Compound Detail
CHEMBL1373811
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Basic Information
| ChEMBL ID | CHEMBL1373811 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZDLLFOWRIGESMT-UHFFFAOYSA-M |
| Parent Compound | CHEMBL1618856 |
| Active Moiety | CHEMBL1618856 |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
329.1
MW (Da)
3.76
ALogP
3
HBA
1
HBD
63.1
PSA (Ų)
0.78
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor gamma/Nuclear receptor corepressor 2 CHEMBL2096976 | IC50 | 5.96 | 5.96 | 1089.0 | 1 |
| Photoreceptor-specific nuclear receptor CHEMBL4374 | IC50 | 5.79 | 5.79 | 1636.0 | 1 |
| Major prion protein CHEMBL4869 | IC50 | 4.86 | 4.86 | 13832.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor gamma/Nuclear receptor corepressor 2 | IC50 | = | 1089.0 | nM | 5.96 | PUBCHEM_BIOASSAY: Counterscreen for agonists of nuclear receptor subfamily 2, gr... | - |
| Photoreceptor-specific nuclear receptor | IC50 | = | 1636.0 | nM | 5.79 | PUBCHEM_BIOASSAY: TR-FRET-based biochemical high throughput dose response assay ... | - |
| Major prion protein | IC50 | = | 13832.0 | nM | 4.86 | PubChem BioAssay. TRFRET-based cell-based high throughput dose response assay to... | - |
Data from ChEMBL 36 via Core Engine