Assay Detail
Binding
CHEMBL821378
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Evaluated for inhibition constant (Ki wt) against Wild-type dihydrofolate reductase of Plasmodium falciparum
31
Total Activities
31
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Plasmodium falciparum |
| Confidence | 8 — Homologous single protein target |
| Curated By | Intermediate |
Target
Bifunctional dihydrofolate reductase-thymidylate synthase (CHEMBL1939) ↗| Type | SINGLE PROTEIN |
| Organism | Plasmodium falciparum K1 |
Publication
Development of a lead inhibitor for the A16V+S108T mutant of dihydrofolate reductase from the cycloguanil-resistant strain (T9/94) of Plasmodium falciparum.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 31 | 8.02 | 8.96 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL92583 | CHLORCYCLOGUANIL | — | 1 | 8.96 |
| CHEMBL6741 | — | — | 1 | 8.96 |
| CHEMBL93153 | — | — | 1 | 8.85 |
| CHEMBL747 | CYCLOGUANIL | 2.0 | 1 | 8.82 |
| CHEMBL93974 | — | — | 1 | 8.80 |
| CHEMBL7004 | — | — | 1 | 8.74 |
| CHEMBL93888 | — | — | 1 | 8.59 |
| CHEMBL93893 | — | — | 1 | 8.54 |
| CHEMBL92047 | — | — | 1 | 8.44 |
| CHEMBL7130 | — | — | 1 | 8.43 |
| CHEMBL90292 | — | — | 1 | 8.43 |
| CHEMBL93484 | — | — | 1 | 8.39 |
| CHEMBL93889 | — | — | 1 | 8.35 |
| CHEMBL90703 | — | — | 1 | 8.34 |
| CHEMBL7005 | — | — | 1 | 8.34 |
| CHEMBL93748 | — | — | 1 | 8.24 |
| CHEMBL90461 | — | — | 1 | 8.24 |
| CHEMBL89959 | — | — | 1 | 8.23 |
| CHEMBL91345 | — | — | 1 | 8.11 |
| CHEMBL13636 | — | — | 1 | 7.99 |
| CHEMBL329687 | — | — | 1 | 7.93 |
| CHEMBL443013 | — | — | 1 | 7.86 |
| CHEMBL6742 | — | — | 1 | 7.70 |
| CHEMBL92182 | — | — | 1 | 7.64 |
| CHEMBL90018 | — | — | 1 | 7.61 |
| CHEMBL94281 | — | — | 1 | 7.52 |
| CHEMBL264392 | — | — | 1 | 7.22 |
| CHEMBL90358 | — | — | 1 | 6.78 |
| CHEMBL93001 | — | — | 1 | 6.57 |
| CHEMBL92846 | — | — | 1 | 6.48 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL92583 | CHLORCYCLOGUANIL | Ki | = | 1.1 | nM | 8.96 |
| CHEMBL6741 | — | Ki | = | 1.1 | nM | 8.96 |
| CHEMBL93153 | — | Ki | = | 1.4 | nM | 8.85 |
| CHEMBL747 | CYCLOGUANIL | Ki | = | 1.5 | nM | 8.82 |
| CHEMBL93974 | — | Ki | = | 1.6 | nM | 8.80 |
| CHEMBL7004 | — | Ki | = | 1.8 | nM | 8.74 |
| CHEMBL93888 | — | Ki | = | 2.6 | nM | 8.59 |
| CHEMBL93893 | — | Ki | = | 2.9 | nM | 8.54 |
| CHEMBL92047 | — | Ki | = | 3.6 | nM | 8.44 |
| CHEMBL7130 | — | Ki | = | 3.7 | nM | 8.43 |
| CHEMBL90292 | — | Ki | = | 3.7 | nM | 8.43 |
| CHEMBL93484 | — | Ki | = | 4.1 | nM | 8.39 |
| CHEMBL93889 | — | Ki | = | 4.5 | nM | 8.35 |
| CHEMBL90703 | — | Ki | = | 4.6 | nM | 8.34 |
| CHEMBL7005 | — | Ki | = | 4.6 | nM | 8.34 |
| CHEMBL93748 | — | Ki | = | 5.7 | nM | 8.24 |
| CHEMBL90461 | — | Ki | = | 5.7 | nM | 8.24 |
| CHEMBL89959 | — | Ki | = | 5.9 | nM | 8.23 |
| CHEMBL91345 | — | Ki | = | 7.7 | nM | 8.11 |
| CHEMBL13636 | — | Ki | = | 10.2 | nM | 7.99 |
| CHEMBL329687 | — | Ki | = | 11.7 | nM | 7.93 |
| CHEMBL443013 | — | Ki | = | 13.7 | nM | 7.86 |
| CHEMBL6742 | — | Ki | = | 20.0 | nM | 7.70 |
| CHEMBL92182 | — | Ki | = | 23.0 | nM | 7.64 |
| CHEMBL90018 | — | Ki | = | 24.4 | nM | 7.61 |
| CHEMBL94281 | — | Ki | = | 30.0 | nM | 7.52 |
| CHEMBL264392 | — | Ki | = | 60.5 | nM | 7.22 |
| CHEMBL90358 | — | Ki | = | 167.0 | nM | 6.78 |
| CHEMBL93001 | — | Ki | = | 270.0 | nM | 6.57 |
| CHEMBL92846 | — | Ki | = | 329.0 | nM | 6.48 |
| CHEMBL433204 | — | Ki | = | 3838.0 | nM | 5.42 |