Compound Detail
CHEMBL2177689
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL2177689 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LDCCTFVPMAHPSF-JKUQZMGJSA-N |
3
Targets
7
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
147.2
MW (Da)
-1.94
ALogP
4
HBA
4
HBD
72.7
PSA (Ų)
0.35
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 7 meas. best 6.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sucrase-isomaltase, intestinal CHEMBL3114 | IC50 | 6.19 | 6.0625 | 640.0 | 4 |
| Acidic alpha-glucosidase CHEMBL3513 | IC50 | 5.54 | 5.54 | 2900.0 | 1 |
| Lysosomal alpha-glucosidase CHEMBL2608 | IC50 | 5.25 | 5.25 | 5600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sucrase-isomaltase, intestinal | IC50 | = | 640.0 | nM | 6.19 | Inhibition of rat intestinal sucrase assessed as release of p-nitrophenol using ... | 35255314 |
| Sucrase-isomaltase, intestinal | IC50 | = | 660.0 | nM | 6.18 | Inhibition of rat intestinal sucrase using sucrose as substrate | 23106358 |
| Sucrase-isomaltase, intestinal | IC50 | = | 660.0 | nM | 6.18 | Inhibition of rat intestinal sucrase | 35072486 |
| Sucrase-isomaltase, intestinal | IC50 | = | 2000.0 | nM | 5.7 | Inhibition of rat intestinal isomaltase assessed as release of p-nitrophenol usi... | 35255314 |
| Acidic alpha-glucosidase | IC50 | = | 2900.0 | nM | 5.54 | Inhibition of rat intestinal maltase assessed as release of D-glucose using malt... | 35255314 |
| Lysosomal alpha-glucosidase | IC50 | = | 5600.0 | nM | 5.25 | Inhibition of human lysosomal alpha glucosidase assessed as release of p-nitroph... | 35255314 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35255314 | 10.1016/j.ejmech.2022.114230 | Sucrase-isomaltase, intestinal | 2 |
| 35255314 | 10.1016/j.ejmech.2022.114230 | Unchecked | 2 |
| 23106358 | 10.1021/jm301304e | Sucrase-isomaltase, intestinal | 1 |
| 35072486 | 10.1021/acs.jmedchem.1c01673 | Sucrase-isomaltase, intestinal | 1 |
| 35255314 | 10.1016/j.ejmech.2022.114230 | Acidic alpha-glucosidase | 1 |
| 35255314 | 10.1016/j.ejmech.2022.114230 | Lysosomal alpha-glucosidase | 1 |
Data from ChEMBL 36 via Core Engine