Compound Detail
CHEMBL5207071
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Basic Information
| ChEMBL ID | CHEMBL5207071 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WPXYXULJPWEGDM-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
401.5
MW (Da)
4.49
ALogP
4
HBA
2
HBD
75.6
PSA (Ų)
0.68
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | EC50 | 6.24 | 6.24 | 580.0 | 1 |
| Peroxisome proliferator-activated receptor gamma CHEMBL235 | EC50 | 5.47 | 5.47 | 3400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor alpha | EC50 | = | 580.0 | nM | 6.24 | Agonist activity at yeast Gal4-fused human PPARalpha LBD transfected in human He... | 35325635 |
| Peroxisome proliferator-activated receptor gamma | EC50 | = | 3400.0 | nM | 5.47 | Agonist activity at yeast Gal4-fused human PPARgamma transfected in human HepG2 ... | 35325635 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35325635 | 10.1016/j.ejmech.2022.114240 | Peroxisome proliferator-activated receptor alpha | 2 |
| 35325635 | 10.1016/j.ejmech.2022.114240 | Peroxisome proliferator-activated receptor gamma | 2 |
| 35325635 | 10.1016/j.ejmech.2022.114240 | Peroxisome proliferator-activated receptor delta | 1 |
Data from ChEMBL 36 via Core Engine