Reaction Details |
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Target | Alcohol dehydrogenase 1A |
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Ligand | BDBM50368955 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_30835 (CHEMBL645234) |
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Ki | 21000±n/a nM |
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Citation | Goldstein, BM; Li, H; Jones, JP; Bell, JE; Zeidler, J; Pankiewicz, KW; Watanabe, KA CNAD: a potent and specific inhibitor of alcohol dehydrogenase. J Med Chem37:392-9 (1994) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Alcohol dehydrogenase 1A |
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Name: | Alcohol dehydrogenase 1A |
Synonyms: | ADH1 | ADH1A | ADH1A_HUMAN | Alcohol dehydrogenase | Alcohol dehydrogenase 1A | Alcohol dehydrogenase alpha chain | Alcohol dehydrogenase subunit alpha |
Type: | PROTEIN |
Mol. Mass.: | 39866.36 |
Organism: | Homo sapiens (Human) |
Description: | ChEMBL_31168 |
Residue: | 375 |
Sequence: | MSTAGKVIKCKAAVLWELKKPFSIEEVEVAPPKAHEVRIKMVAVGICGTDDHVVSGTMVT
PLPVILGHEAAGIVESVGEGVTTVKPGDKVIPLAIPQCGKCRICKNPESNYCLKNDVSNP
QGTLQDGTSRFTCRRKPIHHFLGISTFSQYTVVDENAVAKIDAASPLEKVCLIGCGFSTG
YGSAVNVAKVTPGSTCAVFGLGGVGLSAIMGCKAAGAARIIAVDINKDKFAKAKELGATE
CINPQDYKKPIQEVLKEMTDGGVDFSFEVIGRLDTMMASLLCCHEACGTSVIVGVPPDSQ
NLSMNPMLLLTGRTWKGAILGGFKSKECVPKLVADFMAKKFSLDALITHVLPFEKINEGF
DLLHSGKSIRTILMF
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BDBM50368955 |
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n/a |
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Name | BDBM50368955 |
Synonyms: | CHEMBL1235132 |
Type | Small organic molecule |
Emp. Form. | C21H27N7O14P2 |
Mol. Mass. | 663.4251 |
SMILES | NC(=O)c1cccc([nH+]1)[C@@H]1O[C@H](COP([O-])(=O)O[P@@](O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O |r,@@:14| |
Structure |
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