Compound Detail
CHEMBL186925
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 | CHEMBL186925 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WZVODYACIPKUAB-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
427.5
MW (Da)
5.28
ALogP
4
HBA
1
HBD
68.5
PSA (Ų)
0.39
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 6.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prostaglandin D2 receptor CHEMBL3933 | Ki | 6.77 | 6.77 | 170.0 | 1 |
| Prostaglandin E2 receptor EP4 subtype CHEMBL2489 | Ki | 5.68 | 5.68 | 2100.0 | 1 |
| Prostaglandin E2 receptor EP3 subtype CHEMBL4336 | Ki | 5.48 | 5.48 | 3300.0 | 1 |
| Prostaglandin E2 receptor EP1 subtype CHEMBL2181 | Ki | 5.11 | 5.11 | 7700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prostaglandin D2 receptor | Ki | = | 170.0 | nM | 6.77 | Ability to inhibit the binding of [3H]PGD-2 radioligand to membranes of CHO cell... | 15341946 |
| Prostaglandin E2 receptor EP4 subtype | Ki | = | 2100.0 | nM | 5.68 | Ability to inhibit the binding of [3H]PGD-2 radioligand to membranes of CHO cell... | 15341946 |
| Prostaglandin E2 receptor EP3 subtype | Ki | = | 3300.0 | nM | 5.48 | Ability to inhibit the binding of [3H]PGD-2 radioligand to membranes of CHO cell... | 15341946 |
| Prostaglandin E2 receptor EP1 subtype | Ki | = | 7700.0 | nM | 5.11 | Ability to inhibit the binding of [3H]PGD-2 radioligand to membranes of CHO cell... | 15341946 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15341946 | 10.1016/j.bmcl.2004.07.039 | Prostaglandin D2 receptor | 3 |
| 15341946 | 10.1016/j.bmcl.2004.07.039 | Prostaglandin E2 receptor EP1 subtype | 1 |
| 15341946 | 10.1016/j.bmcl.2004.07.039 | Prostaglandin E2 receptor EP2 subtype | 1 |
| 15341946 | 10.1016/j.bmcl.2004.07.039 | Prostaglandin E2 receptor EP3 subtype | 1 |
| 15341946 | 10.1016/j.bmcl.2004.07.039 | Prostaglandin E2 receptor EP4 subtype | 1 |
Data from ChEMBL 36 via Core Engine