Reaction Details |
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Target | Cytochrome P450 2D3 |
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Ligand | BDBM50122613 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_51711 (CHEMBL665726) |
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IC50 | 1754000±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 2D3 |
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Name: | Cytochrome P450 2D3 |
Synonyms: | CP2D3_RAT | Cyp2d-3 | Cyp2d3 |
Type: | PROTEIN |
Mol. Mass.: | 56643.68 |
Organism: | Rattus norvegicus |
Description: | ChEMBL_51711 |
Residue: | 500 |
Sequence: | MELLAGTGLWPMAIFTVIFILLVDLMHRRQRWTSRYPPGPVPWPVLGNLLQVDLCNMPYS
MYKLQNRYGDVFSLQMGWKPVVVINGLKAVQELLVTCGEDTADRPEMPIFQHIGYGHKAK
GVVLAPYGPEWREQRRFSVSTLRNFGVGKKSLEQWVTDEASHLCDALTAEAGRPLDPYTL
LNKAVCNVIASLIYARRFDYGDPDFIKVLKILKESMGEQTGLFPEVLNMFPVLLRIPGLA
DKVFPGQKTFLTMVDNLVTEHKKTWDPDQPPRDLTDAFLAEIEKAKGNPESSFNDANLRL
VVNDLFGAGMVTTSITLTWALLLMILHPDVQCRVQQEIDEVIGQVRHPEMADQAHMPFTN
AVIHEVQRFADIVPMNLPHKTSRDIEVQGFLIPKGTTLIPNLSSVLKDETVWEKPLRFHP
EHFLDAQGNFVKHEAFMPFSAGRRACLGEPLARMELFLFFTCLLQRFSFSVPTGQPRPSD
YGVFAFLLSPSPYQLCAFKR
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BDBM50122613 |
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n/a |
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Name | BDBM50122613 |
Synonyms: | 3,4-dihydroisoquinoline-2(1H)-carboximidamide | CHEMBL169901 | Debrisochinum | Debrisoquin | Isocaramidine |
Type | Small organic molecule |
Emp. Form. | C10H13N3 |
Mol. Mass. | 175.2303 |
SMILES | NC(=N)N1CCc2ccccc2C1 |
Structure |
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