Compound Detail
CHEMBL4207065
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
Basic Information
| ChEMBL ID | CHEMBL4207065 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LOURBMRICXECGF-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
382.3
MW (Da)
3.24
ALogP
5
HBA
2
HBD
107.7
PSA (Ų)
0.68
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Group 10 secretory phospholipase A2 CHEMBL4342 | IC50 | 6.37 | 6.37 | 430.0 | 1 |
| Phospholipase A2, membrane associated CHEMBL3474 | IC50 | 5.72 | 5.72 | 1900.0 | 1 |
| Phospholipase A2 group V CHEMBL4323 | IC50 | 5.23 | 5.23 | 5900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Group 10 secretory phospholipase A2 | IC50 | = | 430.0 | nM | 6.37 | Inhibition of sPLA2-10 (unknown origin) using 1-palmitoyl-2-oleoyl-sn-glycero-3-... | 30034586 |
| Phospholipase A2, membrane associated | IC50 | = | 1900.0 | nM | 5.72 | Inhibition of sPLA2-2A (unknown origin) using 1-palmitoyl-2-oleoyl-sn-glycero-3-... | 30034586 |
| Phospholipase A2 group V | IC50 | = | 5900.0 | nM | 5.23 | Inhibition of sPLA2-5 (unknown origin) using 1-palmitoyl-2-oleoyl-sn-glycero-3-p... | 30034586 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30034586 | 10.1021/acsmedchemlett.7b00507 | Group 10 secretory phospholipase A2 | 2 |
| 30034586 | 10.1021/acsmedchemlett.7b00507 | Phospholipase A2, membrane associated | 1 |
| 30034586 | 10.1021/acsmedchemlett.7b00507 | Phospholipase A2 group V | 1 |
| 30034586 | 10.1021/acsmedchemlett.7b00507 | Hepatocyte | 1 |
Data from ChEMBL 36 via Core Engine