| Reaction Details |
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 | Report a problem with these data |
| Target | Aldo-keto reductase family 1 member A1 |
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| Ligand | BDBM16314 |
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| Substrate/Competitor | BDBM16241 |
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| Meas. Tech. | Enzyme Inhibition Assay |
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| IC50 | 1940±n/a nM |
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| Citation |  Van Zandt, MC; Jones, ML; Gunn, DE; Geraci, LS; Jones, JH; Sawicki, DR; Sredy, J; Jacot, JL; Dicioccio, AT; Petrova, T; Mitschler, A; Podjarny, AD Discovery of 3-[(4,5,7-trifluorobenzothiazol-2-yl)methyl]indole-N-acetic acid (lidorestat) and congeners as highly potent and selective inhibitors of aldose reductase for treatment of chronic diabetic complications. J Med Chem48:3141-52 (2005) [PubMed] Article |
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| More Info.: | Get all data from this article, Solution Info, Assay Method |
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| Aldo-keto reductase family 1 member A1 |
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| Name: | Aldo-keto reductase family 1 member A1 |
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| Synonyms: | AK1A1_HUMAN | AKR1A1 | ALDR1 | ALR | Alcohol dehydrogenase [NADP+] | Aldehyde Reductase (ALR1) | Aldehyde reductase | Aldo-keto reductase family 1 member A1 |
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| Type: | Enzyme |
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| Mol. Mass.: | 36574.11 |
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| Organism: | Homo sapiens (Human) |
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| Description: | n/a |
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| Residue: | 325 |
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| Sequence: | MAASCVLLHTGQKMPLIGLGTWKSEPGQVKAAVKYALSVGYRHIDCAAIYGNEPEIGEAL
KEDVGPGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFER
GDNPFPKNADGTICYDSTHYKETWKALEALVAKGLVQALGLSNFNSRQIDDILSVASVRP
AVLQVECHPYLAQNELIAHCQARGLEVTAYSPLGSSDRAWRDPDEPVLLEEPVVLALAEK
YGRSPAQILLRWQVQRKVICIPKSITPSRILQNIKVFDFTFSPEEMKQLNALNKNWRYIV
PMLTVDGKRVPRDAGHPLYPFNDPY
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| BDBM16314 |
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| BDBM16241 |
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| Name | BDBM16314 |
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| Synonyms: | 2-{[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]-N-methylmethanethioamido}acetic acid | Alredase | CHEMBL436 | N-{[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]carbonothioyl}-N-methylglycine | Tolrestat |
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| Type | Small organic molecule |
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| Emp. Form. | C16H14F3NO3S |
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| Mol. Mass. | 357.347 |
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| SMILES | COc1ccc2c(cccc2c1C(F)(F)F)C(=S)N(C)CC(O)=O |
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| Structure | 
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