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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Aldo-keto reductase family 1 member B1 | ||
| Ligand | BDBM50038843 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_470439 (CHEMBL936594) | ||
| IC50 | 70±n/a nM | ||
| Citation |  Dhagat, U; Endo, S; Hara, A; El-Kabbani, O Inhibition of 3(17)alpha-hydroxysteroid dehydrogenase (AKR1C21) by aldose reductase inhibitors. Bioorg Med Chem16:3245-54 (2008) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Aldo-keto reductase family 1 member B1 | |||
| Name: | Aldo-keto reductase family 1 member B1 | ||
| Synonyms: | AKR1B1 | ALDR1 | ALDR_HUMAN | ALR2 | AR | Aldo-keto reductase family 1 member B1 (AKR1B1) | Aldose Reductase (ALR2) | Aldose reductase | Aldose reductase (AR) | ||
| Type: | Protein | ||
| Mol. Mass.: | 35855.50 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P15121. 4LAU; 2IKI; 4LB4; 2FZD; 2FZ8; 1US0 | ||
| Residue: | 316 | ||
| Sequence: |
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| BDBM50038843 | |||
| n/a | |||
| Name | BDBM50038843 | ||
| Synonyms: | (4R)-2-(4-bromo-2-fluorobenzyl)-6-fluoro-1H,2'H,5'H-spiro[isoquinoline-4,3'-pyrrolidine]-1,2',3,5'(2H)-tetrone | (4R)-2-[(4-bromo-2-fluorophenyl)methyl]-6-fluoro-2,3-dihydro-1H-spiro[isoquinoline-4,3'-pyrrolidine]-1,2',3,5'-tetrone | 2-(4-bromo-2-fluorobenzyl)-6-fluoro-1H,2'H,5'H-spiro[isoquinoline-4,3'-pyrrolidine]-1,2',3,5'(2H)-tetrone | 2-(4-bromo-2-fluorobenzyl)-6-fluorospiro[1,2,3,4-tetrahydroisoquinoline-4,3'-(tetrahydro-1'H-pyrrole)]-1,2',3,5'-tetraone | 2[4-BROMO-2-FLUOROPHENYL)METHYL]-6-FLUOROSPIRO[ISOQUINOLINE-4-(1H),3'-PYRROLIDINE]-1,2',3,5'(2H)-TETRONE | CHEMBL292963 | minalrestat | ||
| Type | Small organic molecule | ||
| Emp. Form. | C19H11BrF2N2O4 | ||
| Mol. Mass. | 449.202 | ||
| SMILES | Fc1ccc2C(=O)N(Cc3ccc(Br)cc3F)C(=O)[C@]3(CC(=O)NC3=O)c2c1 |r| | ||
| Structure | 
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