Compound Detail
CHEMBL4078784
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Basic Information
| ChEMBL ID | CHEMBL4078784 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GFPIKLVHYYFYDL-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
466.5
MW (Da)
3.79
ALogP
8
HBA
1
HBD
113.3
PSA (Ų)
0.47
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.18
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 8.18 | 8.18 | 6.6 | 1 |
| PI3-kinase p110-delta/p85-alpha CHEMBL2111432 | IC50 | 8.03 | 8.03 | 9.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 6.61 | nM | 8.18 | Antiproliferative activity against human RPMI8266 cells after 72 hrs by MTT assa... | 28325601 |
| PI3-kinase p110-delta/p85-alpha | IC50 | = | 9.3 | nM | 8.03 | Inhibition of PI3K p110delta/p85alpha (unknown origin) using lipid substrate aft... | 28325601 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28325601 | 10.1016/j.bmcl.2017.03.020 | PI3-kinase p110-delta/p85-alpha | 2 |
| 28325601 | 10.1016/j.bmcl.2017.03.020 | Unchecked | 1 |
| 28325601 | 10.1016/j.bmcl.2017.03.020 | Ramos | 1 |
| 28325601 | 10.1016/j.bmcl.2017.03.020 | Raji | 1 |
Data from ChEMBL 36 via Core Engine