| Reaction Details |
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 | Report a problem with these data |
| Target | Cytochrome P450 1A2 |
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| Ligand | BDBM50197859 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_437629 (CHEMBL905989) |
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| IC50 | 23000±n/a nM |
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| Citation |  Garzya, V; Forbes, IT; Gribble, AD; Hadley, MS; Lightfoot, AP; Payne, AH; Smith, AB; Douglas, SE; Cooper, DG; Stansfield, IG; Meeson, M; Dodds, EE; Jones, DN; Wood, M; Reavill, C; Scorer, CA; Worby, A; Riley, G; Eddershaw, P; Ioannou, C; Donati, D; Hagan, JJ; Ratti, EA Studies towards the identification of a new generation of atypical antipsychotic agents. Bioorg Med Chem Lett17:400-5 (2007) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Cytochrome P450 1A2 |
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| Name: | Cytochrome P450 1A2 |
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| Synonyms: | CP1A2_HUMAN | CYP1A2 | CYPIA2 | Cholesterol 25-hydroxylase | Cytochrome P(3)450 | Cytochrome P450 1A | Cytochrome P450 1A2 (CYP1A2) | Cytochrome P450 4 | Cytochrome P450-P3 |
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| Type: | Enzyme |
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| Mol. Mass.: | 58423.38 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P05177 |
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| Residue: | 516 |
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| Sequence: | MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPLLGHVLTLGKN
PHLALSRMSQRYGDVLQIRIGSTPVLVLSRLDTIRQALVRQGDDFKGRPDLYTSTLITDG
QSLTFSTDSGPVWAARRRLAQNALNTFSIASDPASSSSCYLEEHVSKEAKALISRLQELM
AGPGHFDPYNQVVVSVANVIGAMCFGQHFPESSDEMLSLVKNTHEFVETASSGNPLDFFP
ILRYLPNPALQRFKAFNQRFLWFLQKTVQEHYQDFDKNSVRDITGALFKHSKKGPRASGN
LIPQEKIVNLVNDIFGAGFDTVTTAISWSLMYLVTKPEIQRKIQKELDTVIGRERRPRLS
DRPQLPYLEAFILETFRHSSFLPFTIPHSTTRDTTLNGFYIPKKCCVFVNQWQVNHDPEL
WEDPSEFRPERFLTADGTAINKPLSEKMMLFGMGKRRCIGEVLAKWEIFLFLAILLQQLE
FSVPPGVKVDLTPIYGLTMKHARCEHVQARLRFSIN
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| BDBM50197859 |
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| n/a |
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| Name | BDBM50197859 |
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| Synonyms: | 4-butyl-N-(3-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-yl)benzenesulfonamide | CHEMBL231334 |
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| Type | Small organic molecule |
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| Emp. Form. | C21H28N2O2S |
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| Mol. Mass. | 372.524 |
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| SMILES | CCCCc1ccc(cc1)S(=O)(=O)Nc1ccc2CCN(C)CCc2c1 |
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| Structure | 
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