Compound Detail
CHEMBL5402317
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Basic Information
| ChEMBL ID | CHEMBL5402317 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LLPUFYDDUPBNQZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
459.6
MW (Da)
4.41
ALogP
6
HBA
1
HBD
88.6
PSA (Ų)
0.54
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphatidylinositol 4-kinase beta CHEMBL3268 | IC50 | 5.6 | 5.6 | 2500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphatidylinositol 4-kinase beta | IC50 | = | 2500.0 | nM | 5.6 | Inhibition of human recombinant GST tagged P14KIII beta incubated for 10 mins by... | 38389877 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38389877 | 10.1039/d3md00630a | H1-HeLa | 1 |
| 38389877 | 10.1039/d3md00630a | rhinovirus B14 | 1 |
| 38389877 | 10.1039/d3md00630a | rhinovirus A16 | 1 |
| 38389877 | 10.1039/d3md00630a | rhinovirus A21 | 1 |
| 38389877 | 10.1039/d3md00630a | Phosphatidylinositol 4-kinase alpha | 1 |
| 38389877 | 10.1039/d3md00630a | Phosphatidylinositol 4-kinase beta | 1 |
Data from ChEMBL 36 via Core Engine