Assay Detail
Binding
CHEMBL668875
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In vitro inhibitory concentration against rat liver dihydrofolate reductase
34
Total Activities
34
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Expert |
Publication
Structural studies on bioactive compounds. 8. Synthesis, crystal structure, and biological properties of a new series of 2,4-diamino-5-aryl-6-ethylpyrimidine dihydrofolate reductase inhibitors with in vivo activity against a methotrexate-resistant tumor cell line.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 34 | 6.23 | 8.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL81294 | — | — | 1 | 8.00 |
| CHEMBL56170 | — | — | 1 | 8.00 |
| CHEMBL309743 | — | — | 1 | 7.70 |
| CHEMBL312232 | — | — | 1 | 7.16 |
| CHEMBL310062 | — | — | 1 | 6.82 |
| CHEMBL81493 | — | — | 1 | 6.80 |
| CHEMBL79243 | — | — | 1 | 6.77 |
| CHEMBL312785 | — | — | 1 | 6.75 |
| CHEMBL311439 | — | — | 1 | 6.60 |
| CHEMBL83660 | — | — | 1 | 6.58 |
| CHEMBL311930 | — | — | 1 | 6.42 |
| CHEMBL83883 | — | — | 1 | 6.30 |
| CHEMBL311375 | — | — | 1 | 6.21 |
| CHEMBL84439 | — | — | 1 | 6.00 |
| CHEMBL83164 | — | — | 1 | 5.92 |
| CHEMBL80061 | — | — | 1 | 5.89 |
| CHEMBL36 | PYRIMETHAMINE | 4.0 | 1 | 5.85 |
| CHEMBL84069 | — | — | 1 | 5.80 |
| CHEMBL311293 | — | — | 1 | 5.72 |
| CHEMBL312337 | — | — | 1 | 5.60 |
| CHEMBL84440 | — | — | 1 | 5.58 |
| CHEMBL81019 | — | — | 1 | 5.07 |
| CHEMBL312282 | — | — | 1 | 5.03 |
| CHEMBL421712 | — | — | 1 | 4.82 |
| CHEMBL83991 | — | — | 1 | 4.46 |
| CHEMBL80080 | — | — | 1 | - |
| CHEMBL433156 | — | — | 1 | - |
| CHEMBL84234 | — | — | 1 | - |
| CHEMBL432752 | — | — | 1 | - |
| CHEMBL312407 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL81294 | — | IC50 | = | 10.0 | nM | 8.00 |
| CHEMBL56170 | — | IC50 | = | 10.0 | nM | 8.00 |
| CHEMBL309743 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL312232 | — | IC50 | = | 70.0 | nM | 7.16 |
| CHEMBL310062 | — | IC50 | = | 150.0 | nM | 6.82 |
| CHEMBL81493 | — | IC50 | = | 160.0 | nM | 6.80 |
| CHEMBL79243 | — | IC50 | = | 170.0 | nM | 6.77 |
| CHEMBL312785 | — | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL311439 | — | IC50 | = | 250.0 | nM | 6.60 |
| CHEMBL83660 | — | IC50 | = | 260.0 | nM | 6.58 |
| CHEMBL311930 | — | IC50 | = | 380.0 | nM | 6.42 |
| CHEMBL83883 | — | IC50 | = | 500.0 | nM | 6.30 |
| CHEMBL311375 | — | IC50 | = | 620.0 | nM | 6.21 |
| CHEMBL84439 | — | IC50 | = | 1000.0 | nM | 6.00 |
| CHEMBL83164 | — | IC50 | = | 1200.0 | nM | 5.92 |
| CHEMBL80061 | — | IC50 | = | 1300.0 | nM | 5.89 |
| CHEMBL36 | PYRIMETHAMINE | IC50 | = | 1400.0 | nM | 5.85 |
| CHEMBL84069 | — | IC50 | = | 1600.0 | nM | 5.80 |
| CHEMBL311293 | — | IC50 | = | 1900.0 | nM | 5.72 |
| CHEMBL312337 | — | IC50 | = | 2500.0 | nM | 5.60 |
| CHEMBL84440 | — | IC50 | = | 2600.0 | nM | 5.58 |
| CHEMBL81019 | — | IC50 | = | 8500.0 | nM | 5.07 |
| CHEMBL312282 | — | IC50 | = | 9400.0 | nM | 5.03 |
| CHEMBL421712 | — | IC50 | = | 15000.0 | nM | 4.82 |
| CHEMBL83991 | — | IC50 | = | 35000.0 | nM | 4.46 |
| CHEMBL80080 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL433156 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL84234 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL432752 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL312407 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL315409 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL80051 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL81729 | — | IC50 | > | 25000.0 | nM | - |
| CHEMBL79281 | — | IC50 | > | 25000.0 | nM | - |