Compound Detail
CHEMBL3798032
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Basic Information
| ChEMBL ID | CHEMBL3798032 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SWMONNLADWPHPX-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
2
PK Parameters
7
Publications
0
Known Names
Molecular Properties
472.4
MW (Da)
5.84
ALogP
4
HBA
1
HBD
44.8
PSA (Ų)
0.44
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.21
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 8.21 | 8.21 | 6.1 | 1 |
| Fatty-acid amide hydrolase 1 CHEMBL3229 | IC50 | 7.66 | 7.66 | 22.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 1.0 | hr | Rattus norvegicus |
| T1/2 | 0.75 | hr | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | IC50 | = | 6.1 | nM | 8.21 | Inhibition of human FAAH expressed in HEK293 cells using AMC arachidonyl amide a... | 31945644 |
| Fatty-acid amide hydrolase 1 | IC50 | = | 22.0 | nM | 7.66 | Inhibition of FAAH in Sprague-Dawley rat brain homogenate using arachidonoyl-eth... | 31945644 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C5MD00590F | D(3) dopamine receptor | 2 |
| 31945644 | 10.1016/j.ejmech.2019.111953 | Fatty-acid amide hydrolase 1 | 2 |
| - | 10.1039/C5MD00590F | Plasma | 1 |
| - | 10.1039/C5MD00590F | Liver microsome | 1 |
| - | 10.1039/C5MD00590F | No relevant target | 1 |
| - | 10.1039/C5MD00590F | Fatty-acid amide hydrolase 1 | 1 |
| 31945644 | 10.1016/j.ejmech.2019.111953 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine