Compound Detail
CHEMBL26101
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Basic Information
| ChEMBL ID | CHEMBL26101 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LDHHNMNHSWWSNP-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
190.3
MW (Da)
1.48
ALogP
5
HBA
0
HBD
26.9
PSA (Ų)
0.66
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 4.7 | 4.7 | 20000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta | IC50 | = | 20000.0 | nM | 4.7 | Inhibitory activity against recombinant rabbit Glycogen synthase kinase-3 beta | 11881998 |
| Glycogen synthase kinase-3 beta | IC50 | = | 20000.0 | nM | 4.7 | Inhibition of GSK-3beta (unknown origin) using GS-1 as substrate incubated for 2... | 35390715 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11881998 | 10.1021/jm011020u | Glycogen synthase kinase-3 beta | 1 |
| 35390715 | 10.1016/j.ejmech.2022.114301 | Glycogen synthase kinase-3 beta | 1 |
Data from ChEMBL 36 via Core Engine