Assay Detail
Binding
CHEMBL5139999
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of SARS-CoV-2 3CL protease expressed in Escherichia coli BL21 (DE3) cells assessed as change in relative fluorescence unit using MCA-TSAVLQSGFRK(DNP)M as substrate preincubated for 30 mins followed by substrate addition and measured after 2 hrs by microplate reader based FRET assay
43
Total Activities
43
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
The structure-based design of peptidomimetic inhibitors against SARS-CoV-2 3C like protease as Potent anti-viral drug candidate.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 43 | 6.31 | 6.83 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5192273 | — | — | 1 | 6.83 |
| CHEMBL5206326 | — | — | 1 | 6.82 |
| CHEMBL5197113 | — | — | 1 | 6.76 |
| CHEMBL5185152 | — | — | 1 | 6.76 |
| CHEMBL5199219 | — | — | 1 | 6.76 |
| CHEMBL5189683 | — | — | 1 | 6.71 |
| CHEMBL5176330 | — | — | 1 | 6.71 |
| CHEMBL5182229 | — | — | 1 | 6.70 |
| CHEMBL5205787 | — | — | 1 | 6.68 |
| CHEMBL5192541 | — | — | 1 | 6.66 |
| CHEMBL5189974 | — | — | 1 | 6.64 |
| CHEMBL5175884 | — | — | 1 | 6.63 |
| CHEMBL5207843 | — | — | 1 | 6.60 |
| CHEMBL5191197 | — | — | 1 | 6.59 |
| CHEMBL5198279 | — | — | 1 | 6.59 |
| CHEMBL5203574 | — | — | 1 | 6.57 |
| CHEMBL5207566 | — | — | 1 | 6.56 |
| CHEMBL5183017 | — | — | 1 | 6.55 |
| CHEMBL5173399 | — | — | 1 | 6.54 |
| CHEMBL5179730 | — | — | 1 | 6.53 |
| CHEMBL5169416 | — | — | 1 | 6.53 |
| CHEMBL5199094 | — | — | 1 | 6.53 |
| CHEMBL5201697 | — | — | 1 | 6.51 |
| CHEMBL3885329 | — | — | 1 | 6.49 |
| CHEMBL5190907 | — | — | 1 | 6.45 |
| CHEMBL5195478 | — | — | 1 | 6.43 |
| CHEMBL5200040 | — | — | 1 | 6.43 |
| CHEMBL5191663 | — | — | 1 | 6.39 |
| CHEMBL5172144 | — | — | 1 | 6.26 |
| CHEMBL5197105 | — | — | 1 | 6.25 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5192273 | — | IC50 | = | 148.0 | nM | 6.83 |
| CHEMBL5206326 | — | IC50 | = | 153.0 | nM | 6.82 |
| CHEMBL5185152 | — | IC50 | = | 172.0 | nM | 6.76 |
| CHEMBL5199219 | — | IC50 | = | 173.0 | nM | 6.76 |
| CHEMBL5197113 | — | IC50 | = | 173.0 | nM | 6.76 |
| CHEMBL5189683 | — | IC50 | = | 197.0 | nM | 6.71 |
| CHEMBL5176330 | — | IC50 | = | 196.0 | nM | 6.71 |
| CHEMBL5182229 | — | IC50 | = | 199.0 | nM | 6.70 |
| CHEMBL5205787 | — | IC50 | = | 209.0 | nM | 6.68 |
| CHEMBL5192541 | — | IC50 | = | 221.0 | nM | 6.66 |
| CHEMBL5189974 | — | IC50 | = | 230.0 | nM | 6.64 |
| CHEMBL5175884 | — | IC50 | = | 234.0 | nM | 6.63 |
| CHEMBL5207843 | — | IC50 | = | 249.0 | nM | 6.60 |
| CHEMBL5191197 | — | IC50 | = | 257.0 | nM | 6.59 |
| CHEMBL5198279 | — | IC50 | = | 255.0 | nM | 6.59 |
| CHEMBL5203574 | — | IC50 | = | 271.0 | nM | 6.57 |
| CHEMBL5207566 | — | IC50 | = | 277.0 | nM | 6.56 |
| CHEMBL5183017 | — | IC50 | = | 281.0 | nM | 6.55 |
| CHEMBL5173399 | — | IC50 | = | 285.0 | nM | 6.54 |
| CHEMBL5199094 | — | IC50 | = | 298.0 | nM | 6.53 |
| CHEMBL5179730 | — | IC50 | = | 295.0 | nM | 6.53 |
| CHEMBL5169416 | — | IC50 | = | 295.0 | nM | 6.53 |
| CHEMBL5201697 | — | IC50 | = | 307.0 | nM | 6.51 |
| CHEMBL3885329 | — | IC50 | = | 321.0 | nM | 6.49 |
| CHEMBL5190907 | — | IC50 | = | 357.0 | nM | 6.45 |
| CHEMBL5195478 | — | IC50 | = | 374.0 | nM | 6.43 |
| CHEMBL5200040 | — | IC50 | = | 373.0 | nM | 6.43 |
| CHEMBL5191663 | — | IC50 | = | 404.0 | nM | 6.39 |
| CHEMBL5172144 | — | IC50 | = | 543.0 | nM | 6.26 |
| CHEMBL5197105 | — | IC50 | = | 565.0 | nM | 6.25 |
| CHEMBL5189874 | — | IC50 | = | 592.0 | nM | 6.23 |
| CHEMBL5179883 | — | IC50 | = | 640.0 | nM | 6.19 |
| CHEMBL4764751 | — | IC50 | = | 858.0 | nM | 6.07 |
| CHEMBL5207769 | — | IC50 | = | 1338.0 | nM | 5.87 |
| CHEMBL5179310 | — | IC50 | = | 1409.0 | nM | 5.85 |
| CHEMBL5182755 | — | IC50 | = | 1426.0 | nM | 5.85 |
| CHEMBL5174138 | — | IC50 | = | 1497.0 | nM | 5.83 |
| CHEMBL5186446 | — | IC50 | = | 2044.0 | nM | 5.69 |
| CHEMBL5173857 | — | IC50 | = | 3275.0 | nM | 5.49 |
| CHEMBL5182830 | — | IC50 | = | 3436.0 | nM | 5.46 |
| CHEMBL5180964 | — | IC50 | = | 3889.0 | nM | 5.41 |
| CHEMBL3884779 | — | IC50 | = | 6928.0 | nM | 5.16 |
| CHEMBL5203407 | — | IC50 | = | 12320.0 | nM | 4.91 |