Compound Detail
CHEMBL5193666
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 | CHEMBL5193666 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZPVDMEPVFBETQM-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
445.0
MW (Da)
5.57
ALogP
5
HBA
1
HBD
62.7
PSA (Ų)
0.52
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 7.03
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor delta CHEMBL3979 | EC50 | 7.03 | 7.03 | 92.9 | 1 |
| Peroxisome proliferator-activated receptor delta CHEMBL2458 | EC50 | 6.82 | 6.82 | 151.0 | 1 |
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | EC50 | 6.02 | 6.02 | 955.0 | 1 |
| Peroxisome proliferator-activated receptor gamma CHEMBL235 | EC50 | 5.97 | 5.97 | 1070.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor delta | EC50 | = | 92.9 | nM | 7.03 | Transactivation of Gal4-fused human PPARdelta expressed in CHO cells co expressi... | 35063634 |
| Peroxisome proliferator-activated receptor delta | EC50 | = | 151.0 | nM | 6.82 | Transactivation of Gal4-fused mouse PPARdelta expressed in CHO cells co expressi... | 35063634 |
| Peroxisome proliferator-activated receptor alpha | EC50 | = | 955.0 | nM | 6.02 | Transactivation of Gal4-fused human PPARalpha expressed in CHO cells co expressi... | 35063634 |
| Peroxisome proliferator-activated receptor gamma | EC50 | = | 1070.0 | nM | 5.97 | Transactivation of Gal4-fused human PPARgamma expressed in CHO cells co expressi... | 35063634 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35063634 | 10.1016/j.bmcl.2022.128567 | Peroxisome proliferator-activated receptor delta | 2 |
| 35063634 | 10.1016/j.bmcl.2022.128567 | Peroxisome proliferator-activated receptor alpha | 1 |
| 35063634 | 10.1016/j.bmcl.2022.128567 | Peroxisome proliferator-activated receptor gamma | 1 |
Data from ChEMBL 36 via Core Engine