Assay Detail
Binding
CHEMBL986428
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Inhibition of rat liver DHFR using dihydrofolic acid substrate and NADPH cofactor
24
Total Activities
24
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Rattus norvegicus |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
The effect of 5-alkyl modification on the biological activity of pyrrolo[2,3-d]pyrimidine containing classical and nonclassical antifolates as inhibitors of dihydrofolate reductase and as antitumor and/or antiopportunistic infection agents.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 24 | 5.67 | 8.52 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL119 | TRIMETREXATE | 4.0 | 1 | 8.52 |
| CHEMBL476548 | — | — | 1 | 7.22 |
| CHEMBL476751 | — | — | 1 | 6.73 |
| CHEMBL476945 | — | — | 1 | 6.04 |
| CHEMBL516891 | — | — | 1 | 5.90 |
| CHEMBL477790 | — | — | 1 | 5.90 |
| CHEMBL478404 | — | — | 1 | 5.72 |
| CHEMBL478403 | — | — | 1 | 5.70 |
| CHEMBL477150 | — | — | 1 | 5.68 |
| CHEMBL478191 | — | — | 1 | 5.62 |
| CHEMBL477789 | — | — | 1 | 5.61 |
| CHEMBL476745 | — | — | 1 | 5.46 |
| CHEMBL478213 | — | — | 1 | 5.42 |
| CHEMBL477566 | — | — | 1 | 5.34 |
| CHEMBL389686 | — | — | 1 | 5.25 |
| CHEMBL514219 | — | — | 1 | 5.22 |
| CHEMBL515312 | — | — | 1 | 5.19 |
| CHEMBL331986 | — | — | 1 | 5.11 |
| CHEMBL476744 | — | — | 1 | 5.05 |
| CHEMBL477151 | — | — | 1 | 4.87 |
| CHEMBL478192 | — | — | 1 | 4.83 |
| CHEMBL516128 | — | — | 1 | 4.30 |
| CHEMBL227009 | — | — | 1 | - |
| CHEMBL22 | TRIMETHOPRIM | 4.0 | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL119 | TRIMETREXATE | IC50 | = | 3.0 | nM | 8.52 |
| CHEMBL476548 | — | IC50 | = | 60.0 | nM | 7.22 |
| CHEMBL476751 | — | IC50 | = | 186.0 | nM | 6.73 |
| CHEMBL476945 | — | IC50 | = | 910.0 | nM | 6.04 |
| CHEMBL516891 | — | IC50 | = | 1250.0 | nM | 5.90 |
| CHEMBL477790 | — | IC50 | = | 1250.0 | nM | 5.90 |
| CHEMBL478404 | — | IC50 | = | 1900.0 | nM | 5.72 |
| CHEMBL478403 | — | IC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL477150 | — | IC50 | = | 2100.0 | nM | 5.68 |
| CHEMBL478191 | — | IC50 | = | 2400.0 | nM | 5.62 |
| CHEMBL477789 | — | IC50 | = | 2430.0 | nM | 5.61 |
| CHEMBL476745 | — | IC50 | = | 3450.0 | nM | 5.46 |
| CHEMBL478213 | — | IC50 | = | 3800.0 | nM | 5.42 |
| CHEMBL477566 | — | IC50 | = | 4600.0 | nM | 5.34 |
| CHEMBL389686 | — | IC50 | = | 5600.0 | nM | 5.25 |
| CHEMBL514219 | — | IC50 | = | 5950.0 | nM | 5.22 |
| CHEMBL515312 | — | IC50 | = | 6500.0 | nM | 5.19 |
| CHEMBL331986 | — | IC50 | = | 7800.0 | nM | 5.11 |
| CHEMBL476744 | — | IC50 | = | 8900.0 | nM | 5.05 |
| CHEMBL477151 | — | IC50 | = | 13500.0 | nM | 4.87 |
| CHEMBL478192 | — | IC50 | = | 14800.0 | nM | 4.83 |
| CHEMBL516128 | — | IC50 | = | 50300.0 | nM | 4.30 |
| CHEMBL227009 | — | IC50 | = | 4050.0 | nM | - |
| CHEMBL22 | TRIMETHOPRIM | IC50 | = | 180000.0 | nM | - |