Compound Detail
CHEMBL185848
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 | CHEMBL185848 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CQOGRJBEZFMVTP-PKOBYXMFSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
336.4
MW (Da)
3.43
ALogP
3
HBA
0
HBD
61.2
PSA (Ų)
0.80
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.7
Ki 1 meas. best 10.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prolyl endopeptidase CHEMBL2461 | Ki | 10.52 | 10.52 | 0.0 | 1 |
| Prolyl endopeptidase CHEMBL2461 | IC50 | 9.7 | 9.7 | 0.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prolyl endopeptidase | Ki | = | 0.03 | nM | 10.52 | Inhibitory activity against prolyl oligopeptidase of porcine brain homogenate | 15509157 |
| Prolyl endopeptidase | IC50 | = | 0.2 | nM | 9.7 | Inhibitory activity against prolyl oligopeptidase of porcine brain homogenate | 15509157 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15509157 | 10.1021/jm049503w | Prolyl endopeptidase | 2 |
| 15509157 | 10.1021/jm049503w | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine