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Q9UHI8 | ATS1_HUMAN | A disintegrin and metalloproteinase with thrombospondin motifs 1 (ADAMTS1)

3D structures mapped by conservation among orthologs

[ Domain: "Metalloproteases ("zincins") catalytic domain" // Reprolysin ]

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[ Domain: "Disulfide-rich domain in A Disintegrin And Metalloprotease (ADAM) domain-containing proteins" // KOG3538_1st ]

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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
CHEMBL187092 OBDepict OH N H O H N S CH 3 OH O O O Cl F IC50 = 79.0 nM 472.92 C[C@@]1(O)CCCN(S(=O)(=O)c2ccc(OCc3ccc(F)cc3Cl)cc2)[C@H]1C(=O)NO Homo sapiens CHEMBL2167995 single protein format
CHEMBL4877087 OBDepict O N H NH O N O N Cl IC50 = 328.0 nM 390.87 O=C1NC(=O)C(CCC(=O)N2CCN(c3cccc(Cl)c3)CC2)(C2CC2)N1 Homo sapiens CHEMBL4835174 single protein format
CHEMBL4862188 OBDepict O N H N H O N N O N Cl F IC50 = 631.0 nM 445.88 O=C1NC(=O)C(CCC(=O)N2CCN(c3ccc(F)c(Cl)c3)CC2)(c2ccccn2)N1 Homo sapiens CHEMBL4835174 single protein format
CHEMBL208009 OBDepict HO NH O N H N H O O CH 3 N Ki = 776.0 nM 448.52 Cc1cc(COc2ccc(C(=O)NC3(CC(=O)NO)CCNCC3)cc2)c2ccccc2n1 Homo sapiens CHEMBL853110 single protein format