Compound Detail
CHEMBL1229652
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Basic Information
| ChEMBL ID | CHEMBL1229652 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KPCHRAXFURQEBV-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
296.2
MW (Da)
3.73
ALogP
4
HBA
2
HBD
100.9
PSA (Ų)
0.58
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein kinase pim-1 CHEMBL2147 | IC50 | 7.51 | 7.51 | 31.0 | 1 |
| Casein kinase 2 CHEMBL3832943 | IC50 | 6.7 | 6.7 | 200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein kinase pim-1 | IC50 | = | 31.0 | nM | 7.51 | Inhibition of PIM1 (unknown origin) | 36745746 |
| Casein kinase 2 | IC50 | = | 200.0 | nM | 6.7 | Inhibition of CK2 (unknown origin) | 36745746 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36745746 | 10.1021/acs.jmedchem.2c01523 | Casein kinase 2 | 1 |
| 36745746 | 10.1021/acs.jmedchem.2c01523 | Serine/threonine-protein kinase pim-1 | 1 |
Data from ChEMBL 36 via Core Engine