Assay Detail
Binding
CHEMBL4339319
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of recombinant C-terminal 6xHis-tagged MTH1 (3 to 156 residues) (unknown origin) expressed in Escherichia coli BL21(DE3) cells using dGTP as substrate measured after 30 mins by malachite green dye based inorganic phosphatase coupled absorbance assay
12
Total Activities
12
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
Oxidized purine nucleoside triphosphate hydrolase (CHEMBL3708265) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Discovery of a new class of MTH1 inhibitor by X-ray crystallographic screening.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 12 | 5.89 | 7.70 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3781316 | — | — | 1 | 7.70 |
| CHEMBL464119 | — | — | 1 | 7.28 |
| CHEMBL323197 | MANGOSTIN | — | 1 | 6.33 |
| CHEMBL506229 | — | — | 1 | 5.77 |
| CHEMBL1825141 | — | — | 1 | 5.75 |
| CHEMBL260553 | — | — | 1 | 5.70 |
| CHEMBL4440642 | — | — | 1 | 5.57 |
| CHEMBL488606 | 8-DEOXYGARTANIN | — | 1 | 4.70 |
| CHEMBL477921 | — | — | 1 | 4.24 |
| CHEMBL4094195 | — | — | 1 | - |
| CHEMBL187265 | — | — | 1 | - |
| CHEMBL464825 | MANGIFERIN | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3781316 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL464119 | — | IC50 | = | 52.0 | nM | 7.28 |
| CHEMBL323197 | MANGOSTIN | IC50 | = | 470.0 | nM | 6.33 |
| CHEMBL506229 | — | IC50 | = | 1700.0 | nM | 5.77 |
| CHEMBL1825141 | — | IC50 | = | 1800.0 | nM | 5.75 |
| CHEMBL260553 | — | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL4440642 | — | IC50 | = | 2700.0 | nM | 5.57 |
| CHEMBL488606 | 8-DEOXYGARTANIN | IC50 | = | 20000.0 | nM | 4.70 |
| CHEMBL477921 | — | IC50 | = | 57000.0 | nM | 4.24 |
| CHEMBL4094195 | — | IC50 | - | — | - | |
| CHEMBL187265 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL464825 | MANGIFERIN | IC50 | - | — | - |