Compound Detail
CHEMBL5573862
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 | CHEMBL5573862 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QJYIQSSYSCXWLH-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
309.4
MW (Da)
4.72
ALogP
4
HBA
0
HBD
44.5
PSA (Ų)
0.68
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prostaglandin G/H synthase 1 CHEMBL2949 | IC50 | 7.34 | 7.34 | 46.0 | 1 |
| Platelet CHEMBL4296519 | IC50 | 5.6 | 5.6 | 2500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prostaglandin G/H synthase 1 | IC50 | = | 46.0 | nM | 7.34 | Inhibition of ovine COX-1 by colorimetric assay | 38219659 |
| Platelet | IC50 | = | 2500.0 | nM | 5.6 | Antiplatelet activity in human platelets assessed as inhibition of arachidonic a... | 38219659 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38219659 | 10.1016/j.ejmech.2024.116135 | Prostaglandin G/H synthase 1 | 2 |
| 38219659 | 10.1016/j.ejmech.2024.116135 | Prostaglandin G/H synthase 2 | 2 |
| 38219659 | 10.1016/j.ejmech.2024.116135 | Platelet | 2 |
| 38219659 | 10.1016/j.ejmech.2024.116135 | Plasma | 2 |
| 38219659 | 10.1016/j.ejmech.2024.116135 | Unchecked | 1 |
| 38219659 | 10.1016/j.ejmech.2024.116135 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine