Assay Detail
Binding
CHEMBL5550826
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Inhibition of HCoV-NL63 main protease using Dabcyl-YNSTLQSGLKKM-(Edans) as substrate preincubated for 30 mins followed by substrate addition and measured after 60 mins by fluorescence based Spectramax M2e microplate reader based analysis
5
Total Activities
5
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Human coronavirus NL63 |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Exploiting high-energy hydration sites for the discovery of potent peptide aldehyde inhibitors of the SARS-CoV-2 main protease with cellular antiviral activity.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 5 | 7.08 | 7.43 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5565685 | — | — | 1 | 7.43 |
| CHEMBL5570210 | — | — | 1 | 7.40 |
| CHEMBL5595277 | — | — | 1 | 7.27 |
| CHEMBL5565858 | — | — | 1 | 6.75 |
| CHEMBL4802135 | NIRMATRELVIR | 4.0 | 1 | 6.55 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5565685 | — | IC50 | = | 37.0 | nM | 7.43 |
| CHEMBL5570210 | — | IC50 | = | 40.0 | nM | 7.40 |
| CHEMBL5595277 | — | IC50 | = | 54.0 | nM | 7.27 |
| CHEMBL5565858 | — | IC50 | = | 180.0 | nM | 6.75 |
| CHEMBL4802135 | NIRMATRELVIR | IC50 | = | 280.0 | nM | 6.55 |