Compound Detail
CHEMBL74499
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 | CHEMBL74499 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GUXJMJUVMZUTSI-FQNRMIAFSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
235.4
MW (Da)
4.08
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.66
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sigma 2 receptor CHEMBL613288 | Ki | 8.96 | 8.96 | 1.1 | 1 |
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | Ki | 8.52 | 8.52 | 3.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sigma 2 receptor | Ki | = | 1.1 | nM | 8.96 | Inhibition of [3H]-DTG binding to Sigma opioid receptor type 2 | - |
| Sigma non-opioid intracellular receptor 1 | Ki | = | 3.0 | nM | 8.52 | Inhibition of [3H]pentazocine binding to Sigma opioid receptor type 1 | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(97)00417-4 | Sigma non-opioid intracellular receptor 1 | 2 |
| - | 10.1016/S0960-894X(97)00417-4 | Sigma 2 receptor | 1 |
Data from ChEMBL 36 via Core Engine