Compound Detail
CHEMBL1096290
GSK-1000163A Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1096290 |
| Name | GSK-1000163A |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JHBURLBWOXZZGX-UHFFFAOYSA-N |
7
Targets
7
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
395.5
MW (Da)
1.80
ALogP
9
HBA
2
HBD
119.1
PSA (Ų)
0.64
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 7 meas. best 8.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAC-alpha serine/threonine-protein kinase CHEMBL4282 | IC50 | 8.22 | 8.22 | 6.0 | 1 |
| RAC-gamma serine/threonine-protein kinase CHEMBL4816 | IC50 | 7.66 | 7.66 | 22.0 | 1 |
| RAC-beta serine/threonine-protein kinase CHEMBL2431 | IC50 | 6.7 | 6.7 | 200.0 | 1 |
| LNCaP CHEMBL612518 | IC50 | 6.5 | 6.5 | 313.0 | 1 |
| BT-474 CHEMBL614529 | IC50 | 5.9 | 5.9 | 1250.0 | 1 |
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 5.57 | 5.57 | 2700.0 | 1 |
| HFF CHEMBL614071 | IC50 | 4.52 | 4.52 | 30000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAC-alpha serine/threonine-protein kinase | IC50 | = | 6.0 | nM | 8.22 | Inhibition of AKT | 19179070 |
| RAC-gamma serine/threonine-protein kinase | IC50 | = | 22.0 | nM | 7.66 | Inhibition of AKT3 | 19179070 |
| RAC-beta serine/threonine-protein kinase | IC50 | = | 200.0 | nM | 6.7 | Inhibition of AKT2 | 19179070 |
| LNCaP | IC50 | = | 313.0 | nM | 6.5 | Antiproliferative activity against human LNCAP cells | 19179070 |
| BT-474 | IC50 | = | 1250.0 | nM | 5.9 | Antiproliferative activity against human BT474 cells | 19179070 |
| Glycogen synthase kinase-3 beta | IC50 | = | 2700.0 | nM | 5.57 | Inhibition of GSK3-beta phosphorylation in human BT474 cells | 19179070 |
| HFF | IC50 | = | 30000.0 | nM | 4.52 | Antiproliferative activity against human HFF cells | 19179070 |
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 | Mast/stem cell growth factor receptor Kit | 8 |
| - | 10.6019/CHEMBL1961873 | Platelet-derived growth factor receptor alpha | 8 |
| - | 10.6019/CHEMBL1961873 | Proto-oncogene tyrosine-protein kinase receptor Ret | 6 |
| - | 10.6019/CHEMBL1961873 | Protein kinase C beta type | 4 |
| - | 10.6019/CHEMBL1961873 | Leucine-rich repeat serine/threonine-protein kinase 2 | 4 |
| - | 10.6019/CHEMBL1961873 | Cyclin-dependent kinase 2 | 4 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase B-raf | 4 |
| - | 10.6019/CHEMBL1961873 | Receptor-type tyrosine-protein kinase FLT3 | 4 |
| - | 10.6019/CHEMBL1961873 | Tyrosine-protein kinase Lyn | 4 |
| - | 10.6019/CHEMBL1961873 | G protein-coupled receptor kinase 6 | 2 |
| - | 10.6019/CHEMBL2007661 | Serine/threonine-protein kinase TBK1 | 2 |
| - | 10.6019/CHEMBL1961873 | Ribosomal protein S6 kinase alpha-5 | 2 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase MRCK beta | 2 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase MRCK alpha | 2 |
| - | 10.6019/CHEMBL1961873 | Rhodopsin kinase GRK7 | 2 |
| - | 10.6019/CHEMBL1961873 | RAC-gamma serine/threonine-protein kinase | 2 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase D2 | 2 |
| - | 10.6019/CHEMBL1961873 | Serine/threonine-protein kinase D1 | 2 |
Data from ChEMBL 36 via Core Engine