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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Cytochrome P450 2D6 | ||
| Ligand | BDBM50027058 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_123021 (CHEMBL729206) | ||
| Ki | 80±n/a nM | ||
| Citation |  Strobl, GR; von Kruedener, S; Stöckigt, J; Guengerich, FP; Wolff, T Development of a pharmacophore for inhibition of human liver cytochrome P-450 2D6: molecular modeling and inhibition studies. J Med Chem36:1136-45 (1993) [PubMed] | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Cytochrome P450 2D6 | |||
| Name: | Cytochrome P450 2D6 | ||
| Synonyms: | CP2D6_HUMAN | CYP2D6 | CYP2DL1 | CYPIID6 | Cytochrome P450 2D6 (CYP2D6) | Debrisoquine 4-hydroxylase | P450-DB1 | ||
| Type: | Protein | ||
| Mol. Mass.: | 55774.82 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P10635 | ||
| Residue: | 497 | ||
| Sequence: |
| ||
| BDBM50027058 | |||
| n/a | |||
| Name | BDBM50027058 | ||
| Synonyms: | (1S,2S,4aR,13bS,14aS)-2-Hydroxy-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydro-indolo[2'',3'':3,4]pyrido[1,2-b]isoquinoline-1-carboxylic acid methyl ester | (1S,2S,4aR,13bS,14aS)-2-Hydroxy-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydro-indolo[2',3':3,4]pyrido[1,2-b]isoquinoline-1-carboxylic acid methyl ester | 2-Hydroxy-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydro-indolo[2',3':3,4]pyrido[1,2-b]isoquinoline-1-carboxylic acid methyl ester | CHEMBL31410 | corynantheine | ||
| Type | Small organic molecule | ||
| Emp. Form. | C21H26N2O3 | ||
| Mol. Mass. | 354.4427 | ||
| SMILES | COC(=O)[C@@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 |r| | ||
| Structure | 
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