Compound Detail
CHEMBL2387084
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Basic Information
| ChEMBL ID | CHEMBL2387084 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DDRRVMBAHALKPP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
377.4
MW (Da)
1.89
ALogP
8
HBA
2
HBD
106.7
PSA (Ų)
0.56
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform CHEMBL4005 | Ki | 7.68 | 7.68 | 21.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | Ki | = | 21.1 | nM | 7.68 | Inhibition of PI3Kalpha (unknown origin) assessed as 3,4,5-inositoltriphosphate ... | 23662903 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23662903 | 10.1021/jm4003632 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | 2 |
| 23662903 | 10.1021/jm4003632 | No relevant target | 1 |
| 23662903 | 10.1021/jm4003632 | Liver | 1 |
| 23662903 | 10.1021/jm4003632 | NON-PROTEIN TARGET | 1 |
| 23662903 | 10.1021/jm4003632 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine