Compound Detail
CHEMBL1809194
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Basic Information
| ChEMBL ID | CHEMBL1809194 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UBHVSGGXYKHEIW-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
522.4
MW (Da)
3.97
ALogP
8
HBA
1
HBD
87.9
PSA (Ų)
0.42
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Insulin-like growth factor 1 receptor CHEMBL1957 | IC50 | 8.52 | 8.285 | 3.0 | 2 |
| Cyclin-dependent kinase 2 CHEMBL301 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Insulin-like growth factor 1 receptor | IC50 | = | 3.0 | nM | 8.52 | Inhibition of IGF1R | 21775140 |
| Insulin-like growth factor 1 receptor | IC50 | = | 9.0 | nM | 8.05 | Inhibition of IGF1-induced autophosphorylation of human recombinant IGF1R expres... | 21775140 |
| Cyclin-dependent kinase 2 | IC50 | = | 1100.0 | nM | 5.96 | Inhibition of CDK2 | 21775140 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21775140 | 10.1016/j.bmcl.2011.06.093 | Insulin-like growth factor 1 receptor | 2 |
| 21775140 | 10.1016/j.bmcl.2011.06.093 | Cyclin-dependent kinase 2 | 1 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine