Compound Detail
CHEMBL3217947
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Basic Information
| ChEMBL ID | CHEMBL3217947 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ISUJNJHQIOHFBL-UHFFFAOYSA-N |
3
Targets
5
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
353.4
MW (Da)
6.21
ALogP
4
HBA
1
HBD
43.0
PSA (Ų)
0.42
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 7.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 7.75 | 7.395 | 18.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 7.01 | 6.69 | 98.0 | 2 |
| Fatty-acid amide hydrolase 1 CHEMBL3229 | IC50 | 6.23 | 6.23 | 586.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | IC50 | = | 18.0 | nM | 7.75 | Inhibition of human FAAH expressed in HEK293 cells using arachadonyl 7-amino 4-m... | - |
| Fatty-acid amide hydrolase 1 | IC50 | = | 92.0 | nM | 7.04 | Reversible inhibition of full length human FAAH assessed as inhibition of 3[H]-a... | - |
| Unchecked | IC50 | = | 98.0 | nM | 7.01 | Inhibition of rabbit brain FAAH | - |
| Unchecked | IC50 | = | 424.0 | nM | 6.37 | Inhibition of guinea pig brain FAAH | - |
| Fatty-acid amide hydrolase 1 | IC50 | = | 586.0 | nM | 6.23 | Inhibition of rat FAAH expressed in HEK293 cells using arachadonyl 7-amino 4-met... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C2MD00307D | Fatty-acid amide hydrolase 1 | 3 |
| - | 10.1039/C2MD00307D | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine