Compound Detail
CHEMBL361894
GW806290X Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL361894 |
| Name | GW806290X |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WIIIHAKKVLVGJX-UHFFFAOYSA-N |
5
Targets
7
Activities
3
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
346.4
MW (Da)
2.70
ALogP
8
HBA
1
HBD
86.5
PSA (Ų)
0.61
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 9.0
EC50 2 meas. best 7.2
Ki 2 meas. best 8.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 9.0 | 9.0 | 1.0 | 1 |
| Cyclin-dependent kinase 2 CHEMBL301 | Ki | 8.22 | 8.22 | 6.0 | 1 |
| Cyclin-dependent kinase 2 CHEMBL301 | IC50 | 8.2 | 8.2 | 6.3 | 1 |
| Cyclin-dependent kinase 4 CHEMBL331 | Ki | 8.0 | 8.0 | 10.0 | 1 |
| Trypanosoma brucei brucei CHEMBL612851 | EC50 | 7.2 | 7.2 | 63.1 | 1 |
| Cyclin-dependent kinase 4 CHEMBL331 | IC50 | 6.5 | 6.5 | 316.2 | 1 |
| Glycogen synthase kinase-3 beta CHEMBL3669 | EC50 | 6.1 | 6.1 | 800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta | IC50 | = | 1.0 | nM | 9.0 | Inhibition of human GSK3beta using biotinylated-aminohexyl-Ala-Ala-Ala-Lys-Arg-A... | 31846577 |
| Cyclin-dependent kinase 2 | Ki | = | 6.0 | nM | 8.22 | Binding affinity for human cyclin-dependent kinase 2 | 15341487 |
| Cyclin-dependent kinase 2 | IC50 | = | 6.31 | nM | 8.2 | Inhibition of human CDK2 using biotinylated-aminohexyl-Ala-Ala-Ala-Lys-Arg-Arg-G... | 31846577 |
| Cyclin-dependent kinase 4 | Ki | = | 10.0 | nM | 8.0 | Binding affinity for human cyclin-dependent kinase 4 | 15341487 |
| Trypanosoma brucei brucei | EC50 | = | 63.1 | nM | 7.2 | Antitrypanosomal activity against Trypanosoma brucei brucei Lister 427 blood str... | 31846577 |
| Cyclin-dependent kinase 4 | IC50 | = | 316.23 | nM | 6.5 | Inhibition of human CDK4 using biotinylated-aminohexyl-Ala-Ala-Ala-Lys-Arg-Arg-G... | 31846577 |
| Glycogen synthase kinase-3 beta | EC50 | = | 800.0 | nM | 6.1 | Effective concentration to increase glycogen deposition in rat skeletal muscle L... | 15341487 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL1961873 | Tyrosine-protein kinase ABL1 | 14 |
| - | 10.6019/CHEMBL1961873 | Epidermal growth factor receptor | 10 |
| - | 10.6019/CHEMBL1961873 | Platelet-derived growth factor receptor alpha | 8 |
| - | 10.6019/CHEMBL1961873 | Mast/stem cell growth factor receptor Kit | 8 |
| - | 10.6019/CHEMBL1961873 | Proto-oncogene tyrosine-protein kinase receptor Ret | 6 |
| - | 10.6019/CHEMBL1961873 | Cyclin-dependent kinase 2 | 4 |
| - | 10.6019/CHEMBL1961873 | Receptor-type tyrosine-protein kinase FLT3 | 4 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase B-raf | 4 |
| - | 10.6019/CHEMBL1961873 | Protein kinase C beta type | 4 |
| - | 10.6019/CHEMBL1961873 | Tyrosine-protein kinase Lyn | 4 |
| - | 10.6019/CHEMBL1961873 | Leucine-rich repeat serine/threonine-protein kinase 2 | 4 |
| 15341487 | 10.1021/jm040063i | Glycogen synthase kinase-3 beta | 3 |
| - | 10.6019/CHEMBL1961873 | Ribosomal protein S6 kinase beta-1 | 2 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase D2 | 2 |
| - | 10.6019/CHEMBL1961873 | cAMP-dependent protein kinase catalytic subunit alpha | 2 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase D1 | 2 |
| - | 10.6019/CHEMBL1961873 | Ribosomal protein S6 kinase alpha-4 | 2 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase MRCK alpha | 2 |
| - | 10.6019/CHEMBL1961873 | G protein-coupled receptor kinase 6 | 2 |
| - | 10.6019/CHEMBL1961873 | RAC-gamma serine/threonine-protein kinase | 2 |
Data from ChEMBL 36 via Core Engine