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Assay Detail

CHEMBL3379628

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

Binding
Inhibition of ATR (unknown origin) using Avi-tagged protein substrate by alphascreen assay
14
Total Activities
14
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

Serine/threonine-protein kinase ATR (CHEMBL5024)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Based Drug Design of Novel Potent and Selective Tetrahydropyrazolo[1,5-a]pyrazines as ATR Inhibitors.
Barsanti PA, Aversa RJ, Jin X, Pan Y, Lu Y, Elling R, Jain R, Knapp M, Lan J, Lin X, Rudewicz P, Sim J, Taricani L, Thomas G, Xiao L, Yue Q.
ACS Med Chem Lett (2015) 6 : 37 -41
PubMed 25589927 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 7.94 9.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3355072 1 9.52
CHEMBL3355074 1 9.40
CHEMBL3355069 1 9.30
CHEMBL3355071 1 9.30
CHEMBL3355070 1 9.00
CHEMBL3355073 1 9.00
CHEMBL3352844 1 8.70
CHEMBL3355068 1 7.58
CHEMBL3355075 1 7.54
CHEMBL3355079 1 7.39
CHEMBL3355080 1 7.19
CHEMBL3355076 1 6.36
CHEMBL3355078 1 5.68
CHEMBL3355077 1 5.21

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3355072 IC50 = 0.3 nM 9.52
CHEMBL3355074 IC50 = 0.4 nM 9.40
CHEMBL3355069 IC50 = 0.5 nM 9.30
CHEMBL3355071 IC50 = 0.5 nM 9.30
CHEMBL3355070 IC50 = 1.0 nM 9.00
CHEMBL3355073 IC50 = 1.0 nM 9.00
CHEMBL3352844 IC50 = 2.0 nM 8.70
CHEMBL3355068 IC50 = 26.0 nM 7.58
CHEMBL3355075 IC50 = 29.0 nM 7.54
CHEMBL3355079 IC50 = 41.0 nM 7.39
CHEMBL3355080 IC50 = 64.0 nM 7.19
CHEMBL3355076 IC50 = 440.0 nM 6.36
CHEMBL3355078 IC50 = 2100.0 nM 5.68
CHEMBL3355077 IC50 = 6200.0 nM 5.21