Reaction Details |
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Target | Cytochrome P450 3A4 |
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Ligand | BDBM50479542 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_495352 (CHEMBL995940) |
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Ki | <50000000±n/a nM |
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Citation | Mustata, G; Follis, AV; Hammoudeh, DI; Metallo, SJ; Wang, H; Prochownik, EV; Lazo, JS; Bahar, I Discovery of novel Myc-Max heterodimer disruptors with a three-dimensional pharmacophore model. J Med Chem52:1247-50 (2009) [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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BDBM50479542 |
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n/a |
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Name | BDBM50479542 |
Synonyms: | CAS 31122-64-2 | CHEMBL491273 |
Type | Small organic molecule |
Emp. Form. | C16H18N2O3 |
Mol. Mass. | 286.3257 |
SMILES | O=C(CCN1C(=O)c2ccccc2C1=O)N1CCCCC1 |
Structure |
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