Compound Detail
CHEMBL229573
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Basic Information
| ChEMBL ID | CHEMBL229573 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YFOSSOSPJLEQRP-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
483.5
MW (Da)
6.00
ALogP
3
HBA
2
HBD
75.6
PSA (Ų)
0.29
QED
1
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 8.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor delta CHEMBL3979 | EC50 | 8.29 | 8.29 | 5.1 | 1 |
| Peroxisome proliferator-activated receptor alpha CHEMBL239 | EC50 | 6.09 | 6.09 | 820.0 | 1 |
| Peroxisome proliferator-activated receptor gamma CHEMBL235 | EC50 | 6.0 | 6.0 | 1000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor delta | EC50 | = | 5.1 | nM | 8.29 | Effect on PPARdelta transactivation activity in HEK293 cells | 17532641 |
| Peroxisome proliferator-activated receptor alpha | EC50 | = | 820.0 | nM | 6.09 | Effect on PPARalpha transactivation activity in HEK293 cells | 17532641 |
| Peroxisome proliferator-activated receptor gamma | EC50 | = | 1000.0 | nM | 6.0 | Effect on PPARgamma transactivation activity in HEK293 cells | 17532641 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17532641 | 10.1016/j.bmc.2007.05.023 | Peroxisome proliferator-activated receptor alpha | 1 |
| 17532641 | 10.1016/j.bmc.2007.05.023 | Peroxisome proliferator-activated receptor delta | 1 |
| 17532641 | 10.1016/j.bmc.2007.05.023 | Peroxisome proliferator-activated receptor gamma | 1 |
Data from ChEMBL 36 via Core Engine