Compound Detail
CHEMBL215966
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 | CHEMBL215966 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GRHJBBHWINXXFX-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
428.3
MW (Da)
6.18
ALogP
2
HBA
1
HBD
42.0
PSA (Ų)
0.51
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.88
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 1 CHEMBL4794 | IC50 | 6.88 | 6.88 | 131.0 | 1 |
| Transient receptor potential cation channel subfamily V member 1 CHEMBL5102 | IC50 | 6.46 | 6.46 | 348.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 1 | IC50 | = | 131.0 | nM | 6.88 | Antagonist activity against capsaicin-activated human VR1 by FLIPR assay | 16870426 |
| Transient receptor potential cation channel subfamily V member 1 | IC50 | = | 348.0 | nM | 6.46 | Antagonist activity against low pH(5.0-5.5)-activated rat VR1 | 16870426 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16870426 | 10.1016/j.bmcl.2006.07.010 | Transient receptor potential cation channel subfamily V member 1 | 2 |
Data from ChEMBL 36 via Core Engine