Compound Detail
CHEMBL4878086
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Basic Information
| ChEMBL ID | CHEMBL4878086 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GFAYGVIOVHBFEB-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
423.0
MW (Da)
4.77
ALogP
4
HBA
1
HBD
64.2
PSA (Ų)
0.62
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.62
IC50 1 meas. best 7.33
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fusion glycoprotein F0 CHEMBL3856166 | IC50 | 7.33 | 7.33 | 46.7 | 1 |
| Human orthopneumovirus CHEMBL613127 | EC50 | 5.62 | 5.62 | 2384.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fusion glycoprotein F0 | IC50 | = | 46.7 | nM | 7.33 | Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T... | 33729773 |
| Human orthopneumovirus | EC50 | = | 2384.3 | nM | 5.62 | Antiviral activity against Respiratory syncytial virus A2 infected in African gr... | 33729773 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33729773 | 10.1021/acs.jmedchem.0c01882 | Human orthopneumovirus | 1 |
| 33729773 | 10.1021/acs.jmedchem.0c01882 | Vero | 1 |
| 33729773 | 10.1021/acs.jmedchem.0c01882 | Fusion glycoprotein F0 | 1 |
Data from ChEMBL 36 via Core Engine