Compound Detail
CHEMBL103157
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Basic Information
| ChEMBL ID | CHEMBL103157 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SHBWFWVQWMKEMZ-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
287.4
MW (Da)
4.32
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.73
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 8.83
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | Ki | 8.83 | 8.175 | 1.5 | 2 |
| Sigma non-opioid intracellular receptor 1 CHEMBL3602 | Ki | 7.29 | 7.05 | 51.8 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 | Ki | = | 1.48 | nM | 8.83 | Binding affinity measured on Sigma receptor type 1 from guinea pig brain membran... | 7636860 |
| Sigma non-opioid intracellular receptor 1 | Ki | = | 30.5 | nM | 7.52 | Binding affinity measured on Sigma receptor type 1 from guinea pig brain membran... | 7636860 |
| Sigma non-opioid intracellular receptor 1 | Ki | = | 51.8 | nM | 7.29 | Binding affinity at Sigma receptor type 2 on rat liver membranes receptor by [3H... | 7636860 |
| Sigma non-opioid intracellular receptor 1 | Ki | = | 154.0 | nM | 6.81 | Binding affinity at Sigma receptor type 2 on rat liver membranes receptor by [3H... | 7636860 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7636860 | 10.1021/jm00015a022 | Sigma non-opioid intracellular receptor 1 | 6 |
Data from ChEMBL 36 via Core Engine