Compound Detail
CHEMBL5185154
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Basic Information
| ChEMBL ID | CHEMBL5185154 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CKTWXAFQZGEACT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
238.3
MW (Da)
2.55
ALogP
2
HBA
2
HBD
55.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 4.3 | 4.3 | 50000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta | IC50 | = | 50000.0 | nM | 4.3 | Inhibition of recombinant human GSK3beta (636 to 661 residues) assessed as reduc... | 37054760 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37054760 | 10.1016/j.bmcl.2023.129283 | Glycogen synthase kinase-3 beta | 2 |
| 34780899 | 10.1016/j.bmcl.2021.128449 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine