Compound Detail
CHEMBL1544403
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Basic Information
| ChEMBL ID | CHEMBL1544403 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MNBGRERVWNCCTM-UHFFFAOYSA-N |
4
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
407.9
MW (Da)
5.25
ALogP
5
HBA
0
HBD
57.0
PSA (Ų)
0.44
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 4.59
IC50 2 meas. best 7.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Peroxisome proliferator-activated receptor gamma/Nuclear receptor corepressor 2 CHEMBL2096976 | IC50 | 7.26 | 7.26 | 55.5 | 1 |
| Photoreceptor-specific nuclear receptor CHEMBL4374 | IC50 | 6.52 | 6.52 | 303.4 | 1 |
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 4.59 | 4.59 | 25756.0 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 4.32 | 4.32 | 47501.0 | 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 | = | 55.52 | nM | 7.26 | PUBCHEM_BIOASSAY: Counterscreen for agonists of nuclear receptor subfamily 2, gr... | - |
| Photoreceptor-specific nuclear receptor | IC50 | = | 303.35 | nM | 6.52 | PUBCHEM_BIOASSAY: TR-FRET-based biochemical high throughput dose response assay ... | - |
| Zinc finger protein mex-5 | EC50 | = | 25756.0 | nM | 4.59 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| RNA-binding protein pos-1 | EC50 | = | 47501.0 | nM | 4.32 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
Data from ChEMBL 36 via Core Engine