Compound Detail
CHEMBL4241373
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
COc1ccc(-c2nn(Cc3nc4cccc(F)c4c(=O)n3-c3ccccc3C)c3ncnc(N)c23)cn1
Basic Information
| ChEMBL ID | CHEMBL4241373 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FIPRACFVSSQKBB-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
508.5
MW (Da)
3.67
ALogP
10
HBA
1
HBD
126.6
PSA (Ų)
0.37
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform CHEMBL3130 | IC50 | 7.51 | 7.51 | 31.0 | 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 delta isoform | IC50 | = | 31.0 | nM | 7.51 | Inhibition of PI3Kdelta (unknown origin) using Biotin-S11S12 as substrate after ... | 29601991 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29601991 | 10.1016/j.ejmech.2018.03.068 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform | 2 |
Data from ChEMBL 36 via Core Engine