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Assay Detail

CHEMBL5340493

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of C-terminal 6His-tagged human recombinant AKR1B1 expressed in Escherichia coli BL21-CodonPlus competent cells using methyl glyoxylate as substrate incubated for 2 mins in presence of NADPH
24
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Aldo-keto reductase family 1 member B1 (CHEMBL1900)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Identification of a Selective SCoR2 Inhibitor That Protects Against Acute Kidney Injury.
Zhou HL, Hausladen A, Anand P, Rajavel M, Stomberski CT, Zhang R, Premont RT, Greenlee WJ, van den Akker F, Stamler JS.
J Med Chem (2023) 66 : 5657 -5668
PubMed 37027003 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 24 7.50 7.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5418720 1 7.96
CHEMBL5421140 1 7.89
CHEMBL5431713 1 7.85
CHEMBL5431549 2 7.82
CHEMBL5400501 1 7.82
CHEMBL5400147 1 7.80
CHEMBL5414059 1 7.80
CHEMBL5438141 1 7.80
CHEMBL5414200 1 7.75
CHEMBL5413369 1 7.72
CHEMBL5399554 2 7.66
CHEMBL5417323 1 7.66
CHEMBL5397238 2 7.50
CHEMBL5396251 2 7.36
CHEMBL269455 IMIRESTAT 2.0 1 7.34
CHEMBL5400944 1 7.28
CHEMBL5397588 1 7.28
CHEMBL5420064 1 7.25
CHEMBL5423635 1 6.67
CHEMBL5483061 1 6.04

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5418720 IC50 = 11.0 nM 7.96
CHEMBL5421140 IC50 = 13.0 nM 7.89
CHEMBL5431713 IC50 = 14.0 nM 7.85
CHEMBL5431549 IC50 = 15.0 nM 7.82
CHEMBL5400501 IC50 = 15.0 nM 7.82
CHEMBL5414059 IC50 = 16.0 nM 7.80
CHEMBL5400147 IC50 = 16.0 nM 7.80
CHEMBL5438141 IC50 = 16.0 nM 7.80
CHEMBL5414200 IC50 = 18.0 nM 7.75
CHEMBL5413369 IC50 = 19.0 nM 7.72
CHEMBL5417323 IC50 = 22.0 nM 7.66
CHEMBL5399554 IC50 = 22.0 nM 7.66
CHEMBL5399554 IC50 = 27.0 nM 7.57
CHEMBL5431549 IC50 = 30.0 nM 7.52
CHEMBL5397238 IC50 = 32.0 nM 7.50
CHEMBL5397238 IC50 = 42.0 nM 7.38
CHEMBL5396251 IC50 = 44.0 nM 7.36
CHEMBL269455 IMIRESTAT IC50 = 46.0 nM 7.34
CHEMBL5400944 IC50 = 53.0 nM 7.28
CHEMBL5397588 IC50 = 52.0 nM 7.28
CHEMBL5396251 IC50 = 55.0 nM 7.26
CHEMBL5420064 IC50 = 56.0 nM 7.25
CHEMBL5423635 IC50 = 212.0 nM 6.67
CHEMBL5483061 IC50 = 903.0 nM 6.04