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Assay Detail

CHEMBL2168781

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

Binding
Inhibition of reductase activity of N-terminal 6His-tagged human recombinant AKR1B1 expressed in Escherichia coli BL21(DE3) assessed as assessed as pyridine-3-aldehyde reduction
7
Total Activities
7
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

Selective inhibition of the tumor marker aldo-keto reductase family member 1B10 by oleanolic acid.
Takemura M, Endo S, Matsunaga T, Soda M, Zhao HT, El-Kabbani O, Tajima K, Iinuma M, Hara A.
J Nat Prod (2011) 74 : 1201 -1206
PubMed 21561086 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 7 4.41 4.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL269277 BETULINIC ACID 1.0 1 4.96
CHEMBL404313 ASIATIC ACID 1 4.47
CHEMBL169 URSOLIC ACID 2.0 1 4.39
CHEMBL201515 MASLINIC ACID 1 4.14
CHEMBL400074 ERYTHRODIOL 1 4.08
CHEMBL168 OLEANOLIC_ACID 1 -
CHEMBL230006 ENOXOLONE 2.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL269277 BETULINIC ACID IC50 = 11000.0 nM 4.96
CHEMBL404313 ASIATIC ACID IC50 = 34000.0 nM 4.47
CHEMBL169 URSOLIC ACID IC50 = 41000.0 nM 4.39
CHEMBL201515 MASLINIC ACID IC50 = 72000.0 nM 4.14
CHEMBL400074 ERYTHRODIOL IC50 = 84000.0 nM 4.08
CHEMBL168 OLEANOLIC_ACID IC50 = 124000.0 nM -
CHEMBL230006 ENOXOLONE IC50 = 280000.0 nM -