBDepict CH 3 O Cl H N H O N S O O O Cl IC50 = 27.0 nM 457.34 COc1ccc(Cl)cc1C[C@H]1CNC(=O)CN(S(=O)(=O)c2ccc(Cl)cc2)C1=O Homo sapiens CHEMBL886130 single protein format
CHEMBL170683 OBDepict CH 3 HN O F F O N H O H N O NH H CH 3 CH 3 O O H 3 C H 3 C CH 3 Ki = 28.7 nM 552.62 CNC(=O)C(F)(F)C(=O)C(Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C Homo sapiens CHEMBL659791 single protein format
CHEMBL284495 OBDepict H 3 C N N O NH 2 HN O O F F NH O N Ki = 28.9 nM 574.59 Cc1cccc(-c2ncc(N)c(=O)n2CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2cccnc2)c1 Homo sapiens CHEMBL807472 single protein format
CHEMBL387130 OBDepict Cl S P O OH OH N H O IC50 = 29.0 nM 431.84 O=C(Nc1ccc2ccccc2c1)C(c1csc2ccc(Cl)cc12)P(=O)(O)O Homo sapiens CHEMBL915852 single protein format
CHEMBL69677 OBDepict H 3 C O O S N O O O O N IC50 = 29.0 nM 374.37 COC(=O)c1ccc(S(=O)(=O)N2C(=O)CN(c3ccccc3)C2=O)cc1 Homo sapiens CHEMBL885061 single protein format