Compound Detail
CHEMBL259721
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Basic Information
| ChEMBL ID | CHEMBL259721 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RPLSMILMVIUFAQ-VVWMKKEXSA-N |
3
Targets
7
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
254.3
MW (Da)
-4.22
ALogP
6
HBA
5
HBD
124.2
PSA (Ų)
0.32
QED
0
Ro5 Violations
5
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 | 5.49 | 640.0 | 3 |
| Unchecked CHEMBL612545 | IC50 | 5.36 | 5.215 | 4400.0 | 2 |
| Glycogen debranching enzyme CHEMBL5272 | IC50 | 4.8 | 4.8 | 16000.0 | 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 isomaltase | 18258441 |
| Unchecked | IC50 | = | 4400.0 | nM | 5.36 | Inhibition of human lysosomal alpha glucosidase | 18258441 |
| Sucrase-isomaltase, intestinal | IC50 | = | 5200.0 | nM | 5.28 | Inhibition of rat sucrase | 18258441 |
| Unchecked | IC50 | = | 8600.0 | nM | 5.07 | Inhibition of rice alpha-glucosidase | 18258441 |
| Sucrase-isomaltase, intestinal | IC50 | = | 10000.0 | nM | 5.0 | Inhibition of rat intestinal maltase | 18258441 |
| Glycogen debranching enzyme | IC50 | = | 16000.0 | nM | 4.8 | Inhibition of amylo-1,6-glucosidase | 18258441 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18258441 | 10.1016/j.bmc.2008.01.032 | Unchecked | 5 |
| 18258441 | 10.1016/j.bmc.2008.01.032 | Sucrase-isomaltase, intestinal | 3 |
| 18258441 | 10.1016/j.bmc.2008.01.032 | Glycogen debranching enzyme | 1 |
Data from ChEMBL 36 via Core Engine