Compound Detail
CHEMBL1587518
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Basic Information
| ChEMBL ID | CHEMBL1587518 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PFCZWSUYQWSCDQ-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
328.4
MW (Da)
5.37
ALogP
3
HBA
0
HBD
25.8
PSA (Ų)
0.50
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.19
EC50 1 meas. best 5.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor gamma/Nuclear receptor coactivator 2 CHEMBL2095163 | EC50 | 5.63 | 5.63 | 2353.0 | 1 |
| Major prion protein CHEMBL4869 | IC50 | 5.19 | 5.19 | 6507.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 4.19 | 4.19 | 63999.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor gamma/Nuclear receptor coactivator 2 | EC50 | = | 2353.0 | nM | 5.63 | PUBCHEM_BIOASSAY: TR-FRET dose response biochemical High Throughput Screening as... | - |
| Major prion protein | IC50 | = | 6507.0 | nM | 5.19 | PubChem BioAssay. TRFRET-based cell-based high throughput dose response assay to... | - |
| NON-PROTEIN TARGET | IC50 | = | 63999.0 | nM | 4.19 | PubChem BioAssay. Counterscreen for inhibitors of cell surface Prion Protein (Pr... | - |
Data from ChEMBL 36 via Core Engine