Compound Detail
CHEMBL2004692
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Basic Information
| ChEMBL ID | CHEMBL2004692 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JCTPJYZESAMIGH-UHFFFAOYSA-N |
10
Targets
10
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
380.4
MW (Da)
1.72
ALogP
10
HBA
2
HBD
137.1
PSA (Ų)
0.40
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 10 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase MRCK alpha CHEMBL4516 | Ki | 6.6 | 6.6 | 251.2 | 1 |
| Glycogen synthase kinase-3 alpha CHEMBL2850 | Ki | 6.0 | 6.0 | 1000.0 | 1 |
| Glycogen synthase kinase-3 beta CHEMBL262 | Ki | 5.9 | 5.9 | 1258.9 | 1 |
| Dual specificity protein kinase CLK4 CHEMBL4203 | Ki | 5.9 | 5.9 | 1258.9 | 1 |
| Cyclin-dependent kinase 2 CHEMBL301 | Ki | 5.4 | 5.4 | 3981.1 | 1 |
| Rho-associated protein kinase 1 CHEMBL3231 | Ki | 5.3 | 5.3 | 5011.9 | 1 |
| Ribosomal protein S6 kinase alpha-3 CHEMBL2345 | Ki | 5.2 | 5.2 | 6309.6 | 1 |
| Rho-associated protein kinase 2 CHEMBL2973 | Ki | 5.2 | 5.2 | 6309.6 | 1 |
| Ribosomal protein S6 kinase beta-1 CHEMBL4501 | Ki | 5.2 | 5.2 | 6309.6 | 1 |
| Protein kinase C delta type CHEMBL2996 | Ki | 5.1 | 5.1 | 7943.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Data from ChEMBL 36 via Core Engine