Compound Detail
CHEMBL1668623
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Basic Information
| ChEMBL ID | CHEMBL1668623 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NPDBUWUEHWAHRS-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1739274 |
| Active Moiety | CHEMBL1739274 |
1
Targets
5
Activities
2
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
161.2
MW (Da)
0.68
ALogP
2
HBA
1
HBD
43.1
PSA (Ų)
0.61
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 6.3
IC50 2 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aminopeptidase N CHEMBL1907 | Ki | 6.3 | 6.3 | 500.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aminopeptidase N | Ki | = | 500.0 | nM | 6.3 | Inhibition of human aminopeptidase N by Dixon plot analysis | 21292493 |
| Aminopeptidase N | Ki | = | 500.0 | nM | 6.3 | Inhibition of APN | 22796349 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21292493 | 10.1016/j.bmc.2011.01.008 | Aminopeptidase N | 3 |
| 22796349 | 10.1016/j.bmc.2012.06.041 | Aminopeptidase N | 2 |
| 21292493 | 10.1016/j.bmc.2011.01.008 | Cytosol aminopeptidase | 1 |
| 21292493 | 10.1016/j.bmc.2011.01.008 | Leukotriene A-4 hydrolase | 1 |
| 21292493 | 10.1016/j.bmc.2011.01.008 | Unchecked | 1 |
| 22796349 | 10.1016/j.bmc.2012.06.041 | Cytosol aminopeptidase | 1 |
Data from ChEMBL 36 via Core Engine