Compound Detail
CHEMBL4642907
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Basic Information
| ChEMBL ID | CHEMBL4642907 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZSTZNGPOKKKVCT-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
264.3
MW (Da)
3.04
ALogP
3
HBA
0
HBD
36.3
PSA (Ų)
0.80
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| N-acylethanolamine-hydrolyzing acid amidase CHEMBL4349 | IC50 | 8.55 | 8.12 | 2.8 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| N-acylethanolamine-hydrolyzing acid amidase | IC50 | = | 2.8 | nM | 8.55 | Inhibition of activated human NAAA using fluorogenic PAMCA and N-4-methylcoumari... | 31761726 |
| N-acylethanolamine-hydrolyzing acid amidase | IC50 | = | 2.8 | nM | 8.55 | Inhibition of NAAA (unknown origin) | 33900772 |
| N-acylethanolamine-hydrolyzing acid amidase | IC50 | = | 55.0 | nM | 7.26 | Inhibition Assay: In order to have an assay method more conducive to high-throug... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31761726 | 10.1016/j.bmc.2019.115195 | N-acylethanolamine-hydrolyzing acid amidase | 2 |
| 33900772 | 10.1021/acs.jmedchem.1c00076 | N-acylethanolamine-hydrolyzing acid amidase | 1 |
Data from ChEMBL 36 via Core Engine