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Assay Detail

CHEMBL4737004

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

Binding
Inhibition of GSTP1-1 (unknown origin) using reduced GSH and CDNB as substrate incubated for 10 mins followed by substrate addition by microplate reader analysis
22
Total Activities
22
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

Glutathione S-transferase P (CHEMBL3902)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of 6-(7-Nitro-2,1,3-benzoxadiazol-4-ylthio)hexanol Derivatives as Glutathione Transferase Inhibitors with Favorable Selectivity and Tolerated Toxicity.
Liu Q,Liu Z,Hua W,Gou S
J Med Chem (2021) 64 : 1701 -1712
PubMed 33529017 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 22 5.51 6.80

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4757438 1 6.80
CHEMBL4763818 1 6.48
CHEMBL4777228 1 6.38
CHEMBL4797471 1 6.34
CHEMBL4794932 1 6.30
CHEMBL4748062 1 6.28
CHEMBL4764480 1 6.27
CHEMBL1234570 1 5.84
CHEMBL4757338 1 5.39
CHEMBL4783291 1 5.39
CHEMBL4757112 1 5.30
CHEMBL4743025 1 5.29
CHEMBL4763865 1 5.19
CHEMBL4762497 1 5.17
CHEMBL4743365 1 5.07
CHEMBL4739867 1 5.02
CHEMBL4751148 1 5.01
CHEMBL4787180 1 5.00
CHEMBL4797735 1 4.99
CHEMBL4762005 1 4.81
CHEMBL4759134 1 4.54
CHEMBL4742105 1 4.46

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4757438 IC50 = 160.0 nM 6.80
CHEMBL4763818 IC50 = 330.0 nM 6.48
CHEMBL4777228 IC50 = 420.0 nM 6.38
CHEMBL4797471 IC50 = 460.0 nM 6.34
CHEMBL4794932 IC50 = 500.0 nM 6.30
CHEMBL4748062 IC50 = 530.0 nM 6.28
CHEMBL4764480 IC50 = 540.0 nM 6.27
CHEMBL1234570 IC50 = 1460.0 nM 5.84
CHEMBL4757338 IC50 = 4100.0 nM 5.39
CHEMBL4783291 IC50 = 4050.0 nM 5.39
CHEMBL4757112 IC50 = 5050.0 nM 5.30
CHEMBL4743025 IC50 = 5090.0 nM 5.29
CHEMBL4763865 IC50 = 6470.0 nM 5.19
CHEMBL4762497 IC50 = 6800.0 nM 5.17
CHEMBL4743365 IC50 = 8570.0 nM 5.07
CHEMBL4739867 IC50 = 9550.0 nM 5.02
CHEMBL4751148 IC50 = 9850.0 nM 5.01
CHEMBL4787180 IC50 = 9890.0 nM 5.00
CHEMBL4797735 IC50 = 10160.0 nM 4.99
CHEMBL4762005 IC50 = 15490.0 nM 4.81
CHEMBL4759134 IC50 = 28840.0 nM 4.54
CHEMBL4742105 IC50 = 35000.0 nM 4.46