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Q16548 | B2LA1_HUMAN | Bcl-2-related protein A1 (BCL2A1)

3D structures mapped by conservation among orthologs

[ Domain: "Bcl-2 inhibitors of programmed cell death" // Bcl-2 ]

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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
CHEMBL4522193 OBDepict HO O NH S S N O O N CH 3 CH 3 CH 3 Ki = 84.0 nM 553.75 CC(C)(C)c1ccc(N2CCN(S(=O)(=O)Nc3ccc(SCCc4ccccc4)cc3C(=O)O)CC2)cc1 Homo sapiens CHEMBL4344314 assay format
CHEMBL4576854 OBDepict HO O NH S S N O O N CH 3 H 3 C CH 3 Ki = 100.0 nM 567.78 CC(C)(C)c1ccc(CN2CCN(S(=O)(=O)Nc3ccc(SCCc4ccccc4)cc3C(=O)O)CC2)cc1 Homo sapiens CHEMBL4344314 assay format
CHEMBL4533559 OBDepict CH 3 O S HN O HO S N O O N H 3 C CH 3 H 3 C Ki = 100.0 nM 583.78 COc1cccc(CCSc2ccc(NS(=O)(=O)N3CCN(c4ccc(C(C)(C)C)cc4)CC3)c(C(=O)O)c2)c1 Homo sapiens CHEMBL4344314 assay format
CHEMBL4558313 OBDepict HO O HN S S O O Ki = 150.0 nM 489.62 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL4344314 assay format
CHEMBL4462138 OBDepict HO O HN S S O O Ki = 170.0 nM 495.67 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)c1ccc(C2CCCCC2)cc1 Homo sapiens CHEMBL4344314 assay format
CHEMBL4454113 OBDepict OH S NH O OH S N O O N CH 3 CH 3 CH 3 Ki = 250.0 nM 569.75 CC(C)(C)c1ccc(N2CCN(S(=O)(=O)Nc3ccc(SCCc4cccc(O)c4)cc3C(=O)O)CC2)cc1 Homo sapiens CHEMBL4344314 assay format
CHEMBL4463305 OBDepict HO O HN S S O O N Ki = 280.0 nM 490.61 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)c1ccc(-c2ccccc2)nc1 Homo sapiens CHEMBL4344314 assay format
CHEMBL4452560 OBDepict HO O HN S S N O O Ki = 390.0 nM 496.65 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)N1CCC(c2ccccc2)CC1 Homo sapiens CHEMBL4344314 assay format
CHEMBL1269202 OBDepict H 3 C N CH 3 Cl O N O Cl Cl IC50 = 400.0 nM 319.58 CN(C)C1=C(Cl)C(=O)N(c2ccc(Cl)c(Cl)c2)C1=O Homo sapiens CHEMBL1273077 single protein format
CHEMBL1272154 OBDepict OH O N N Cl O N O Cl Cl IC50 = 400.0 nM 448.73 O=C1C(Cl)=C(N2CCN(CCOCCO)CC2)C(=O)N1c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL1273077 single protein format
CHEMBL1269107 OBDepict CH 3 O O CH 3 O O OH OH HO HO Ki = 430.0 nM 586.6 CC1=C(C2=C(C)C(=O)c3c(cc(O)c(O)c3Cc3ccccc3)C2=O)C(=O)c2cc(O)c(O)c(Cc3ccccc3)c2C1=O Homo sapiens CHEMBL1273518 single protein format
CHEMBL1271993 OBDepict O N N O Cl Cl O Cl IC50 = 450.0 nM 361.61 O=C1C(Cl)=C(N2CCOCC2)C(=O)N1c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL1273077 single protein format
CHEMBL4457901 OBDepict OH O N H S S O O Ki = 570.0 nM 463.58 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL4344314 assay format
CHEMBL1271764 OBDepict CH 3 N N Cl O N O Cl Cl IC50 = 600.0 nM 374.65 CN1CCN(C2=C(Cl)C(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)CC1 Homo sapiens CHEMBL1273076 single protein format
CHEMBL1272100 OBDepict OH N N Cl O N O Cl Cl IC50 = 620.0 nM 404.68 O=C1C(Cl)=C(N2CCN(CCO)CC2)C(=O)N1c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL1273077 single protein format
CHEMBL1269107 OBDepict CH 3 O O CH 3 O O OH OH HO HO IC50 = 650.0 nM 586.6 CC1=C(C2=C(C)C(=O)c3c(cc(O)c(O)c3Cc3ccccc3)C2=O)C(=O)c2cc(O)c(O)c(Cc3ccccc3)c2C1=O Homo sapiens CHEMBL1273518 single protein format
CHEMBL1271495 OBDepict O N N O Cl Cl N Cl IC50 = 690.0 nM 476.79 O=C1C(Cl)=C(N2CCN(C/C=C/c3ccccc3)CC2)C(=O)N1c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL1273077 single protein format
CHEMBL4475729 OBDepict HO O HN S S N O O N Ki = 760.0 nM 497.64 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)N1CCN(c2ccccc2)CC1 Homo sapiens CHEMBL4344314 assay format
CHEMBL1272047 OBDepict O N N O Cl Cl NH H H 3 C Cl IC50 = 800.0 nM 374.66 C[C@@H]1CN(C2=C(Cl)C(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)CCN1 Homo sapiens CHEMBL1273077 single protein format
CHEMBL4435041 OBDepict Br S HN O O O OH S Ki = 810.0 nM 492.42 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)c1ccc(Br)cc1 Homo sapiens CHEMBL4344314 assay format
CHEMBL4440719 OBDepict F N N S HN O O O HO S Ki = 900.0 nM 529.66 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)N1CCN(Cc2ccc(F)cc2)CC1 Homo sapiens CHEMBL4344314 assay format
CHEMBL1272224 OBDepict CH 3 H 3 C HO O HO CH 3 O CH 3 O O OH OH CH 3 CH 3 Ki = 930.0 nM 518.56 CC1=C(C2=C(C)C(=O)c3c(cc(O)c(O)c3CC(C)C)C2=O)C(=O)c2cc(O)c(O)c(CC(C)C)c2C1=O Homo sapiens CHEMBL1273518 single protein format
CHEMBL408194 OBDepict CH 3 O N N N H H 3 C H CH 3 Ki = 1000.0 nM 317.39 COC1=CC(c2cc3ccccc3[nH]2)=N/C1=Cc1[nH]c(C)cc1C Homo sapiens CHEMBL936499 single protein format
CHEMBL4473975 OBDepict HO O HN S S N O O N Ki = 1000.0 nM 511.67 O=C(O)c1cc(SCCc2ccccc2)ccc1NS(=O)(=O)N1CCN(Cc2ccccc2)CC1 Homo sapiens CHEMBL4344314 assay format
CHEMBL1271825 OBDepict CH 3 N N Cl O N O Cl IC50 = 1000.0 nM 340.21 CN1CCN(C2=C(Cl)C(=O)N(c3ccccc3Cl)C2=O)CC1 Homo sapiens CHEMBL1273077 single protein format
CHEMBL1271994 OBDepict CH 3 N N Cl O N O Cl Cl IC50 = 1000.0 nM 388.68 CCN1CCN(C2=C(Cl)C(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)CC1 Homo sapiens CHEMBL1273077 single protein format