Assay Detail
Binding
CHEMBL814568
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of Thymidylate synthase of Escherichia coli (Ki)
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Escherichia coli |
| Confidence | 9 — Direct single protein target |
| Curated By | Intermediate |
Publication
Design of enzyme inhibitors using iterative protein crystallographic analysis.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 14 | 6.53 | 8.52 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL422395 | — | — | 1 | 8.52 |
| CHEMBL25889 | — | — | 1 | 8.32 |
| CHEMBL417222 | — | — | 1 | 7.60 |
| CHEMBL291548 | — | — | 1 | 7.43 |
| CHEMBL301256 | — | — | 1 | 7.37 |
| CHEMBL56662 | — | — | 1 | 6.85 |
| CHEMBL299928 | — | — | 1 | 6.82 |
| CHEMBL301423 | — | — | 1 | 6.35 |
| CHEMBL275685 | — | — | 1 | 5.82 |
| CHEMBL57333 | — | — | 1 | 5.40 |
| CHEMBL353700 | — | — | 1 | 5.31 |
| CHEMBL57002 | — | — | 1 | 4.68 |
| CHEMBL56992 | — | — | 1 | 4.42 |
| CHEMBL301844 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL422395 | — | Ki | = | 3.0 | nM | 8.52 |
| CHEMBL25889 | — | Ki | = | 4.8 | nM | 8.32 |
| CHEMBL417222 | — | Ki | = | 25.0 | nM | 7.60 |
| CHEMBL291548 | — | Ki | = | 37.0 | nM | 7.43 |
| CHEMBL301256 | — | Ki | = | 43.0 | nM | 7.37 |
| CHEMBL56662 | — | Ki | = | 140.0 | nM | 6.85 |
| CHEMBL299928 | — | Ki | = | 150.0 | nM | 6.82 |
| CHEMBL301423 | — | Ki | = | 450.0 | nM | 6.35 |
| CHEMBL275685 | — | Ki | = | 1500.0 | nM | 5.82 |
| CHEMBL57333 | — | Ki | = | 4000.0 | nM | 5.40 |
| CHEMBL353700 | — | Ki | = | 4900.0 | nM | 5.31 |
| CHEMBL57002 | — | Ki | = | 21000.0 | nM | 4.68 |
| CHEMBL56992 | — | Ki | = | 38000.0 | nM | 4.42 |
| CHEMBL301844 | — | Ki | > | 1000.0 | nM | - |