Compound Detail
CHEMBL3262706
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 | CHEMBL3262706 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QGVYDKLTHVYTBB-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
260.3
MW (Da)
3.04
ALogP
4
HBA
1
HBD
55.8
PSA (Ų)
0.68
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.76
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prostaglandin G/H synthase 1 CHEMBL2949 | IC50 | 4.76 | 4.76 | 17200.0 | 1 |
| Prostaglandin G/H synthase 2 CHEMBL4102 | IC50 | 4.72 | 4.72 | 19010.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prostaglandin G/H synthase 1 | IC50 | = | 17200.0 | nM | 4.76 | Inhibition of ovine COX1 using arachidonic acid as substrate preincubated for 10... | 24763362 |
| Prostaglandin G/H synthase 2 | IC50 | = | 19010.0 | nM | 4.72 | Inhibition of ovine COX2 using arachidonic acid as substrate preincubated for 10... | 24763362 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24763362 | 10.1016/j.ejmech.2014.04.033 | Prostaglandin G/H synthase 1 | 2 |
| 24763362 | 10.1016/j.ejmech.2014.04.033 | Prostaglandin G/H synthase 2 | 2 |
| 24763362 | 10.1016/j.ejmech.2014.04.033 | Rattus norvegicus | 2 |
| 24763362 | 10.1016/j.ejmech.2014.04.033 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine