Compound Detail
CHEMBL3926655
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Basic Information
| ChEMBL ID | CHEMBL3926655 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IVNBEGUEJZHZPO-IWSPIJDZSA-N |
1
Targets
5
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
248.3
MW (Da)
-0.94
ALogP
4
HBA
4
HBD
76.0
PSA (Ų)
0.38
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 5 meas. best 6.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.02 | 4.875 | 960.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 960.0 | nM | 6.02 | Competitive inhibition of bovine liver cytosolic beta-glucosidase using beta-D-g... | 26361824 |
| Unchecked | Ki | = | 19000.0 | nM | 4.72 | Competitive inhibition of baker's yeast isomaltase after 10 to 30 mins by Linewe... | 26361824 |
| Unchecked | Ki | = | 25000.0 | nM | 4.6 | Competitive inhibition of almond beta-glucosidase using beta-D-glycopyranoside a... | 26361824 |
| Unchecked | Ki | = | 69000.0 | nM | 4.16 | Competitive inhibition of baker's yeast alpha-glucosidase using alpha-D-glycopyr... | 26361824 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26361824 | 10.1016/j.ejmech.2015.08.038 | Unchecked | 7 |
| 26361824 | 10.1016/j.ejmech.2015.08.038 | Alpha-galactosidase | 1 |
| 26361824 | 10.1016/j.ejmech.2015.08.038 | Beta-galactosidase | 1 |
| 26361824 | 10.1016/j.ejmech.2015.08.038 | Alpha-mannosidase | 1 |
Data from ChEMBL 36 via Core Engine