Compound Detail
CHEMBL1467423
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Basic Information
| ChEMBL ID | CHEMBL1467423 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UYBVPYFAXHSIPV-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
12
Publications
0
Known Names
Molecular Properties
240.3
MW (Da)
2.25
ALogP
3
HBA
3
HBD
61.4
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.87
Ki 1 meas. best 6.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Alpha-glucosidase CHEMBL5291954 | Ki | 6.38 | 6.38 | 420.0 | 1 |
| Alpha-glucosidase CHEMBL5291954 | IC50 | 5.87 | 5.87 | 1350.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Alpha-glucosidase | Ki | = | 420.0 | nM | 6.38 | Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alp... | 36680985 |
| Alpha-glucosidase | IC50 | = | 1350.0 | nM | 5.87 | Inhibition of Saccharomyces cerevisiae alpha-glucosidase using p-nitrophenyl-alp... | 36680985 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36680985 | 10.1016/j.ejmech.2023.115119 | Alpha-glucosidase | 2 |
| 38784470 | 10.1039/d3md00600j | HT-29 | 2 |
| 38784470 | 10.1039/d3md00600j | U-87 MG | 2 |
| 38784470 | 10.1039/d3md00600j | MCF7 | 2 |
| 38784470 | 10.1039/d3md00600j | A2780 | 2 |
| 38784470 | 10.1039/d3md00600j | NCI-H460 | 2 |
| 38784470 | 10.1039/d3md00600j | A-431 | 2 |
| 38784470 | 10.1039/d3md00600j | DU-145 | 2 |
| 38784470 | 10.1039/d3md00600j | BE(2)-C | 2 |
| 38784470 | 10.1039/d3md00600j | Unchecked | 2 |
| 38784470 | 10.1039/d3md00600j | MIA PaCa-2 | 2 |
| 38784470 | 10.1039/d3md00600j | MCF-10A | 2 |
Data from ChEMBL 36 via Core Engine