Assay Detail
Binding
CHEMBL5250616
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of C-terminal His6-tagged recombinant SARS-CoV-2 MPro transfected in Escherichia coli BL21 (DE3) using Dabcyl-KTSAVLQSGFRKM-E(Edans)-NH2 as substrate preincubated for 15 mins followed by substrate addition measured after 30 mins by FRET assay
10
Total Activities
10
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
Rational design of the zonulin inhibitor AT1001 derivatives as potential anti SARS-CoV-2.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 10 | 5.29 | 5.62 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5287352 | — | — | 1 | 5.62 |
| CHEMBL92708 | CALPEPTIN | — | 1 | 5.61 |
| CHEMBL5286815 | — | — | 1 | 5.60 |
| CHEMBL5291013 | — | — | 1 | 5.19 |
| CHEMBL5279125 | — | — | 1 | 4.42 |
| CHEMBL5281857 | — | — | 1 | - |
| CHEMBL5270591 | — | — | 1 | - |
| CHEMBL5287116 | — | — | 1 | - |
| CHEMBL5291407 | — | — | 1 | - |
| CHEMBL5276189 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5287352 | — | IC50 | = | 2370.0 | nM | 5.62 |
| CHEMBL92708 | CALPEPTIN | IC50 | = | 2430.0 | nM | 5.61 |
| CHEMBL5286815 | — | IC50 | = | 2510.0 | nM | 5.60 |
| CHEMBL5291013 | — | IC50 | = | 6490.0 | nM | 5.19 |
| CHEMBL5279125 | — | IC50 | = | 37840.0 | nM | 4.42 |
| CHEMBL5281857 | — | IC50 | > | 425000.0 | nM | - |
| CHEMBL5270591 | — | IC50 | > | 213000.0 | nM | - |
| CHEMBL5287116 | — | IC50 | > | 425000.0 | nM | - |
| CHEMBL5291407 | — | IC50 | = | 197730.0 | nM | - |
| CHEMBL5276189 | — | IC50 | > | 170000.0 | nM | - |