Compound Detail
CHEMBL1766573
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 | CHEMBL1766573 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OZULYIIGBMRTMW-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
318.3
MW (Da)
2.44
ALogP
6
HBA
1
HBD
69.0
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase 14 CHEMBL260 | IC50 | 6.58 | 6.58 | 260.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.82 | 4.77 | 15200.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase 14 | IC50 | = | 260.0 | nM | 6.58 | Inhibition of human recombinant p38alpha assessed as incorporation of 33P from g... | 21375264 |
| Unchecked | IC50 | = | 15200.0 | nM | 4.82 | Inhibition of ADP-BODIPY binding to Thermotoga maritima HK853 in presence of Tri... | 29706527 |
| Unchecked | IC50 | = | 19100.0 | nM | 4.72 | Inhibition of ADP-BODIPY binding to Thermotoga maritima HK853 by fluorescence po... | 29706527 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29706527 | 10.1016/j.bmc.2018.04.047 | Unchecked | 5 |
| 21375264 | 10.1021/jm101423y | Mitogen-activated protein kinase 14 | 1 |
| 29706527 | 10.1016/j.bmc.2018.04.047 | Sensor protein kinase WalK | 1 |
Data from ChEMBL 36 via Core Engine