Compound Detail
CHEMBL3113269
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Basic Information
| ChEMBL ID | CHEMBL3113269 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QMLUKFKNJYGUOW-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
397.4
MW (Da)
2.57
ALogP
6
HBA
1
HBD
87.1
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 8.82 | 8.82 | 1.5 | 1 |
| Fatty-acid amide hydrolase 1 CHEMBL3229 | IC50 | 8.77 | 8.77 | 1.7 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | IC50 | = | 1.5 | nM | 8.82 | Apparent inhibition of human FAAH expressed in CHOK1 cells using AMCAA as substr... | 24440478 |
| Fatty-acid amide hydrolase 1 | IC50 | = | 1.7 | nM | 8.77 | Apparent inhibition of rat FAAH using AMCAA as substrate after 30 mins by fluore... | 24440478 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24440478 | 10.1016/j.bmc.2013.12.023 | Fatty-acid amide hydrolase 1 | 2 |
Data from ChEMBL 36 via Core Engine