Reaction Details |
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Target | Cytochrome P450 3A4 |
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Ligand | BDBM50396556 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_863248 (CHEMBL2176191) |
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IC50 | 15±n/a nM |
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Citation | Ruf, S; Buning, C; Schreuder, H; Horstick, G; Linz, W; Olpp, T; Pernerstorfer, J; Hiss, K; Kroll, K; Kannt, A; Kohlmann, M; Linz, D; Hübschle, T; Rütten, H; Wirth, K; Schmidt, T; Sadowski, T Novelß-amino acid derivatives as inhibitors of cathepsin A. J Med Chem55:7636-49 (2012) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Cytochrome P450 3A4 |
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Name: | Cytochrome P450 3A4 |
Synonyms: | Albendazole monooxygenase | Albendazole sulfoxidase | CP3A4_HUMAN | CYP3A3 | CYP3A4 | CYPIIIA3 | CYPIIIA4 | Cytochrome P450 3A3 | Cytochrome P450 3A4 (CYP3A4) | Cytochrome P450 HLp | Nifedipine oxidase | Quinine 3-monooxygenase | Taurochenodeoxycholate 6-alpha-hydroxylase |
Type: | Enzyme |
Mol. Mass.: | 57349.57 |
Organism: | Homo sapiens (Human) |
Description: | n/a |
Residue: | 503 |
Sequence: | MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNILSYHKGFCMF
DMECHKKYGKVWGFYDGQQPVLAITDPDMIKTVLVKECYSVFTNRRPFGPVGFMKSAISI
AEDEEWKRLRSLLSPTFTSGKLKEMVPIIAQYGDVLVRNLRREAETGKPVTLKDVFGAYS
MDVITSTSFGVNIDSLNNPQDPFVENTKKLLRFDFLDPFFLSITVFPFLIPILEVLNICV
FPREVTNFLRKSVKRMKESRLEDTQKHRVDFLQLMIDSQNSKETESHKALSDLELVAQSI
IFIFAGYETTSSVLSFIMYELATHPDVQQKLQEEIDAVLPNKAPPTYDTVLQMEYLDMVV
NETLRLFPIAMRLERVCKKDVEINGMFIPKGVVVMIPSYALHRDPKYWTEPEKFLPERFS
KKNKDNIDPYIYTPFGSGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQIPLKLSLG
GLLQPEKPVVLKVESRDGTVSGA
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BDBM50396556 |
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n/a |
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Name | BDBM50396556 |
Synonyms: | CHEMBL2171398 |
Type | Small organic molecule |
Emp. Form. | C24H24FN3O4 |
Mol. Mass. | 437.4635 |
SMILES | Cc1ccccc1[C@H](CC(O)=O)NC(=O)c1cc(OCC2CC2)n(n1)-c1ccccc1F |r| |
Structure |
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