Compound Detail
CHEMBL3770709
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Basic Information
| ChEMBL ID | CHEMBL3770709 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YCKCPIYKXUJHQQ-HNNXBMFYSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
4
Publications
0
Known Names
Molecular Properties
408.5
MW (Da)
1.63
ALogP
9
HBA
1
HBD
117.0
PSA (Ų)
0.70
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform CHEMBL4005 | Ki | 10.0 | 10.0 | 0.1 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 83.0 | mL.min-1.kg-1 | Rattus norvegicus |
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 | = | 0.1 | nM | 10.0 | Inhibition of recombinant PI3K alpha (unknown origin) using PIP2 as substrate by... | 26741947 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26741947 | 10.1021/acs.jmedchem.5b01483 | Unchecked | 3 |
| 26741947 | 10.1021/acs.jmedchem.5b01483 | Hepatocyte | 2 |
| 26741947 | 10.1021/acs.jmedchem.5b01483 | Rattus norvegicus | 1 |
| 26741947 | 10.1021/acs.jmedchem.5b01483 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | 1 |
Data from ChEMBL 36 via Core Engine