Compound Detail
CHEMBL157967
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 | CHEMBL157967 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TZAHMEHTLQVSPK-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
456.6
MW (Da)
4.64
ALogP
5
HBA
2
HBD
71.5
PSA (Ų)
0.39
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Myosin light chain kinase, smooth muscle CHEMBL2428 | IC50 | 6.66 | 6.66 | 220.0 | 1 |
| Protein kinase C (PKC) CHEMBL2094266 | IC50 | 6.26 | 6.26 | 550.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Myosin light chain kinase, smooth muscle | IC50 | = | 220.0 | nM | 6.66 | Tested for inhibition of Myosin light chain kinase from chicken gizzard | - |
| Protein kinase C (PKC) | IC50 | = | 550.0 | nM | 6.26 | Tested for inhibition of protein kinase C from rat brain | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(94)00458-R | Protein kinase C (PKC) | 1 |
| - | 10.1016/0960-894X(94)00458-R | Unchecked | 1 |
| - | 10.1016/0960-894X(94)00458-R | cGMP-dependent protein kinase 1 | 1 |
| - | 10.1016/0960-894X(94)00458-R | Myosin light chain kinase, smooth muscle | 1 |
| - | 10.1016/0960-894X(94)00458-R | Tyrosine-protein kinase Blk | 1 |
Data from ChEMBL 36 via Core Engine