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Q14973 | NTCP_HUMAN | Sodium/bile acid cotransporter (SLC10A1)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL184982 OBDepict OH N N CH 3 H OH CH 3 CH 3 H N H O O OH IC50 = 200.0 nM 515.7 C[C@H](CCC(=O)NCC(=O)O)C1CCC2C3C(CC[C@@]21C)[C@@]1(C)Cc2cn(CCO)nc2CC1C[C@H]3O Homo sapiens CHEMBL828684 cell-based format
CHEMBL182301 OBDepict O N H O OH CH 3 H CH 3 H OH CH 3 N N H IC50 = 300.0 nM 471.64 C[C@H](CCC(=O)NCC(=O)O)C1CCC2C3C(CC[C@@]21C)[C@@]1(C)Cc2c[nH]nc2CC1C[C@H]3O Homo sapiens CHEMBL828684 cell-based format
CHEMBL367757 OBDepict O NH H 3 C H O HO CH 3 CH 3 N N HO IC50 = 300.0 nM 561.77 C[C@H](CCC(=O)NCC(=O)O)C1CCC2C3CCC4Cc5nn(Cc6cccc(O)c6)cc5C[C@]4(C)C3CC[C@@]21C Homo sapiens CHEMBL828684 cell-based format
CHEMBL182671 OBDepict O HN CH 3 H O OH CH 3 H OH CH 3 N N OH IC50 = 300.0 nM 577.77 C[C@H](CCC(=O)NCC(=O)O)C1CCC2C3C(CC[C@@]21C)[C@@]1(C)Cc2cn(Cc4cccc(O)c4)nc2CC1C[C@H]3O Homo sapiens CHEMBL828684 cell-based format
CHEMBL185033 OBDepict OH N N CH 3 CH 3 CH 3 H HN O O OH IC50 = 700.0 nM 499.7 C[C@H](CCC(=O)NCC(=O)O)C1CCC2C3CCC4Cc5nn(CCO)cc5C[C@]4(C)C3CC[C@@]21C Homo sapiens CHEMBL828684 cell-based format