Compound Detail
CHEMBL215824
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 | CHEMBL215824 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FXXJNNWOYBQHCC-CJNGLKHVSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
323.9
MW (Da)
2.55
ALogP
3
HBA
2
HBD
58.4
PSA (Ų)
0.85
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dipeptidyl peptidase 2 CHEMBL3976 | IC50 | 7.24 | 7.24 | 57.0 | 1 |
| Dipeptidyl peptidase 8 CHEMBL4657 | IC50 | 4.19 | 4.19 | 65000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dipeptidyl peptidase 2 | IC50 | = | 57.0 | nM | 7.24 | Inhibition of DPP2 | 16844373 |
| Dipeptidyl peptidase 8 | IC50 | = | 65000.0 | nM | 4.19 | Inhibition of DPP8 | 16844373 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16844373 | 10.1016/j.bmcl.2006.06.082 | Dipeptidyl peptidase 4 | 1 |
| 16844373 | 10.1016/j.bmcl.2006.06.082 | Dipeptidyl peptidase 2 | 1 |
| 16844373 | 10.1016/j.bmcl.2006.06.082 | Dipeptidyl peptidase 8 | 1 |
| 16844373 | 10.1016/j.bmcl.2006.06.082 | Dipeptidyl peptidase II and dipeptidyl peptidase IV (DPP2 and DPP4) | 1 |
| 16844373 | 10.1016/j.bmcl.2006.06.082 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine