Compound Detail
CHEMBL55137
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Basic Information
| ChEMBL ID | CHEMBL55137 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WSMYEMDZCLVLJH-UHFFFAOYSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
404.6
MW (Da)
5.35
ALogP
5
HBA
2
HBD
53.3
PSA (Ų)
0.41
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fibroblast growth factor receptor 3 CHEMBL2742 | IC50 | 5.85 | 5.85 | 1400.0 | 1 |
| Platelet-derived growth factor receptor alpha CHEMBL2007 | IC50 | 5.7 | 5.7 | 2000.0 | 1 |
| Mast/stem cell growth factor receptor Kit CHEMBL1936 | IC50 | 5.6 | 5.52 | 2500.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fibroblast growth factor receptor 3 | IC50 | = | 1400.0 | nM | 5.85 | Inhibitory activity against Fibroblast growth factor receptor 3 | 16190746 |
| Platelet-derived growth factor receptor alpha | IC50 | = | 2000.0 | nM | 5.7 | Inhibitory activity against Platelet-derived growth factor receptor alpha | 16190746 |
| Mast/stem cell growth factor receptor Kit | IC50 | = | 2500.0 | nM | 5.6 | Inhibitory concentration against c-Kit wild type expressed in recombinant baculo... | 16190746 |
| Mast/stem cell growth factor receptor Kit | IC50 | = | 3600.0 | nM | 5.44 | Inhibitory concentration against c-Kit D816V type expressed in recombinant bacul... | 16190746 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6827534 | 10.1021/jm00356a012 | L1210 | 5 |
| 16190746 | 10.1021/jm050231m | Mast/stem cell growth factor receptor Kit | 4 |
| 6827534 | 10.1021/jm00356a012 | Mus musculus | 2 |
| 16190746 | 10.1021/jm050231m | Fibroblast growth factor receptor 3 | 1 |
| 16190746 | 10.1021/jm050231m | Platelet-derived growth factor receptor alpha | 1 |
Data from ChEMBL 36 via Core Engine