Compound Detail
CHEMBL5426155
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 | CHEMBL5426155 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FKMMUKDTVNOKQD-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
395.5
MW (Da)
3.20
ALogP
6
HBA
0
HBD
48.6
PSA (Ų)
0.58
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sigma intracellular receptor 2 CHEMBL4105907 | Ki | 9.37 | 9.37 | 0.4 | 1 |
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | Ki | 6.25 | 6.25 | 560.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sigma intracellular receptor 2 | Ki | = | 0.43 | nM | 9.37 | Binding affinity to sigma2 receptor (unknown origin) assessed as inhibition cons... | 37607512 |
| Sigma non-opioid intracellular receptor 1 | Ki | = | 560.0 | nM | 6.25 | Binding affinity to sigma1 receptor (unknown origin) assessed as inhibition cons... | 37607512 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37607512 | 10.1021/acs.jmedchem.3c01060 | Sigma non-opioid intracellular receptor 1 | 1 |
| 37607512 | 10.1021/acs.jmedchem.3c01060 | Sigma intracellular receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine