Compound Detail
CHEMBL5208465
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Basic Information
| ChEMBL ID | CHEMBL5208465 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IWVKHQXTSJJJBY-SCRDCRAPSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
454.7
MW (Da)
1.97
ALogP
8
HBA
3
HBD
105.3
PSA (Ų)
0.51
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor delta CHEMBL3979 | Ki | 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 delta | Ki | = | 3400.0 | nM | 5.47 | Binding affinity to PPARdelta (unknown origin) by TR-FRET based LanthaScreen com... | 35859875 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35859875 | 10.1021/acsmedchemlett.2c00159 | Peroxisome proliferator-activated receptor delta | 1 |
| 35859875 | 10.1021/acsmedchemlett.2c00159 | Peroxisome proliferator-activated receptor alpha | 1 |
| 35859875 | 10.1021/acsmedchemlett.2c00159 | Peroxisome proliferator-activated receptor gamma | 1 |
| 35859875 | 10.1021/acsmedchemlett.2c00159 | Mesenchymal stem cells | 1 |
Data from ChEMBL 36 via Core Engine