Compound Detail
CHEMBL315214
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 | CHEMBL315214 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PGOJZWSRPJMLLS-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
391.5
MW (Da)
2.96
ALogP
4
HBA
2
HBD
77.0
PSA (Ų)
0.83
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.86
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Gastrin/cholecystokinin type B receptor CHEMBL298 | IC50 | 6.86 | 6.86 | 137.0 | 2 |
| Cholecystokinin receptor type A CHEMBL2871 | IC50 | 6.32 | 6.32 | 480.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gastrin/cholecystokinin type B receptor | IC50 | = | 137.0 | nM | 6.86 | Binding activity against Cholecystokinin type B receptor from guinea pig cortex ... | 8145219 |
| Gastrin/cholecystokinin type B receptor | IC50 | = | 137.0 | nM | 6.86 | Inhibition of ligand binding to Cholecystokinin type B receptor from guinea pig ... | 9258356 |
| Cholecystokinin receptor type A | IC50 | = | 480.0 | nM | 6.32 | Binding activity against Cholecystokinin type A receptor from rat pancreas using... | 8145219 |
| Cholecystokinin receptor type A | IC50 | = | 480.0 | nM | 6.32 | Inhibition of ligand binding to Cholecystokinin type A receptor from rat pancrea... | 9258356 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8145219 | 10.1021/jm00032a002 | Cholecystokinin receptor type A | 1 |
| 8145219 | 10.1021/jm00032a002 | Gastrin/cholecystokinin type B receptor | 1 |
| 9258356 | 10.1021/jm9608523 | Gastrin/cholecystokinin type B receptor | 1 |
| 9258356 | 10.1021/jm9608523 | Cholecystokinin receptor type A | 1 |
Data from ChEMBL 36 via Core Engine