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Target
Aldo-keto reductase family 1 member A1
Ligand
BDBM16314
Substrate
n/a
Meas. Tech.
ChEMBL_2330030
IC50
65±n/a nM
Citation
 Zhou, HL; Hausladen, A; Anand, P; Rajavel, M; Stomberski, CT; Zhang, R; Premont, RT; Greenlee, WJ; van den Akker, F; Stamler, JS Identification of a Selective SCoR2 Inhibitor That Protects Against Acute Kidney Injury. J Med Chem 66:5657-5668 (2023) [PubMed] 
Target
Name:
Aldo-keto reductase family 1 member A1
Synonyms:
Alcohol dehydrogenase [NADP+] | Aldo-keto reductase family 1 member A1 | Aldehyde Reductase (ALR1) | AK1A1_HUMAN | AKR1A1 | ALDR1 | ALR | Aldehyde reductase
Type:
Enzyme
Mol. Mass.:
36574.11
Organism:
Human
Description:
n/a
Residue:
325
Sequence:
MAASCVLLHTGQKMPLIGLGTWKSEPGQVKAAVKYALSVGYRHIDCAAIYGNEPEIGEALKEDVGPGKAVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFERGDNPFPKNADGTICYDSTHYKETWKALEALVAKGLVQALGLSNFNSRQIDDILSVASVRPAVLQVECHPYLAQNELIAHCQARGLEVTAYSPLGSSDRAWRDPDEPVLLEEPVVLALAEKYGRSPAQILLRWQVQRKVICIPKSITPSRILQNIKVFDFTFSPEEMKQLNALNKNWRYIVPMLTVDGKRVPRDAGHPLYPFNDPY
  
Inhibitor
Name:
BDBM16314
Synonyms:
N-{[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]carbonothioyl}-N-methylglycine | Alredase | 2-{[6-methoxy-5-(trifluoromethyl)naphthalen-1-yl]-N-methylmethanethioamido}acetic acid | CHEMBL436 | Tolrestat
Type:
Small organic molecule
Emp. Form.:
C16H14F3NO3S
Mol. Mass.:
357.06
SMILES:
CN(CC(=O)O)C(=S)c1cccc2c1ccc(c2C(F)(F)F)OC
Structure:
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