Compound Detail
CHEMBL310229
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Basic Information
| ChEMBL ID | CHEMBL310229 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AORXTDSJOOFVRB-IWSPIJDZSA-N |
1
Targets
9
Activities
2
Assay Types
0
PK Parameters
12
Publications
0
Known Names
Molecular Properties
189.2
MW (Da)
-0.82
ALogP
4
HBA
3
HBD
63.9
PSA (Ų)
0.54
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas.
Ki 3 meas. best 4.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 4.02 | 4.02 | 95000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 95000.0 | nM | 4.02 | Competitive Inhibitory activity against Endoplasmic reticulum Alpha-Glucosidase ... | 7608901 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37314161 | 10.1021/acs.jmedchem.3c00637 | Lysosomal alpha-glucosidase | 5 |
| 7608901 | 10.1021/jm00013a012 | Unchecked | 4 |
| 7608901 | 10.1021/jm00013a012 | Sucrase-isomaltase, intestinal | 2 |
| 7608901 | 10.1021/jm00013a012 | Alpha-mannosidase 2 | 2 |
| 7608901 | 10.1021/jm00013a012 | MT4 | 2 |
| 7608901 | 10.1021/jm00013a012 | MOLT-4 | 2 |
| 7608901 | 10.1021/jm00013a012 | Maltase-glucoamylase | 1 |
| 7608901 | 10.1021/jm00013a012 | Trehalase | 1 |
| 7608901 | 10.1021/jm00013a012 | Lactase/phlorizin hydrolase | 1 |
| 7608901 | 10.1021/jm00013a012 | Alpha-mannosidase 2C1 | 1 |
| 7608901 | 10.1021/jm00013a012 | Mannosidase 2, alpha B1 | 1 |
| 37314161 | 10.1021/acs.jmedchem.3c00637 | Lysosomal acid glucosylceramidase | 1 |
Data from ChEMBL 36 via Core Engine