Assay Detail
Binding
CHEMBL927299
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Inhibition of SARS-CoV Mpro
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Severe acute respiratory syndrome-related coronavirus |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Molecular docking identifies the binding of 3-chloropyridine moieties specifically to the S1 pocket of SARS-CoV Mpro.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 13 | 6.65 | 7.22 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL398437 | — | — | 1 | 7.22 |
| CHEMBL222769 | — | — | 1 | 7.20 |
| CHEMBL334399 | — | — | 1 | 6.97 |
| CHEMBL253905 | — | — | 1 | 6.91 |
| CHEMBL403932 | — | — | 1 | 6.91 |
| CHEMBL254103 | — | — | 1 | 6.79 |
| CHEMBL402379 | — | — | 1 | 6.68 |
| CHEMBL252662 | — | — | 1 | 6.48 |
| CHEMBL252661 | — | — | 1 | 6.36 |
| CHEMBL253906 | — | — | 1 | 6.30 |
| CHEMBL253685 | — | — | 1 | 6.30 |
| CHEMBL252663 | — | — | 1 | 6.17 |
| CHEMBL252660 | — | — | 1 | 6.16 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL398437 | — | IC50 | = | 60.0 | nM | 7.22 |
| CHEMBL222769 | — | IC50 | = | 63.0 | nM | 7.20 |
| CHEMBL334399 | — | IC50 | = | 108.0 | nM | 6.97 |
| CHEMBL253905 | — | IC50 | = | 122.0 | nM | 6.91 |
| CHEMBL403932 | — | IC50 | = | 124.0 | nM | 6.91 |
| CHEMBL254103 | — | IC50 | = | 164.0 | nM | 6.79 |
| CHEMBL402379 | — | IC50 | = | 208.0 | nM | 6.68 |
| CHEMBL252662 | — | IC50 | = | 333.0 | nM | 6.48 |
| CHEMBL252661 | — | IC50 | = | 434.0 | nM | 6.36 |
| CHEMBL253906 | — | IC50 | = | 500.0 | nM | 6.30 |
| CHEMBL253685 | — | IC50 | = | 500.0 | nM | 6.30 |
| CHEMBL252663 | — | IC50 | = | 684.0 | nM | 6.17 |
| CHEMBL252660 | — | IC50 | = | 697.0 | nM | 6.16 |