Compound Detail
CHEMBL48650
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Basic Information
| ChEMBL ID | CHEMBL48650 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LRBIUVIHDLIKSO-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
280.3
MW (Da)
2.90
ALogP
4
HBA
3
HBD
82.5
PSA (Ų)
0.63
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tyrosine-protein kinase Lck CHEMBL258 | IC50 | 6.0 | 6.0 | 1000.0 | 1 |
| Epidermal growth factor receptor CHEMBL203 | IC50 | 5.11 | 5.11 | 7700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tyrosine-protein kinase Lck | IC50 | = | 1000.0 | nM | 6.0 | Inhibition of p56 lck tyrosine kinase | - |
| Epidermal growth factor receptor | IC50 | = | 7700.0 | nM | 5.11 | Inhibition of epidermal growth factor receptor (EGFR) | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(00)80473-4 | Epidermal growth factor receptor | 1 |
| - | 10.1016/S0960-894X(00)80473-4 | Tyrosine-protein kinase Lck | 1 |
Data from ChEMBL 36 via Core Engine