Compound Detail
CHEMBL169438
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 | CHEMBL169438 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FGWACVODRFNWJZ-NRFANRHFSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
403.9
MW (Da)
3.91
ALogP
3
HBA
1
HBD
61.8
PSA (Ų)
0.72
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholecystokinin receptor type A CHEMBL2871 | IC50 | 8.54 | 8.54 | 2.9 | 1 |
| Gastrin/cholecystokinin type B receptor CHEMBL298 | IC50 | 4.96 | 4.96 | 11000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholecystokinin receptor type A | IC50 | = | 2.9 | nM | 8.54 | The compound was tested for its activity to inhibit the binding of [125I]CCK-8 t... | - |
| Gastrin/cholecystokinin type B receptor | IC50 | = | 11000.0 | nM | 4.96 | The compound was tested for its activity to inhibit the binding of [125I]CCK-8 t... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80684-8 | Gastrin/cholecystokinin type B receptor | 1 |
| - | 10.1016/S0960-894X(00)80684-8 | Cholecystokinin receptor type A | 1 |
Data from ChEMBL 36 via Core Engine