Compound Detail
CHEMBL1081615
ATPENIN A5 Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1081615 |
| Name | ATPENIN A5 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OVULNOOPECCZRG-CIUDSAMLSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
366.2
MW (Da)
2.79
ALogP
5
HBA
2
HBD
88.6
PSA (Ų)
0.55
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 8.44 | 8.3075 | 3.6 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 3.6 | nM | 8.44 | Inhibition of bovine heart SQR | 25841198 |
| Unchecked | IC50 | = | 3.7 | nM | 8.43 | Inhibition of rat liver SQR | 25841198 |
| Unchecked | IC50 | = | 4.0 | nM | 8.4 | Inhibition of bovine heart sub-mitochondrial membrane SQR assessed as ubiquinol-... | 20137945 |
| Unchecked | IC50 | = | 11.0 | nM | 7.96 | Inhibition of Septoria nodorum sub-mitochondrial membrane SQR assessed as ubiqui... | 20137945 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20137945 | 10.1016/j.bmcl.2010.01.066 | Unchecked | 2 |
| 25841198 | 10.1016/j.ejmech.2015.03.060 | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine