Reaction Details |
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Target | Cytochrome P450 2D4 |
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Ligand | BDBM36108 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_51712 (CHEMBL665727) |
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IC50 | 117000±n/a nM |
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Citation | Venhorst, J; ter Laak, AM; Commandeur, JN; Funae, Y; Hiroi, T; Vermeulen, NP Homology modeling of rat and human cytochrome P450 2D (CYP2D) isoforms and computational rationalization of experimental ligand-binding specificities. J Med Chem46:74-86 (2002) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Cytochrome P450 2D4 |
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Name: | Cytochrome P450 2D4 |
Synonyms: | CP2D4_RAT | CYPIID4 | Cyp2d-18 | Cyp2d-4 | Cyp2d18 | Cyp2d4 | Cytochrome P450 2D18 | Cytochrome P450 2D4 | Cytochrome P450-CMF3 | Cytochrome P450-DB4 | Debrisoquine 4-hydroxylase |
Type: | PROTEIN |
Mol. Mass.: | 56689.73 |
Organism: | Rattus norvegicus |
Description: | ChEMBL_1280215 |
Residue: | 500 |
Sequence: | MRMPTGSELWPIAIFTIIFLLLVDLMHRRQRWTSRYPPGPVPWPVLGNLLQIDFQNMPAG
FQKLRCRFGDLFSLQLAFESVVVLNGLPALREALVKYSEDTADRPPLHFNDQSGFGPRSQ
GVVLARYGPAWRQQRRFSVSTFRHFGLGKKSLEQWVTEEARCLCAAFADHSGFPFSPNTL
LDKAVCNVIASLLFACRFEYNDPRFIRLLDLLKDTLEEESGFLPMLLNVFPMLLHIPGLL
GKVFSGKKAFVAMLDELLTEHKVTWDPAQPPRDLTDAFLAEVEKAKGNPESSFNDENLRV
VVADLFMAGMVTTSTTLTWALLFMILRPDVQCRVQQEIDEVIGQVRRPEMADQARMPFTN
AVIHEVQRFADILPLGVPHKTSRDIEVQGFLIPKGTTLIINLSSVLKDETVWEKPLRFHP
EHFLDAQGNFVKHEAFMPFSAGRRACLGEPLARMELFLFFTCLLQRFSFSVPAGQPRPSN
YGVFGALTTPRPYQLCASPR
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BDBM36108 |
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n/a |
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Name | BDBM36108 |
Synonyms: | (R)-propranolol |
Type | Guest |
Emp. Form. | C16H22NO2 |
Mol. Mass. | 260.3508 |
SMILES | CC(C)[NH2+]C[C@@H](O)COc1cccc2ccccc12 |
Structure |
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