Compound Detail
CHEMBL5080744
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Basic Information
| ChEMBL ID | CHEMBL5080744 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DUKKBXHYYSHSAI-BZNPZCIMSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
205.2
MW (Da)
-1.84
ALogP
5
HBA
4
HBD
84.2
PSA (Ų)
0.43
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysosomal alpha-glucosidase CHEMBL2608 | Ki | 6.44 | 6.44 | 360.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysosomal alpha-glucosidase | Ki | = | 360.0 | nM | 6.44 | Inhibition of human GAA using 4-methylumbelliferyl-alpha-D-glucopyranoside as su... | 35072486 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35072486 | 10.1021/acs.jmedchem.1c01673 | Lysosomal alpha-glucosidase | 1 |
Data from ChEMBL 36 via Core Engine