Compound Detail
CHEMBL185962
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Basic Information
| ChEMBL ID | CHEMBL185962 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CTCKXCOHXZAARD-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
242.2
MW (Da)
1.40
ALogP
7
HBA
1
HBD
95.7
PSA (Ų)
0.73
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Ribosomal protein S6 kinase alpha-5 CHEMBL4237 | IC50 | 8.82 | 8.78 | 1.5 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Ribosomal protein S6 kinase alpha-5 | IC50 | = | 1.5 | nM | 8.82 | Inhibitory concentration against MSK-1 | 15955699 |
| Ribosomal protein S6 kinase alpha-5 | IC50 | = | 1.8 | nM | 8.74 | Inhibitory concentration exhibited towards MSK-1 | 15950465 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL1961873 | Tyrosine-protein kinase ABL1 | 28 |
| - | 10.6019/CHEMBL1961873 | Epidermal growth factor receptor | 20 |
| - | 10.6019/CHEMBL1961873 | Mast/stem cell growth factor receptor Kit | 16 |
| - | 10.6019/CHEMBL1961873 | Platelet-derived growth factor receptor alpha | 16 |
| - | 10.6019/CHEMBL1961873 | Proto-oncogene tyrosine-protein kinase receptor Ret | 12 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase B-raf | 8 |
| - | 10.6019/CHEMBL1961873 | Leucine-rich repeat serine/threonine-protein kinase 2 | 8 |
| - | 10.6019/CHEMBL1961873 | Tyrosine-protein kinase Lyn | 8 |
| - | 10.6019/CHEMBL1961873 | Protein kinase C beta type | 8 |
| - | 10.6019/CHEMBL1961873 | Receptor-type tyrosine-protein kinase FLT3 | 8 |
| - | 10.6019/CHEMBL1961873 | Cyclin-dependent kinase 2 | 8 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase MRCK beta | 4 |
| - | 10.6019/CHEMBL1961873 | Ribosomal protein S6 kinase alpha-5 | 4 |
| - | 10.6019/CHEMBL1961873 | Ribosomal protein S6 kinase alpha-4 | 4 |
| - | 10.6019/CHEMBL1961873 | Ribosomal protein S6 kinase beta-1 | 4 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase D3 | 4 |
| - | 10.6019/CHEMBL1961873 | cAMP-dependent protein kinase catalytic subunit alpha | 4 |
| - | 10.6019/CHEMBL1961873 | G protein-coupled receptor kinase 6 | 4 |
| - | 10.6019/CHEMBL1961873 | RAC-gamma serine/threonine-protein kinase | 4 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase D2 | 4 |
Data from ChEMBL 36 via Core Engine