Compound Detail
CHEMBL66643
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL66643 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KGGRQYJJHXVWSI-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
2
PK Parameters
6
Publications
0
Known Names
Molecular Properties
271.3
MW (Da)
3.98
ALogP
4
HBA
0
HBD
31.4
PSA (Ų)
0.72
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Platelet-derived growth factor receptor CHEMBL2095189 | IC50 | 7.7 | 6.7933 | 20.0 | 3 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| F | 49.0 | % | Rattus norvegicus |
| F | 21.0 | % | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Platelet-derived growth factor receptor | IC50 | = | 20.0 | nM | 7.7 | Inhibition of human PDGF receptor phosphorylation; 0.01-0.02 | 8035419 |
| Platelet-derived growth factor receptor | IC50 | = | 461.0 | nM | 6.34 | Inhibition of Platelet-derived growth factor receptor | 12941342 |
| Platelet-derived growth factor receptor | IC50 | = | 461.0 | nM | 6.34 | Inhibition of Platelet-derived growth factor receptor | 12941341 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12941342 | 10.1016/s0960-894x(03)00655-3 | Rattus norvegicus | 2 |
| 8035419 | 10.1021/jm00040a003 | Platelet-derived growth factor receptor | 1 |
| 8035419 | 10.1021/jm00040a003 | Epidermal growth factor receptor | 1 |
| 8035419 | 10.1021/jm00040a003 | cAMP-dependent protein kinase (PKA) | 1 |
| 12941342 | 10.1016/s0960-894x(03)00655-3 | Platelet-derived growth factor receptor | 1 |
| 12941341 | 10.1016/s0960-894x(03)00654-1 | Platelet-derived growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine