Compound Detail
CHEMBL1761303
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Basic Information
| ChEMBL ID | CHEMBL1761303 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KPHKKPXBQCDXEL-SFHVURJKSA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
456.6
MW (Da)
4.73
ALogP
8
HBA
0
HBD
68.8
PSA (Ų)
0.39
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.7
EC50 1 meas. best 7.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 8.7 | 8.7 | 2.0 | 1 |
| Fatty-acid amide hydrolase 1 CHEMBL3229 | IC50 | 7.58 | 7.58 | 26.0 | 1 |
| Fatty-acid amide hydrolase 1 CHEMBL3229 | EC50 | 7.1 | 7.1 | 80.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | IC50 | = | 2.0 | nM | 8.7 | Inhibition of human FAAH assessed as hydrolysis of anandamido-amino-methyl-cumar... | 21392988 |
| Fatty-acid amide hydrolase 1 | IC50 | = | 26.0 | nM | 7.58 | Inhibition of rat FAAH assessed as hydrolysis of anandamido-amino-methyl-cumarin | 21392988 |
| Fatty-acid amide hydrolase 1 | EC50 | = | 80.0 | nM | 7.1 | Inhibition of FAAH in rat RBL cell assessed as conversion of [3H]AEA to [3H]etha... | 21392988 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21392988 | 10.1016/j.bmcl.2011.02.052 | Fatty-acid amide hydrolase 1 | 3 |
Data from ChEMBL 36 via Core Engine