Compound Detail
CHEMBL68509
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Basic Information
| ChEMBL ID | CHEMBL68509 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ONDNDTMAYANFKN-ZCFIWIBFSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
148.3
MW (Da)
0.37
ALogP
3
HBA
3
HBD
52.0
PSA (Ų)
0.39
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aminopeptidase B CHEMBL2452 | Ki | 9.04 | 9.04 | 0.9 | 1 |
| Aminopeptidase N CHEMBL2590 | Ki | 6.96 | 6.96 | 110.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aminopeptidase B | Ki | = | 0.91 | nM | 9.04 | Inhibitory activity against aminopeptidase B | 3184126 |
| Aminopeptidase N | Ki | = | 110.0 | nM | 6.96 | Inhibitory activity against Aminopeptidase M | 3184126 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3184126 | 10.1021/jm00119a022 | Aminopeptidase N | 1 |
| 3184126 | 10.1021/jm00119a022 | Cytosol aminopeptidase | 1 |
| 3184126 | 10.1021/jm00119a022 | Aminopeptidase B | 1 |
Data from ChEMBL 36 via Core Engine