Compound Detail
CHEMBL3729892
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 | CHEMBL3729892 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VBVNGQQCFQVGHE-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
301.4
MW (Da)
4.23
ALogP
6
HBA
0
HBD
43.3
PSA (Ų)
0.52
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proteinase-activated receptor 4 CHEMBL4691 | IC50 | 6.66 | 6.1267 | 216.7 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proteinase-activated receptor 4 | IC50 | = | 216.7 | nM | 6.66 | Antagonist activity against human PAR4 expressed in HEK293 cells assessed as red... | - |
| Proteinase-activated receptor 4 | IC50 | = | 217.0 | nM | 6.66 | FLIPR Assay: The FLIPR assay is an exemplary in vitro assay for measuring the ac... | - |
| Proteinase-activated receptor 4 | IC50 | = | 8756.0 | nM | 5.06 | Antagonist activity against PAR4 in human platelet rich plasma assessed as inhib... | - |
Data from ChEMBL 36 via Core Engine