Compound Detail
CHEMBL2376207
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Basic Information
| ChEMBL ID | CHEMBL2376207 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VAYJAEOCYWSGBB-UHFFFAOYSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
265.3
MW (Da)
2.91
ALogP
3
HBA
0
HBD
46.6
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone acetyltransferase RTT109 CHEMBL3414417 | IC50 | 5.52 | 5.265 | 3000.0 | 2 |
| Fatty-acid amide hydrolase 1 CHEMBL3229 | IC50 | 5.28 | 5.28 | 5300.0 | 1 |
| Monoglyceride lipase CHEMBL4191 | IC50 | 5.01 | 5.01 | 9700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone acetyltransferase RTT109 | IC50 | = | 3000.0 | nM | 5.52 | Inhibition of Vps75-stimulated recombinant Saccharomyces cerevisiae histone acet... | 25634295 |
| Fatty-acid amide hydrolase 1 | IC50 | = | 5300.0 | nM | 5.28 | Inhibition of FAAH in Sprague-Dawley rat brain microsomes assessed as N-(2-hydro... | 23455058 |
| Monoglyceride lipase | IC50 | = | 9700.0 | nM | 5.01 | Inhibition of human recombinant MAGL-mediated 1,3-dihydroxypropan-1-yl 4-pyren-1... | 23455058 |
| Histone acetyltransferase RTT109 | IC50 | = | 9700.0 | nM | 5.01 | Inhibition of Vps75-stimulated recombinant Saccharomyces cerevisiae histone acet... | 25634295 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25634295 | 10.1021/jm5019093 | No relevant target | 4 |
| 25634295 | 10.1021/jm5019093 | Histone acetyltransferase RTT109 | 4 |
| 30523084 | 10.1126/science.aat9446 | Plasmodium berghei | 4 |
| 30523084 | 10.1126/science.aat9446 | HepG2-CD81 | 2 |
| 23455058 | 10.1016/j.ejmech.2013.01.050 | Fatty-acid amide hydrolase 1 | 1 |
| 23455058 | 10.1016/j.ejmech.2013.01.050 | Monoglyceride lipase | 1 |
Data from ChEMBL 36 via Core Engine