Assay Detail
Binding
CHEMBL4352755
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of ATR in human HCT116 cells assessed as reduction in histone H2AX phosphorylation by Hoechst staining-based immunofluorescence microscopic analysis
18
Total Activities
18
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 |
Publication
Rational Design of 5-(4-(Isopropylsulfonyl)phenyl)-3-(3-(4-((methylamino)methyl)phenyl)isoxazol-5-yl)pyrazin-2-amine (VX-970, M6620): Optimization of Intra- and Intermolecular Polar Interactions of a New Ataxia Telangiectasia Mutated and Rad3-Related (ATR) Kinase Inhibitor.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 18 | 6.58 | 7.89 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4444602 | — | — | 1 | 7.89 |
| CHEMBL3989870 | BERZOSERTIB | 2.0 | 1 | 7.72 |
| CHEMBL4533440 | — | — | 1 | 7.12 |
| CHEMBL4541587 | — | — | 1 | 6.89 |
| CHEMBL4566104 | — | — | 1 | 6.89 |
| CHEMBL4448538 | — | — | 1 | 6.68 |
| CHEMBL4467848 | — | — | 1 | 6.52 |
| CHEMBL4467820 | — | — | 1 | 6.39 |
| CHEMBL4530813 | — | — | 1 | 6.10 |
| CHEMBL1766793 | — | — | 1 | 5.99 |
| CHEMBL4440048 | — | — | 1 | 5.96 |
| CHEMBL4434665 | — | — | 1 | 5.77 |
| CHEMBL4445532 | — | — | 1 | 5.64 |
| CHEMBL4443525 | — | — | 1 | - |
| CHEMBL2409216 | — | — | 1 | - |
| CHEMBL3695214 | — | — | 1 | - |
| CHEMBL4593939 | — | — | 1 | - |
| CHEMBL4558884 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4444602 | — | IC50 | = | 13.0 | nM | 7.89 |
| CHEMBL3989870 | BERZOSERTIB | IC50 | = | 19.0 | nM | 7.72 |
| CHEMBL4533440 | — | IC50 | = | 76.0 | nM | 7.12 |
| CHEMBL4541587 | — | IC50 | = | 130.0 | nM | 6.89 |
| CHEMBL4566104 | — | IC50 | = | 130.0 | nM | 6.89 |
| CHEMBL4448538 | — | IC50 | = | 210.0 | nM | 6.68 |
| CHEMBL4467848 | — | IC50 | = | 300.0 | nM | 6.52 |
| CHEMBL4467820 | — | IC50 | = | 410.0 | nM | 6.39 |
| CHEMBL4530813 | — | IC50 | = | 800.0 | nM | 6.10 |
| CHEMBL1766793 | — | IC50 | = | 1030.0 | nM | 5.99 |
| CHEMBL4440048 | — | IC50 | = | 1100.0 | nM | 5.96 |
| CHEMBL4434665 | — | IC50 | = | 1700.0 | nM | 5.77 |
| CHEMBL4445532 | — | IC50 | = | 2300.0 | nM | 5.64 |
| CHEMBL4443525 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL2409216 | — | IC50 | > | 2500.0 | nM | - |
| CHEMBL3695214 | — | IC50 | > | 2500.0 | nM | - |
| CHEMBL4593939 | — | IC50 | > | 2500.0 | nM | - |
| CHEMBL4558884 | — | IC50 | > | 2500.0 | nM | - |