Assay Detail
Binding
CHEMBL829454
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Inhibitory concentration against Pneumocystis carinii DHFR
23
Total Activities
23
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Pneumocystis carinii |
| Confidence | 9 — Direct single protein target |
| Curated By | Expert |
Publication
Design, synthesis, and antifolate activity of new analogues of piritrexim and other diaminopyrimidine dihydrofolate reductase inhibitors with omega-carboxyalkoxy or omega-carboxy-1-alkynyl substitution in the side chain.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 23 | 8.20 | 10.01 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL190650 | — | — | 1 | 10.01 |
| CHEMBL190486 | — | — | 1 | 9.77 |
| CHEMBL189952 | — | — | 1 | 9.37 |
| CHEMBL190199 | — | — | 1 | 9.29 |
| CHEMBL370239 | — | — | 1 | 9.19 |
| CHEMBL300419 | — | — | 1 | 9.00 |
| CHEMBL187595 | — | — | 1 | 8.92 |
| CHEMBL188540 | — | — | 1 | 8.89 |
| CHEMBL425893 | — | — | 1 | 8.85 |
| CHEMBL192835 | — | — | 1 | 8.74 |
| CHEMBL190026 | — | — | 1 | 8.42 |
| CHEMBL187570 | — | — | 1 | 8.24 |
| CHEMBL189796 | — | — | 1 | 8.19 |
| CHEMBL190807 | — | — | 1 | 8.03 |
| CHEMBL189012 | — | — | 1 | 7.92 |
| CHEMBL7492 | PIRITREXIM | 2.0 | 1 | 7.89 |
| CHEMBL189953 | — | — | 1 | 7.55 |
| CHEMBL435938 | — | — | 1 | 7.46 |
| CHEMBL191071 | — | — | 1 | 7.15 |
| CHEMBL190935 | — | — | 1 | 7.08 |
| CHEMBL190340 | — | — | 1 | 7.02 |
| CHEMBL189369 | — | — | 1 | 6.64 |
| CHEMBL22 | TRIMETHOPRIM | 4.0 | 1 | 4.89 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL190650 | — | IC50 | = | 0.097 | nM | 10.01 |
| CHEMBL190486 | — | IC50 | = | 0.17 | nM | 9.77 |
| CHEMBL189952 | — | IC50 | = | 0.43 | nM | 9.37 |
| CHEMBL190199 | — | IC50 | = | 0.51 | nM | 9.29 |
| CHEMBL370239 | — | IC50 | = | 0.65 | nM | 9.19 |
| CHEMBL300419 | — | IC50 | = | 1.0 | nM | 9.00 |
| CHEMBL187595 | — | IC50 | = | 1.2 | nM | 8.92 |
| CHEMBL188540 | — | IC50 | = | 1.3 | nM | 8.89 |
| CHEMBL425893 | — | IC50 | = | 1.4 | nM | 8.85 |
| CHEMBL192835 | — | IC50 | = | 1.8 | nM | 8.74 |
| CHEMBL190026 | — | IC50 | = | 3.8 | nM | 8.42 |
| CHEMBL187570 | — | IC50 | = | 5.8 | nM | 8.24 |
| CHEMBL189796 | — | IC50 | = | 6.5 | nM | 8.19 |
| CHEMBL190807 | — | IC50 | = | 9.4 | nM | 8.03 |
| CHEMBL189012 | — | IC50 | = | 12.0 | nM | 7.92 |
| CHEMBL7492 | PIRITREXIM | IC50 | = | 13.0 | nM | 7.89 |
| CHEMBL189953 | — | IC50 | = | 28.0 | nM | 7.55 |
| CHEMBL435938 | — | IC50 | = | 35.0 | nM | 7.46 |
| CHEMBL191071 | — | IC50 | = | 71.0 | nM | 7.15 |
| CHEMBL190935 | — | IC50 | = | 83.0 | nM | 7.08 |
| CHEMBL190340 | — | IC50 | = | 96.0 | nM | 7.02 |
| CHEMBL189369 | — | IC50 | = | 230.0 | nM | 6.64 |
| CHEMBL22 | TRIMETHOPRIM | IC50 | = | 13000.0 | nM | 4.89 |