Compound Detail
CHEMBL122195
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 | CHEMBL122195 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XLNHYBZVRFENAR-CGCDUOSSSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
394.6
MW (Da)
4.00
ALogP
5
HBA
3
HBD
87.0
PSA (Ų)
0.15
QED
0
Ro5 Violations
17
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 6.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 2 CHEMBL2470 | Ki | 6.26 | 6.26 | 550.0 | 1 |
| Fatty-acid amide hydrolase 1 CHEMBL2243 | Ki | 5.22 | 5.22 | 6000.0 | 1 |
| Unchecked CHEMBL612545 | Ki | 5.05 | 5.05 | 9000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 2 | Ki | = | 550.0 | nM | 6.26 | Displacement of [3H]CP-55940 from rat forebrain membrane which expresses Cannabi... | 12166944 |
| Fatty-acid amide hydrolase 1 | Ki | = | 6000.0 | nM | 5.22 | Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 ... | 12166944 |
| Unchecked | Ki | = | 9000.0 | nM | 5.05 | Inhibition of N-arachidonoylethanolamine transporter (AEA) activity in human lym... | 12166944 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12166944 | 10.1021/jm020818q | Cannabinoid receptor 1 | 1 |
| 12166944 | 10.1021/jm020818q | Cannabinoid receptor 2 | 1 |
| 12166944 | 10.1021/jm020818q | Fatty-acid amide hydrolase 1 | 1 |
| 12166944 | 10.1021/jm020818q | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine