Compound Detail
CHEMBL460255
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 | CHEMBL460255 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZCFDZGVJJBUOOF-UHFFFAOYSA-N |
2
Targets
6
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
344.4
MW (Da)
-4.58
ALogP
9
HBA
8
HBD
184.9
PSA (Ų)
0.20
QED
1
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.0
Ki 3 meas. best 7.28
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sucrase-isomaltase, intestinal CHEMBL3114 | Ki | 7.28 | 6.33 | 52.0 | 2 |
| Sucrase-isomaltase, intestinal CHEMBL3114 | IC50 | 7.0 | 6.865 | 99.0 | 2 |
| Acidic alpha-glucosidase CHEMBL3513 | Ki | 6.96 | 6.96 | 110.0 | 1 |
| Acidic alpha-glucosidase CHEMBL3513 | IC50 | 6.64 | 6.64 | 227.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sucrase-isomaltase, intestinal | Ki | = | 52.0 | nM | 7.28 | Inhibition of rat intestinal sucrase | 18547114 |
| Sucrase-isomaltase, intestinal | IC50 | = | 99.0 | nM | 7.0 | Inhibition of rat intestinal isomaltase | 18547114 |
| Acidic alpha-glucosidase | Ki | = | 110.0 | nM | 6.96 | Inhibition of rat intestinal maltase | 18547114 |
| Sucrase-isomaltase, intestinal | IC50 | = | 186.0 | nM | 6.73 | Inhibition of rat intestinal sucrase | 18547114 |
| Acidic alpha-glucosidase | IC50 | = | 227.0 | nM | 6.64 | Inhibition of rat intestinal maltase | 18547114 |
| Sucrase-isomaltase, intestinal | Ki | = | 4200.0 | nM | 5.38 | Inhibition of rat intestinal isomaltase | 18547114 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18547114 | 10.1021/np070604h | Sucrase-isomaltase, intestinal | 4 |
| 18547114 | 10.1021/np070604h | Acidic alpha-glucosidase | 2 |
| 18547114 | 10.1021/np070604h | Pancreatic alpha-amylase | 1 |
Data from ChEMBL 36 via Core Engine