Assay Detail
Binding
CHEMBL3412012
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Binding affinity to Leishmania major DHFR
6
Total Activities
6
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Leishmania major |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Bifunctional dihydrofolate reductase-thymidylate synthase (CHEMBL4614) ↗| Type | SINGLE PROTEIN |
| Organism | Leishmania major |
Publication
Antileishmanial activity of quinazoline derivatives: synthesis, docking screens, molecular dynamic simulations and electrochemical studies.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Kd | 6 | 5.57 | 6.62 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3410463 | — | — | 1 | 6.62 |
| CHEMBL3410464 | — | — | 1 | 6.12 |
| CHEMBL174153 | — | — | 1 | 5.99 |
| CHEMBL546890 | — | — | 1 | 5.80 |
| CHEMBL1883668 | — | — | 1 | 4.80 |
| CHEMBL6885 | QUINAZOLINE-2,4,6-TRIAMINE | — | 1 | 4.08 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3410463 | — | Kd | = | 241.0 | nM | 6.62 |
| CHEMBL3410464 | — | Kd | = | 752.0 | nM | 6.12 |
| CHEMBL174153 | — | Kd | = | 1020.0 | nM | 5.99 |
| CHEMBL546890 | — | Kd | = | 1580.0 | nM | 5.80 |
| CHEMBL1883668 | — | Kd | = | 15810.0 | nM | 4.80 |
| CHEMBL6885 | QUINAZOLINE-2,4,6-TRIAMINE | Kd | = | 83980.0 | nM | 4.08 |