Compound Detail
CHEMBL174048
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Basic Information
| ChEMBL ID | CHEMBL174048 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RZGSPAWMLKONHZ-KTKRTIGZSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
399.6
MW (Da)
8.15
ALogP
4
HBA
0
HBD
56.2
PSA (Ų)
0.15
QED
1
Ro5 Violations
17
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 7.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL3229 | Ki | 7.27 | 7.27 | 54.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | Ki | = | 54.0 | nM | 7.27 | Inhibitory constant determined against recombinant Fatty-acid amide hydrolase fr... | 15771430 |
| Fatty-acid amide hydrolase 1 | Ki | = | 54.0 | nM | 7.27 | Binding affinity against purified rat Fatty-acid amide hydrolase (FAAH) expresse... | 15582420 |
| Fatty-acid amide hydrolase 1 | Ki | = | 54.0 | nM | 7.27 | Inhibition of rat FAAH | 18053726 |
| Fatty-acid amide hydrolase 1 | Ki | = | 54.0 | nM | 7.27 | Inhibition of rat FAAH expressed in Escherichia coli | 18630870 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15771430 | 10.1021/jm049614v | Fatty-acid amide hydrolase 1 | 1 |
| 15582420 | 10.1016/j.bmcl.2004.10.025 | Fatty-acid amide hydrolase 1 | 1 |
| 18053726 | 10.1016/j.bmc.2007.11.015 | Fatty-acid amide hydrolase 1 | 1 |
| 18630870 | 10.1021/jm800136b | Fatty-acid amide hydrolase 1 | 1 |
Data from ChEMBL 36 via Core Engine