Reaction Details |
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Target | Cytochrome P450 2D6 |
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Ligand | BDBM50255702 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_515428 (CHEMBL1028887) |
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Ki | 28.1±n/a nM |
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Citation | Ponte-Sucre, A; Gulder, T; Wegehaupt, A; Albert, C; Rikanovic, C; Schaeflein, L; Frank, A; Schultheis, M; Unger, M; Holzgrabe, U; Bringmann, G; Moll, H Structure-activity relationship and studies on the molecular mechanism of leishmanicidal N,C-coupled arylisoquinolinium salts. J Med Chem52:626-36 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Cytochrome P450 2D6 |
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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: | MGLEALVPLAVIVAIFLLLVDLMHRRQRWAARYPPGPLPLPGLGNLLHVDFQNTPYCFDQ
LRRRFGDVFSLQLAWTPVVVLNGLAAVREALVTHGEDTADRPPVPITQILGFGPRSQGVF
LARYGPAWREQRRFSVSTLRNLGLGKKSLEQWVTEEAACLCAAFANHSGRPFRPNGLLDK
AVSNVIASLTCGRRFEYDDPRFLRLLDLAQEGLKEESGFLREVLNAVPVLLHIPALAGKV
LRFQKAFLTQLDELLTEHRMTWDPAQPPRDLTEAFLAEMEKAKGNPESSFNDENLRIVVA
DLFSAGMVTTSTTLAWGLLLMILHPDVQRRVQQEIDDVIGQVRRPEMGDQAHMPYTTAVI
HEVQRFGDIVPLGVTHMTSRDIEVQGFRIPKGTTLITNLSSVLKDEAVWEKPFRFHPEHF
LDAQGHFVKPEAFLPFSAGRRACLGEPLARMELFLFFTSLLQHFSFSVPTGQPRPSHHGV
FAFLVSPSPYELCAVPR
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BDBM50255702 |
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n/a |
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Name | BDBM50255702 |
Synonyms: | CHEMBL520612 | N-(4'-Methyl phenyl)-6,8-dimethoxy-1,3-dimethylisoquinolinium tetrafluoroborate |
Type | Small organic molecule |
Emp. Form. | C20H22NO2 |
Mol. Mass. | 308.3936 |
SMILES | COc1cc(OC)c2c(C)[n+](c(C)cc2c1)-c1ccc(C)cc1 |
Structure |
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