Assay Detail
Binding
CHEMBL5136659
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of full length SARS CoV-2 main protease expressed in Escherichia coli BL21 (DE3) expression system using Mca-AVLQSGFR-K(Dnp)K as substrate by fluorescence method
2
Total Activities
2
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Severe acute respiratory syndrome coronavirus 2 |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Replicase polyprotein 1ab (CHEMBL4523582) ↗| Type | SINGLE PROTEIN |
| Organism | Severe acute respiratory syndrome coronavirus 2 |
Publication
Small-Molecule Thioesters as SARS-CoV-2 Main Protease Inhibitors: Enzyme Inhibition, Structure-Activity Relationships, Antiviral Activity, and X-ray Structure Determination.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 2 | 5.66 | 5.68 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5190583 | — | — | 1 | 5.68 |
| CHEMBL472940 | — | — | 1 | 5.63 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5190583 | — | IC50 | = | 2080.0 | nM | 5.68 |
| CHEMBL472940 | — | IC50 | = | 2350.0 | nM | 5.63 |