Compound Detail
CHEMBL4224990
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Basic Information
| ChEMBL ID | CHEMBL4224990 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VCAZMKAHPZWESR-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
245.8
MW (Da)
4.03
ALogP
1
HBA
1
HBD
26.0
PSA (Ų)
0.87
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas.
Kd 1 meas. best 4.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Casein kinase 2 CHEMBL3832943 | Kd | 4.77 | 4.77 | 17000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Casein kinase 2 | Kd | = | 17000.0 | nM | 4.77 | Binding affinity to CK2 (unknown origin) | 36745746 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29759799 | 10.1016/j.bmc.2018.05.011 | Casein kinase II alpha/beta | 1 |
| 33119282 | 10.1021/acs.jmedchem.0c01173 | Casein kinase II subunit alpha | 1 |
| 36745746 | 10.1021/acs.jmedchem.2c01523 | Casein kinase 2 | 1 |
Data from ChEMBL 36 via Core Engine