Compound Detail
CHEMBL327137
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Basic Information
| ChEMBL ID | CHEMBL327137 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CLVUFWXGNIFGNC-PDGVUFFASA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
193.2
MW (Da)
-3.61
ALogP
6
HBA
6
HBD
113.2
PSA (Ų)
0.27
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tissue alpha-L-fucosidase CHEMBL4176 | IC50 | 4.52 | 4.52 | 30000.0 | 1 |
| Neutral alpha-glucosidase C CHEMBL3635 | IC50 | 4.34 | 4.34 | 46000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tissue alpha-L-fucosidase | IC50 | = | 30000.0 | nM | 4.52 | Inhibitory activity against alpha-fucosidase from bovine epididymis | 10560746 |
| Neutral alpha-glucosidase C | IC50 | = | 46000.0 | nM | 4.34 | Inhibitory activity against alpha-glucosidase from rat intestinal maltase | 10560746 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10560746 | 10.1016/s0960-894x(99)00551-x | Neutral alpha-glucosidase C | 2 |
| 10560746 | 10.1016/s0960-894x(99)00551-x | Alpha-galactosidase A | 1 |
| 10560746 | 10.1016/s0960-894x(99)00551-x | Beta-galactosidase | 1 |
| 10560746 | 10.1016/s0960-894x(99)00551-x | Tissue alpha-L-fucosidase | 1 |
Data from ChEMBL 36 via Core Engine