Compound Detail
CHEMBL336093
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Basic Information
| ChEMBL ID | CHEMBL336093 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XMTYXUJCIGTOHH-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
398.2
MW (Da)
3.79
ALogP
6
HBA
1
HBD
86.7
PSA (Ų)
0.57
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase Src CHEMBL3074 | IC50 | 6.2 | 6.2 | 630.0 | 1 |
| Fibroblast growth factor receptor CHEMBL2111391 | IC50 | 6.14 | 6.14 | 720.0 | 1 |
| Platelet-derived growth factor receptor CHEMBL2096980 | IC50 | 5.92 | 5.92 | 1200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase Src | IC50 | = | 630.0 | nM | 6.2 | Inhibition of mouse c-Src tyrosine kinase | 9784112 |
| Fibroblast growth factor receptor | IC50 | = | 720.0 | nM | 6.14 | Inhibition of mouse fibroblast growth factor receptor tyrosine kinase (FGFr) | 9784112 |
| Platelet-derived growth factor receptor | IC50 | = | 1200.0 | nM | 5.92 | Inhibition against of platelet-derived growth factor receptor (PDGFr) | 9784112 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9784112 | 10.1021/jm980398y | Platelet-derived growth factor receptor | 1 |
| 9784112 | 10.1021/jm980398y | Fibroblast growth factor receptor | 1 |
| 9784112 | 10.1021/jm980398y | Proto-oncogene tyrosine-protein kinase Src | 1 |
Data from ChEMBL 36 via Core Engine