Assay Detail
Binding
CHEMBL2185822
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Inhibition of Leishmania major PTR1 by spectrophotometric assay
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Leishmania |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Publication
Structure-based selectivity optimization of piperidine-pteridine derivatives as potent Leishmania pteridine reductase inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 10 | 6.85 | 7.52 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL2178602 | — | — | 1 | 7.52 |
| CHEMBL1232702 | — | — | 1 | 7.43 |
| CHEMBL2178603 | — | — | 1 | 7.22 |
| CHEMBL2177120 | — | — | 1 | 7.11 |
| CHEMBL2178601 | — | — | 1 | 7.00 |
| CHEMBL1232399 | — | — | 1 | 7.00 |
| CHEMBL34259 | METHOTREXATE | 4.0 | 1 | 6.75 |
| CHEMBL2178600 | — | — | 1 | 6.68 |
| CHEMBL2178599 | — | — | 1 | 6.41 |
| CHEMBL2178604 | — | — | 1 | 5.38 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL2178602 | — | Ki | = | 30.0 | nM | 7.52 |
| CHEMBL1232702 | — | Ki | = | 37.0 | nM | 7.43 |
| CHEMBL2178603 | — | Ki | = | 60.0 | nM | 7.22 |
| CHEMBL2177120 | — | Ki | = | 78.0 | nM | 7.11 |
| CHEMBL2178601 | — | Ki | = | 100.0 | nM | 7.00 |
| CHEMBL1232399 | — | Ki | = | 100.0 | nM | 7.00 |
| CHEMBL34259 | METHOTREXATE | Ki | = | 180.0 | nM | 6.75 |
| CHEMBL2178600 | — | Ki | = | 210.0 | nM | 6.68 |
| CHEMBL2178599 | — | Ki | = | 390.0 | nM | 6.41 |
| CHEMBL2178604 | — | Ki | = | 4170.0 | nM | 5.38 |