Assay Detail
Binding
CHEMBL873889
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Compound was evaluated as inhibitor of Lactobacillus casei thymidylate synthase
5
Total Activities
5
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Lacticaseibacillus casei |
| Confidence | 9 — Direct single protein target |
| Curated By | Intermediate |
Publication
Design, synthesis, and biological activities of classical N-[4-[2-(2-amino-4-ethylpyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-l-glutamic acid and its 6-methyl derivative as potential dual inhibitors of thymidylate synthase and dihydrofolate reductase and as potential antitumor agents.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 5 | 5.53 | 7.26 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL389051 | — | — | 1 | 7.26 |
| CHEMBL225071 | RALTITREXED | 4.0 | 1 | 5.10 |
| CHEMBL439973 | — | — | 1 | 5.05 |
| CHEMBL225072 | PEMETREXED | 4.0 | 1 | 4.70 |
| CHEMBL154935 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL389051 | — | IC50 | = | 55.0 | nM | 7.26 |
| CHEMBL225071 | RALTITREXED | IC50 | = | 8000.0 | nM | 5.10 |
| CHEMBL439973 | — | IC50 | = | 9000.0 | nM | 5.05 |
| CHEMBL225072 | PEMETREXED | IC50 | = | 20000.0 | nM | 4.70 |
| CHEMBL154935 | — | IC50 | > | 100000.0 | nM | - |