Compound Detail
CHEMBL101581
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Basic Information
| ChEMBL ID | CHEMBL101581 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OVJMXMWWASQPSL-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
360.2
MW (Da)
4.81
ALogP
4
HBA
0
HBD
40.6
PSA (Ų)
0.67
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Epidermal growth factor receptor CHEMBL203 | IC50 | 5.6 | 5.6 | 2500.0 | 1 |
| Platelet-derived growth factor receptor beta CHEMBL4125 | IC50 | 5.08 | 5.08 | 8400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Epidermal growth factor receptor | IC50 | = | 2500.0 | nM | 5.6 | Inhibition of epidermal growth factor receptor (EGF-R) autophosphorylation in A4... | - |
| Platelet-derived growth factor receptor beta | IC50 | = | 8400.0 | nM | 5.08 | Inhibition of PDGF-BB induced PDGF-B receptor autophosphorylation in rat mesangi... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(97)10117-2 | Platelet-derived growth factor receptor beta | 1 |
| - | 10.1016/S0960-894X(97)10117-2 | Epidermal growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine