Compound Detail
CHEMBL4173159
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CC(=O)OC[C@H]1O[C@@H](Sc2ccc(NC(=O)[C@H]3O[C@@H](n4ccc(=O)[nH]c4=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]3O[Si](C)(C)C(C)(C)C)cn2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O
Basic Information
| ChEMBL ID | CHEMBL4173159 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VTZBDSZIZOLJFW-ODQOQVFTSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
925.2
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Classical swine fever virus CHEMBL4296565 | IC50 | 5.52 | 5.52 | 3000.0 | 1 |
| Hepatitis C virus CHEMBL379 | IC50 | 5.4 | 5.28 | 4005.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Classical swine fever virus | IC50 | = | 3000.0 | nM | 5.52 | Antiviral activity against CSFV infected in SK6 cells assessed as reduction of p... | 28601004 |
| Hepatitis C virus | IC50 | = | 4005.0 | nM | 5.4 | Antiviral activity against HCV infected in human Huh7-J17 cells assessed as inhi... | 28601004 |
| Hepatitis C virus | IC50 | = | 7000.0 | nM | 5.16 | Antiviral activity against HCV Jc1/JFH infected in human Huh7.5 cells assessed a... | 28601004 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28601004 | 10.1016/j.ejmech.2017.05.051 | Unchecked | 11 |
| 28601004 | 10.1016/j.ejmech.2017.05.051 | Hepatitis C virus | 10 |
| 28601004 | 10.1016/j.ejmech.2017.05.051 | Classical swine fever virus | 2 |
Data from ChEMBL 36 via Core Engine