Assay Detail
Binding
CHEMBL986430
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Inhibition of Mycobacterium avium 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 | Mycobacterium avium |
| Confidence | 0 — Uncurated / Unknown |
| 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 | 6.31 | 9.41 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL476751 | — | — | 1 | 9.41 |
| CHEMBL476548 | — | — | 1 | 9.13 |
| CHEMBL119 | TRIMETREXATE | 4.0 | 1 | 8.82 |
| CHEMBL331986 | — | — | 1 | 7.00 |
| CHEMBL227009 | — | — | 1 | 6.98 |
| CHEMBL476745 | — | — | 1 | 6.68 |
| CHEMBL476945 | — | — | 1 | 6.62 |
| CHEMBL22 | TRIMETHOPRIM | 4.0 | 1 | 6.52 |
| CHEMBL478403 | — | — | 1 | 6.43 |
| CHEMBL476744 | — | — | 1 | 6.22 |
| CHEMBL477790 | — | — | 1 | 6.20 |
| CHEMBL389686 | — | — | 1 | 6.06 |
| CHEMBL477151 | — | — | 1 | 5.94 |
| CHEMBL516891 | — | — | 1 | 5.88 |
| CHEMBL516128 | — | — | 1 | 5.68 |
| CHEMBL477150 | — | — | 1 | 5.59 |
| CHEMBL478191 | — | — | 1 | 5.57 |
| CHEMBL477566 | — | — | 1 | 5.47 |
| CHEMBL515312 | — | — | 1 | 5.39 |
| CHEMBL478213 | — | — | 1 | 5.11 |
| CHEMBL477789 | — | — | 1 | 4.98 |
| CHEMBL514219 | — | — | 1 | 4.91 |
| CHEMBL478192 | — | — | 1 | 4.54 |
| CHEMBL478404 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL476751 | — | IC50 | = | 0.391 | nM | 9.41 |
| CHEMBL476548 | — | IC50 | = | 0.737 | nM | 9.13 |
| CHEMBL119 | TRIMETREXATE | IC50 | = | 1.5 | nM | 8.82 |
| CHEMBL331986 | — | IC50 | = | 100.0 | nM | 7.00 |
| CHEMBL227009 | — | IC50 | = | 104.3 | nM | 6.98 |
| CHEMBL476745 | — | IC50 | = | 210.0 | nM | 6.68 |
| CHEMBL476945 | — | IC50 | = | 240.0 | nM | 6.62 |
| CHEMBL22 | TRIMETHOPRIM | IC50 | = | 300.0 | nM | 6.52 |
| CHEMBL478403 | — | IC50 | = | 368.7 | nM | 6.43 |
| CHEMBL476744 | — | IC50 | = | 600.0 | nM | 6.22 |
| CHEMBL477790 | — | IC50 | = | 630.0 | nM | 6.20 |
| CHEMBL389686 | — | IC50 | = | 880.0 | nM | 6.06 |
| CHEMBL477151 | — | IC50 | = | 1140.0 | nM | 5.94 |
| CHEMBL516891 | — | IC50 | = | 1310.0 | nM | 5.88 |
| CHEMBL516128 | — | IC50 | = | 2100.0 | nM | 5.68 |
| CHEMBL477150 | — | IC50 | = | 2540.0 | nM | 5.59 |
| CHEMBL478191 | — | IC50 | = | 2700.0 | nM | 5.57 |
| CHEMBL477566 | — | IC50 | = | 3400.0 | nM | 5.47 |
| CHEMBL515312 | — | IC50 | = | 4100.0 | nM | 5.39 |
| CHEMBL478213 | — | IC50 | = | 7800.0 | nM | 5.11 |
| CHEMBL477789 | — | IC50 | = | 10400.0 | nM | 4.98 |
| CHEMBL514219 | — | IC50 | = | 12300.0 | nM | 4.91 |
| CHEMBL478192 | — | IC50 | = | 28600.0 | nM | 4.54 |
| CHEMBL478404 | — | IC50 | - | — | - |