Compound Detail
CHEMBL296494
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Basic Information
| ChEMBL ID | CHEMBL296494 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UIQSKEDQPSEGAU-UHFFFAOYSA-N |
1
Targets
4
Activities
2
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
125.1
MW (Da)
-0.53
ALogP
2
HBA
3
HBD
83.5
PSA (Ų)
0.41
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.38
Ki 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aminopeptidase N CHEMBL2590 | IC50 | 4.38 | 4.38 | 42000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aminopeptidase N | IC50 | = | 42000.0 | nM | 4.38 | Inhibition of pig kidney aminopeptidase N using Leu-AMC as substrate | 20347318 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3137344 | 10.1021/jm00117a017 | Unchecked | 2 |
| 2562853 | 10.1021/jm00121a030 | Unchecked | 1 |
| 3137344 | 10.1021/jm00117a017 | UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase | 1 |
| 3625708 | 10.1021/jm00392a014 | Cytosol aminopeptidase | 1 |
| 20347318 | 10.1016/j.bmc.2010.02.056 | Aminopeptidase N | 1 |
Data from ChEMBL 36 via Core Engine