Compound Detail
CHEMBL87084
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Basic Information
| ChEMBL ID | CHEMBL87084 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PWPSIWFFYVGDHO-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
238.2
MW (Da)
2.71
ALogP
4
HBA
2
HBD
66.2
PSA (Ų)
0.64
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 5.3 | 5.3 | 5000.0 | 1 |
| Platelet-derived growth factor receptor CHEMBL2095189 | IC50 | 4.44 | 4.44 | 36000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 5000.0 | nM | 5.3 | Inhibition of Epidermal growth factor receptor tyrosine kinase | 8064792 |
| Platelet-derived growth factor receptor | IC50 | = | 36000.0 | nM | 4.44 | Inhibition of Platelet-derived growth factor receptor tyrosine kinase | 8064792 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8064792 | 10.1021/jm00043a002 | Platelet-derived growth factor receptor | 1 |
| 8064792 | 10.1021/jm00043a002 | Epidermal growth factor receptor | 1 |
| 8064792 | 10.1021/jm00043a002 | Receptor tyrosine-protein kinase erbB-2 | 1 |
| 8064792 | 10.1021/jm00043a002 | Tyrosine-protein kinase Lck | 1 |
| 8064792 | 10.1021/jm00043a002 | Unchecked | 1 |
| 8064792 | 10.1021/jm00043a002 | Protein kinase C (PKC) | 1 |
Data from ChEMBL 36 via Core Engine