Compound Detail
CHEMBL346631
CEP-7055 Phase I
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
Phase I
CC(C)OCc1ccc2c(c1)c1c3c(c4c(c1n2CCCOC(=O)CN(C)C)Cc1ccccc1-4)C(=O)NC3
Basic Information
| ChEMBL ID | CHEMBL346631 |
| Name | CEP-7055 |
| Phase | Phase I |
| Structure Type | MOL |
| InChI Key | UHEBDUAFKQHUBV-UHFFFAOYSA-N |
| Active Moiety | CHEMBL150894 |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
1
Known Names
1
Mechanisms
Molecular Properties
525.6
MW (Da)
5.03
ALogP
6
HBA
1
HBD
72.8
PSA (Ų)
0.22
QED
2
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Vascular endothelial growth factor receptor inhibitor | INHIBITOR | Vascular endothelial growth factor receptor | ✓ | ✓ |
Activity Summary
IC50 3 meas. best 7.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.8 | 7.775 | 16.0 | 2 |
| Angiopoietin-1 receptor CHEMBL4128 | IC50 | 5.87 | 5.87 | 1357.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 16.0 | nM | 7.8 | Inhibition of VEGFR2 | 18343109 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 18.0 | nM | 7.75 | In vitro inhibitory concentration against human vascular endothelial growth fact... | 14640546 |
| Angiopoietin-1 receptor | IC50 | = | 1357.0 | nM | 5.87 | Inhibition of TIE2 | 18343109 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14640546 | 10.1021/jm0301641 | Vascular endothelial growth factor receptor 2 | 1 |
| 14640546 | 10.1021/jm0301641 | Mus musculus | 1 |
| 18343109 | 10.1016/j.bmcl.2008.02.069 | Angiopoietin-1 receptor | 1 |
| 18343109 | 10.1016/j.bmcl.2008.02.069 | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine