| Reaction Details |
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 | Report a problem with these data |
| Target | Cytochrome P450 3A4 |
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| Ligand | BDBM50428871 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_945618 (CHEMBL2344952) |
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| IC50 | 360±n/a nM |
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| Citation |  Taygerly, JP; McGee, LR; Rubenstein, SM; Houze, JB; Cushing, TD; Li, Y; Motani, A; Chen, JL; Frankmoelle, W; Ye, G; Learned, MR; Jaen, J; Miao, S; Timmermans, PB; Thoolen, M; Kearney, P; Flygare, J; Beckmann, H; Weiszmann, J; Lindstrom, M; Walker, N; Liu, J; Biermann, D; Wang, Z; Hagiwara, A; Iida, T; Aramaki, H; Kitao, Y; Shinkai, H; Furukawa, N; Nishiu, J; Nakamura, M Discovery of INT131: a selective PPAR¿ modulator that enhances insulin sensitivity. Bioorg Med Chem21:979-92 (2013) [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 |
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| 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 |
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| Type: | Enzyme |
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| Mol. Mass.: | 57349.57 |
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| Organism: | Homo sapiens (Human) |
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| Description: | n/a |
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| Residue: | 503 |
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| Sequence: | MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNILSYHKGFCMF
DMECHKKYGKVWGFYDGQQPVLAITDPDMIKTVLVKECYSVFTNRRPFGPVGFMKSAISI
AEDEEWKRLRSLLSPTFTSGKLKEMVPIIAQYGDVLVRNLRREAETGKPVTLKDVFGAYS
MDVITSTSFGVNIDSLNNPQDPFVENTKKLLRFDFLDPFFLSITVFPFLIPILEVLNICV
FPREVTNFLRKSVKRMKESRLEDTQKHRVDFLQLMIDSQNSKETESHKALSDLELVAQSI
IFIFAGYETTSSVLSFIMYELATHPDVQQKLQEEIDAVLPNKAPPTYDTVLQMEYLDMVV
NETLRLFPIAMRLERVCKKDVEINGMFIPKGVVVMIPSYALHRDPKYWTEPEKFLPERFS
KKNKDNIDPYIYTPFGSGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQIPLKLSLG
GLLQPEKPVVLKVESRDGTVSGA
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| BDBM50428871 |
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| n/a |
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| Name | BDBM50428871 |
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| Synonyms: | CHEMBL2331785 |
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| Type | Small organic molecule |
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| Emp. Form. | C21H18Cl3N3O4S |
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| Mol. Mass. | 514.809 |
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| SMILES | CCNC(=O)c1cc(NS(=O)(=O)c2cc(C)c(Cl)cc2Cl)ccc1Oc1cncc(Cl)c1 |
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| Structure | 
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