Compound Detail
CHEMBL290184
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Basic Information
| ChEMBL ID | CHEMBL290184 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NXSHAXRMBPQCIM-YVMONPNESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
222.6
MW (Da)
1.52
ALogP
2
HBA
2
HBD
58.2
PSA (Ų)
0.56
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 4.74 | 4.74 | 18200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta | IC50 | = | 18200.0 | nM | 4.74 | Inhibition of recombinant GSK3-beta by ELISA | 19616957 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14998338 | 10.1021/jm030450c | Mus musculus | 2 |
| 19616957 | 10.1016/j.bmc.2009.06.054 | Glycogen synthase kinase-3 beta | 1 |
Data from ChEMBL 36 via Core Engine