Assay Detail
Binding
CHEMBL4393313
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Binding affinity to MERS-CoV papain-like protease by SPR analysis
8
Total Activities
8
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Middle East respiratory syndrome-related coronavirus |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Target
Replicase polyprotein 1ab (CHEMBL4295557) ↗| Type | SINGLE PROTEIN |
| Organism | Middle East respiratory syndrome-related coronavirus (isolate UnitedKingdom/H123990006/2012) (Betacoronavirus England 1) (Humancoronavirus EMC) |
Publication
Identification and design of novel small molecule inhibitors against MERS-CoV papain-like protease via high-throughput screening and molecular modeling.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Kd | 8 | 5.08 | 5.12 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL421 | SULFASALAZINE | 4.0 | 1 | 5.12 |
| CHEMBL4544405 | — | — | 1 | 5.12 |
| CHEMBL2030452 | — | — | 1 | 5.12 |
| CHEMBL1368663 | — | — | 1 | 5.12 |
| CHEMBL4475926 | — | — | 1 | 5.12 |
| CHEMBL1595473 | — | — | 1 | 5.12 |
| CHEMBL11350 | ONO-1078 | — | 1 | 4.85 |
| CHEMBL222021 | PROTOCATECHUALDEHYDE | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL421 | SULFASALAZINE | Kd | = | 7600.0 | nM | 5.12 |
| CHEMBL4544405 | — | Kd | = | 7600.0 | nM | 5.12 |
| CHEMBL2030452 | — | Kd | = | 7600.0 | nM | 5.12 |
| CHEMBL1368663 | — | Kd | = | 7600.0 | nM | 5.12 |
| CHEMBL4475926 | — | Kd | = | 7600.0 | nM | 5.12 |
| CHEMBL1595473 | — | Kd | = | 7600.0 | nM | 5.12 |
| CHEMBL11350 | ONO-1078 | Kd | = | 14100.0 | nM | 4.85 |
| CHEMBL222021 | PROTOCATECHUALDEHYDE | Kd | = | 220000.0 | nM | - |