Compound Detail
CHEMBL140516
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 | CHEMBL140516 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GJJJVONLYFECJX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
413.4
MW (Da)
3.78
ALogP
4
HBA
0
HBD
53.0
PSA (Ų)
0.61
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cholecystokinin receptor type A CHEMBL2871 | IC50 | 5.37 | 5.37 | 4300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cholecystokinin receptor type A | IC50 | = | 4300.0 | nM | 5.37 | Inhibition of binding of [125I]CCK-8 to Cholecystokinin type A receptor in rat p... | 2153212 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2153212 | 10.1021/jm00163a069 | Cholecystokinin receptor type A | 1 |
| 2153212 | 10.1021/jm00163a069 | Gastrin/cholecystokinin type B receptor | 1 |
Data from ChEMBL 36 via Core Engine