Compound Detail
CHEMBL2002599
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Basic Information
| ChEMBL ID | CHEMBL2002599 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VEZQCXWMPWTPJL-UHFFFAOYSA-N |
9
Targets
9
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
376.4
MW (Da)
2.75
ALogP
6
HBA
2
HBD
92.3
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 9 meas. best 8.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | Ki | 8.1 | 8.1 | 7.9 | 1 |
| Glycogen synthase kinase-3 alpha CHEMBL2850 | Ki | 8.0 | 8.0 | 10.0 | 1 |
| Dual specificity protein kinase CLK4 CHEMBL4203 | Ki | 7.0 | 7.0 | 100.0 | 1 |
| Cyclin-dependent kinase 8 CHEMBL5719 | Ki | 7.0 | 7.0 | 100.0 | 1 |
| Dual specificity tyrosine-phosphorylation-regulated kinase 1B CHEMBL5543 | Ki | 6.1 | 6.1 | 794.3 | 1 |
| Proto-oncogene tyrosine-protein kinase receptor Ret CHEMBL2041 | Ki | 5.7 | 5.7 | 1995.3 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | Ki | 5.7 | 5.7 | 1995.3 | 1 |
| Casein kinase I isoform alpha CHEMBL2793 | Ki | 5.5 | 5.5 | 3162.3 | 1 |
| Activin receptor type-1 CHEMBL5903 | Ki | 5.5 | 5.5 | 3162.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine