Reaction Details | |||
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Target | Aldo-keto reductase family 1 member B1 | ||
Ligand | BDBM50010436 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_218061 (CHEMBL821473) | ||
Ki | 310±n/a nM | ||
Citation | Deck, LM; Vander Jagt, DL; Royer, RE Gossypol and derivatives: a new class of aldose reductase inhibitors. J Med Chem34:3301-5 (1991) [PubMed] | ||
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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BDBM50010436 | |||
n/a | |||
Name | BDBM50010436 | ||
Synonyms: | 6,7,6',7'-Tetrahydroxy-5,5'-diisopropyl-1,1'-dimethoxy-3,3'-dimethyl-[2,2']binaphthalenyl-8,8'-dicarbaldehyde | CHEMBL114289 | ||
Type | Small organic molecule | ||
Emp. Form. | C32H34O8 | ||
Mol. Mass. | 546.6076 | ||
SMILES | COc1c(c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1OC |(9.55,-8.26,;8.21,-9.03,;8.21,-10.58,;9.55,-11.35,;9.55,-12.91,;9.55,-14.01,;8.21,-13.65,;6.92,-12.91,;5.59,-13.65,;5.59,-15.21,;6.92,-15.98,;4.26,-15.98,;4.26,-12.91,;2.92,-13.69,;4.26,-11.35,;2.92,-10.58,;5.59,-10.58,;5.59,-9.03,;4.5,-7.93,;6.92,-11.35,;12.21,-11.35,;12.21,-12.91,;12.24,-14.01,;13.55,-13.65,;14.86,-12.91,;16.19,-13.65,;16.19,-15.21,;17.54,-15.98,;14.86,-15.98,;17.54,-12.91,;18.85,-13.69,;17.54,-11.35,;18.85,-10.58,;16.19,-10.58,;16.18,-9.03,;17.26,-7.93,;14.86,-11.35,;13.55,-10.58,;13.55,-9.03,;12.21,-8.26,)| | ||
Structure |