Assay Detail
Binding
CHEMBL665053
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In vitro inhibitory concentration against Pneumocystis carinii dihydrofolate reductase
34
Total Activities
34
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Pneumocystis carinii |
| Confidence | 9 — Direct single protein target |
| Curated By | Intermediate |
Publication
Structural studies on bioactive compounds. 28. Selective activity of triazenyl-substituted pyrimethamine derivatives against Pneumocystis carinii dihydrofolate reductase.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 34 | 5.56 | 7.38 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL119 | TRIMETREXATE | 4.0 | 1 | 7.38 |
| CHEMBL55764 | — | — | 1 | 6.77 |
| CHEMBL57222 | — | — | 1 | 6.72 |
| CHEMBL298538 | — | — | 1 | 6.58 |
| CHEMBL440479 | — | — | 1 | 6.36 |
| CHEMBL54659 | — | — | 1 | 6.24 |
| CHEMBL59530 | — | — | 1 | 6.07 |
| CHEMBL298819 | — | — | 1 | 6.04 |
| CHEMBL299045 | — | — | 1 | 5.88 |
| CHEMBL56170 | — | — | 1 | 5.80 |
| CHEMBL48203 | — | — | 1 | 5.77 |
| CHEMBL55584 | — | — | 1 | 5.60 |
| CHEMBL49246 | — | — | 1 | 5.55 |
| CHEMBL56862 | — | — | 1 | 5.55 |
| CHEMBL56532 | — | — | 1 | 5.48 |
| CHEMBL56709 | — | — | 1 | 5.46 |
| CHEMBL36 | PYRIMETHAMINE | 4.0 | 1 | 5.44 |
| CHEMBL53902 | — | — | 1 | 5.34 |
| CHEMBL293265 | — | — | 1 | 5.33 |
| CHEMBL54007 | — | — | 1 | 5.31 |
| CHEMBL55903 | — | — | 1 | 5.30 |
| CHEMBL56311 | — | — | 1 | 5.22 |
| CHEMBL57610 | — | — | 1 | 5.18 |
| CHEMBL293822 | — | — | 1 | 5.12 |
| CHEMBL413323 | — | — | 1 | 5.07 |
| CHEMBL294468 | — | — | 1 | 4.99 |
| CHEMBL55526 | — | — | 1 | 4.97 |
| CHEMBL56456 | — | — | 1 | 4.94 |
| CHEMBL56169 | — | — | 1 | 4.85 |
| CHEMBL56861 | — | — | 1 | 4.74 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL119 | TRIMETREXATE | IC50 | = | 42.0 | nM | 7.38 |
| CHEMBL55764 | — | IC50 | = | 170.0 | nM | 6.77 |
| CHEMBL57222 | — | IC50 | = | 190.0 | nM | 6.72 |
| CHEMBL298538 | — | IC50 | = | 260.0 | nM | 6.58 |
| CHEMBL440479 | — | IC50 | = | 440.0 | nM | 6.36 |
| CHEMBL54659 | — | IC50 | = | 570.0 | nM | 6.24 |
| CHEMBL59530 | — | IC50 | = | 850.0 | nM | 6.07 |
| CHEMBL298819 | — | IC50 | = | 910.0 | nM | 6.04 |
| CHEMBL299045 | — | IC50 | = | 1330.0 | nM | 5.88 |
| CHEMBL56170 | — | IC50 | = | 1600.0 | nM | 5.80 |
| CHEMBL48203 | — | IC50 | = | 1700.0 | nM | 5.77 |
| CHEMBL55584 | — | IC50 | = | 2500.0 | nM | 5.60 |
| CHEMBL49246 | — | IC50 | = | 2800.0 | nM | 5.55 |
| CHEMBL56862 | — | IC50 | = | 2800.0 | nM | 5.55 |
| CHEMBL56532 | — | IC50 | = | 3300.0 | nM | 5.48 |
| CHEMBL56709 | — | IC50 | = | 3500.0 | nM | 5.46 |
| CHEMBL36 | PYRIMETHAMINE | IC50 | = | 3650.0 | nM | 5.44 |
| CHEMBL53902 | — | IC50 | = | 4600.0 | nM | 5.34 |
| CHEMBL293265 | — | IC50 | = | 4700.0 | nM | 5.33 |
| CHEMBL54007 | — | IC50 | = | 4900.0 | nM | 5.31 |
| CHEMBL55903 | — | IC50 | = | 5000.0 | nM | 5.30 |
| CHEMBL56311 | — | IC50 | = | 6000.0 | nM | 5.22 |
| CHEMBL57610 | — | IC50 | = | 6600.0 | nM | 5.18 |
| CHEMBL293822 | — | IC50 | = | 7600.0 | nM | 5.12 |
| CHEMBL413323 | — | IC50 | = | 8500.0 | nM | 5.07 |
| CHEMBL294468 | — | IC50 | = | 10200.0 | nM | 4.99 |
| CHEMBL55526 | — | IC50 | = | 10600.0 | nM | 4.97 |
| CHEMBL56456 | — | IC50 | = | 11500.0 | nM | 4.94 |
| CHEMBL56169 | — | IC50 | = | 14100.0 | nM | 4.85 |
| CHEMBL56861 | — | IC50 | = | 18200.0 | nM | 4.74 |
| CHEMBL300876 | — | IC50 | = | 29300.0 | nM | 4.53 |
| CHEMBL293321 | — | IC50 | = | 40400.0 | nM | 4.39 |
| CHEMBL55697 | — | IC50 | > | 11000.0 | nM | - |
| CHEMBL56366 | — | IC50 | > | 11000.0 | nM | - |