Compound Detail
CHEMBL2414497
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Basic Information
| ChEMBL ID | CHEMBL2414497 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VMUGFJHHAQTKCY-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
363.5
MW (Da)
4.61
ALogP
6
HBA
2
HBD
84.3
PSA (Ų)
0.60
QED
0
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 10.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 1 CHEMBL5102 | IC50 | 10.3 | 10.02 | 0.1 | 2 |
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 | = | 0.05 | nM | 10.3 | Antagonist activity at rat TRPV1 receptor expressed in HEK293T cells assessed as... | 23796768 |
| Transient receptor potential cation channel subfamily V member 1 | IC50 | = | 0.18 | nM | 9.74 | Antagonist activity at rat TRPV1 receptor expressed in HEK293T cells assessed as... | 23796768 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23796768 | 10.1016/j.ejmech.2013.05.001 | Transient receptor potential cation channel subfamily V member 1 | 4 |
| 23796768 | 10.1016/j.ejmech.2013.05.001 | Uncharacterized protein | 1 |
Data from ChEMBL 36 via Core Engine