Compound Detail
CHEMBL37811
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Basic Information
| ChEMBL ID | CHEMBL37811 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XEUMIWURCLCOPI-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
287.3
MW (Da)
3.56
ALogP
5
HBA
0
HBD
51.8
PSA (Ų)
0.69
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 5.85 | 5.85 | 1400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta | IC50 | = | 1400.0 | nM | 5.85 | Inhibitory concentration against human Glycogen synthase kinase-3 | 12031334 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12031334 | 10.1016/s0960-894x(02)00169-5 | Glycogen synthase kinase-3 beta | 1 |
| 24560539 | 10.1016/j.bmcl.2014.01.078 | Fibroblast | 1 |
Data from ChEMBL 36 via Core Engine