Compound Detail
CHEMBL575888
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Basic Information
| ChEMBL ID | CHEMBL575888 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CGJRRFJDMMUHJW-LBPRGKRZSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
352.4
MW (Da)
1.53
ALogP
7
HBA
3
HBD
117.2
PSA (Ų)
0.64
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cyclin-dependent kinase 2/cyclin E CHEMBL2094126 | IC50 | 8.7 | 8.7 | 2.0 | 1 |
| Insulin-like growth factor 1 receptor CHEMBL1957 | IC50 | 7.39 | 7.39 | 41.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 7.33 | 7.33 | 47.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cyclin-dependent kinase 2/cyclin E | IC50 | = | 2.0 | nM | 8.7 | Inhibition of CDK2/Cyclin E after 60 mins by fluorescence electrophoresis | 19778024 |
| Insulin-like growth factor 1 receptor | IC50 | = | 41.0 | nM | 7.39 | Inhibition of IGF1R after 60 mins by fluorescence electrophoresis | 19778024 |
| NON-PROTEIN TARGET | IC50 | = | 47.0 | nM | 7.33 | Antiproliferative activity against mouse Sal cells overexpressing IGF1R assessed... | 19778024 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19778024 | 10.1021/jm900786r | Insulin-like growth factor 1 receptor | 1 |
| 19778024 | 10.1021/jm900786r | Cyclin-dependent kinase 2/cyclin E | 1 |
| 19778024 | 10.1021/jm900786r | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine