Compound Detail
CHEMBL311364
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 | CHEMBL311364 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LAWPGSGXPGSRTD-NSHDSACASA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
268.4
MW (Da)
2.01
ALogP
3
HBA
0
HBD
49.9
PSA (Ų)
0.73
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prolyl endopeptidase CHEMBL2461 | IC50 | 7.54 | 7.54 | 29.0 | 2 |
| Prolyl endopeptidase CHEMBL3202 | IC50 | 7.5 | 7.5 | 32.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prolyl endopeptidase | IC50 | = | 29.0 | nM | 7.54 | In vitro inhibitory activity against porcine prolyl oligopeptidase by using 4 mM... | 16033257 |
| Prolyl endopeptidase | IC50 | = | 29.0 | nM | 7.54 | Inhibition of pig brain POP | 20058865 |
| Prolyl endopeptidase | IC50 | = | 32.0 | nM | 7.5 | Inhibitory activity evaluated against Post-proline cleaving enzyme from Flavobac... | 8691432 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8691432 | 10.1021/jm950858c | Prolyl endopeptidase | 1 |
| 16033257 | 10.1021/jm0500020 | Prolyl endopeptidase | 1 |
| 20058865 | 10.1021/jm901104g | Prolyl endopeptidase | 1 |
Data from ChEMBL 36 via Core Engine