Compound Detail
CHEMBL519139
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 | CHEMBL519139 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IOWVGVILVVPYNF-RFVHGSKJSA-N |
| Parent Compound | CHEMBL1187762 |
| Active Moiety | CHEMBL1187762 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
315.3
MW (Da)
1.19
ALogP
3
HBA
2
HBD
58.4
PSA (Ų)
0.82
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.84
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dipeptidyl peptidase 4 CHEMBL284 | IC50 | 5.84 | 5.84 | 1440.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dipeptidyl peptidase 4 | IC50 | = | 1440.0 | nM | 5.84 | Inhibition of DPP4 | 18996694 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18996694 | 10.1016/j.bmcl.2008.10.076 | Dipeptidyl peptidase 4 | 1 |
| 18996694 | 10.1016/j.bmcl.2008.10.076 | Cytochrome P450 3A4 | 1 |
Data from ChEMBL 36 via Core Engine