Assay Detail
Binding
CHEMBL5155119
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Inhibition of SARS-CoV-2 3CL protease incubated for 30 mins by FRET assay
19
Total Activities
19
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
Peptidomimetic α-Acyloxymethylketone Warheads with Six-Membered Lactam P1 Glutamine Mimic: SARS-CoV-2 3CL Protease Inhibition, Coronavirus Antiviral Activity, and <i>in Vitro</i> Biological Stability.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 19 | 7.53 | 9.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5191092 | — | — | 1 | 9.00 |
| CHEMBL5190876 | — | — | 1 | 8.40 |
| CHEMBL5191464 | — | — | 1 | 8.19 |
| CHEMBL5206120 | — | — | 1 | 7.90 |
| CHEMBL5173658 | — | — | 1 | 7.85 |
| CHEMBL5189954 | — | — | 1 | 7.77 |
| CHEMBL5191060 | — | — | 1 | 7.72 |
| CHEMBL5195798 | — | — | 1 | 7.71 |
| CHEMBL5198667 | — | — | 1 | 7.70 |
| CHEMBL5194822 | — | — | 1 | 7.66 |
| CHEMBL5171263 | — | — | 1 | 7.66 |
| CHEMBL5192585 | — | — | 1 | 7.48 |
| CHEMBL5193390 | — | — | 1 | 7.20 |
| CHEMBL5179259 | — | — | 1 | 7.19 |
| CHEMBL5195086 | — | — | 1 | 7.15 |
| CHEMBL5190213 | — | — | 1 | 7.06 |
| CHEMBL5187784 | — | — | 1 | 6.90 |
| CHEMBL3427166 | — | — | 1 | 6.72 |
| CHEMBL5182169 | — | — | 1 | 5.82 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5191092 | — | IC50 | = | 1.0 | nM | 9.00 |
| CHEMBL5190876 | — | IC50 | = | 4.0 | nM | 8.40 |
| CHEMBL5191464 | — | IC50 | = | 6.4 | nM | 8.19 |
| CHEMBL5206120 | — | IC50 | = | 12.5 | nM | 7.90 |
| CHEMBL5173658 | — | IC50 | = | 14.0 | nM | 7.85 |
| CHEMBL5189954 | — | IC50 | = | 17.0 | nM | 7.77 |
| CHEMBL5191060 | — | IC50 | = | 19.0 | nM | 7.72 |
| CHEMBL5195798 | — | IC50 | = | 19.5 | nM | 7.71 |
| CHEMBL5198667 | — | IC50 | = | 20.0 | nM | 7.70 |
| CHEMBL5194822 | — | IC50 | = | 21.9 | nM | 7.66 |
| CHEMBL5171263 | — | IC50 | = | 22.1 | nM | 7.66 |
| CHEMBL5192585 | — | IC50 | = | 32.9 | nM | 7.48 |
| CHEMBL5193390 | — | IC50 | = | 63.5 | nM | 7.20 |
| CHEMBL5179259 | — | IC50 | = | 64.1 | nM | 7.19 |
| CHEMBL5195086 | — | IC50 | = | 71.5 | nM | 7.15 |
| CHEMBL5190213 | — | IC50 | = | 86.3 | nM | 7.06 |
| CHEMBL5187784 | — | IC50 | = | 125.5 | nM | 6.90 |
| CHEMBL3427166 | — | IC50 | = | 190.0 | nM | 6.72 |
| CHEMBL5182169 | — | IC50 | = | 1500.0 | nM | 5.82 |