Assay Detail
Functional
CHEMBL5136653
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Antiviral activity against SARS-COV 2 infected in human Calu-3 cells assessed as inhibition of viral replication preincubated for 1 hr followed by viral infection and further incubated with compound for 24 hrs
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Functional |
| Organism | Severe acute respiratory syndrome coronavirus 2 |
| Cell Type | Calu-3 |
| Confidence | 1 — Organism |
| Curated By | Autocuration |
Target
SARS-CoV-2 (CHEMBL4303835) ↗| Type | ORGANISM |
| Organism | Severe acute respiratory syndrome coronavirus 2 |
Publication
Small-Molecule Thioesters as SARS-CoV-2 Main Protease Inhibitors: Enzyme Inhibition, Structure-Activity Relationships, Antiviral Activity, and X-ray Structure Determination.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| EC50 | 12 | 6.80 | 7.54 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL490820 | — | — | 1 | 7.54 |
| CHEMBL5204064 | — | — | 1 | 7.42 |
| CHEMBL5191017 | — | — | 1 | 7.35 |
| CHEMBL4065616 | REMDESIVIR | 4.0 | 1 | 7.10 |
| CHEMBL4855437 | — | — | 1 | 7.00 |
| CHEMBL5169323 | — | — | 1 | 6.96 |
| CHEMBL5192654 | — | — | 1 | 6.86 |
| CHEMBL5189565 | — | — | 1 | 6.43 |
| CHEMBL5199191 | — | — | 1 | 6.36 |
| CHEMBL5204130 | — | — | 1 | 6.25 |
| CHEMBL5199531 | — | — | 1 | 6.18 |
| CHEMBL5207081 | — | — | 1 | 6.13 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL490820 | — | EC50 | = | 28.5 | nM | 7.54 |
| CHEMBL5204064 | — | EC50 | = | 38.3 | nM | 7.42 |
| CHEMBL5191017 | — | EC50 | = | 45.0 | nM | 7.35 |
| CHEMBL4065616 | REMDESIVIR | EC50 | = | 79.6 | nM | 7.10 |
| CHEMBL4855437 | — | EC50 | = | 100.0 | nM | 7.00 |
| CHEMBL5169323 | — | EC50 | = | 111.0 | nM | 6.96 |
| CHEMBL5192654 | — | EC50 | = | 137.0 | nM | 6.86 |
| CHEMBL5189565 | — | EC50 | = | 367.0 | nM | 6.43 |
| CHEMBL5199191 | — | EC50 | = | 437.0 | nM | 6.36 |
| CHEMBL5204130 | — | EC50 | = | 562.0 | nM | 6.25 |
| CHEMBL5199531 | — | EC50 | = | 659.0 | nM | 6.18 |
| CHEMBL5207081 | — | EC50 | = | 734.0 | nM | 6.13 |