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Assay Detail

CHEMBL5507347

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

Binding
Binding affinity to recombinant human AKR1C3 in presence of NADP+ by MST assay
3
Total Activities
3
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 C3 (CHEMBL4681)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-guided optimization of 3-hydroxybenzoisoxazole derivatives as inhibitors of Aldo-keto reductase 1C3 (AKR1C3) to target prostate cancer.
Pippione AC, Kovachka S, Vigato C, Bertarini L, Mannella I, Sainas S, Rolando B, Denasio E, Piercy-Mycock H, Romalho L, Salladini E, Adinolfi S, Zonari D, Peraldo-Neia C, Chiorino G, Passoni A, Mirza OA, Frydenvang K, Pors K, Lolli ML, Spyrakis F, Oliaro-Bosso S, Boschi D.
Eur J Med Chem (2024) 268 : 116193 -116193
PubMed 38364714 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 3 5.47 5.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5555217 1 5.60
CHEMBL5557454 1 5.52
CHEMBL4238437 1 5.28

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5555217 Kd = 2500.0 nM 5.60
CHEMBL5557454 Kd = 3000.0 nM 5.52
CHEMBL4238437 Kd = 5200.0 nM 5.28