Assay Detail
Binding
CHEMBL5330612
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of SARS-CoV-2 MPro using protease substrate preincubated with enzyme for 10 mins followed by substrate addition and measured after 5 mins by FRET based assay
12
Total Activities
12
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
Identification of Ebselen derivatives as novel SARS-CoV-2 main protease inhibitors: Design, synthesis, biological evaluation, and structure-activity relationships exploration.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 12 | 6.43 | 6.63 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5409716 | — | — | 1 | 6.63 |
| CHEMBL5398922 | — | — | 1 | 6.57 |
| CHEMBL5411764 | — | — | 1 | 6.54 |
| CHEMBL5395762 | — | — | 1 | 6.49 |
| CHEMBL51085 | EBSELEN | 3.0 | 1 | 6.47 |
| CHEMBL5394951 | — | — | 1 | 6.45 |
| CHEMBL3920474 | — | — | 1 | 6.44 |
| CHEMBL5434494 | — | — | 1 | 6.38 |
| CHEMBL5403838 | — | — | 1 | 6.34 |
| CHEMBL5438913 | — | — | 1 | 6.31 |
| CHEMBL5418023 | — | — | 1 | 6.28 |
| CHEMBL5426830 | — | — | 1 | 6.26 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5409716 | — | IC50 | = | 233.0 | nM | 6.63 |
| CHEMBL5398922 | — | IC50 | = | 268.0 | nM | 6.57 |
| CHEMBL5411764 | — | IC50 | = | 287.0 | nM | 6.54 |
| CHEMBL5395762 | — | IC50 | = | 322.0 | nM | 6.49 |
| CHEMBL51085 | EBSELEN | IC50 | = | 339.0 | nM | 6.47 |
| CHEMBL5394951 | — | IC50 | = | 356.0 | nM | 6.45 |
| CHEMBL3920474 | — | IC50 | = | 364.0 | nM | 6.44 |
| CHEMBL5434494 | — | IC50 | = | 417.0 | nM | 6.38 |
| CHEMBL5403838 | — | IC50 | = | 459.0 | nM | 6.34 |
| CHEMBL5438913 | — | IC50 | = | 490.0 | nM | 6.31 |
| CHEMBL5418023 | — | IC50 | = | 528.0 | nM | 6.28 |
| CHEMBL5426830 | — | IC50 | = | 550.0 | nM | 6.26 |