Compound Detail
CHEMBL1510003
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Basic Information
| ChEMBL ID | CHEMBL1510003 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UQCLCESEXBRIHE-UHFFFAOYSA-N |
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
386.9
MW (Da)
5.18
ALogP
5
HBA
1
HBD
74.0
PSA (Ų)
0.61
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.18
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serine/threonine-protein phosphatase PP1-alpha catalytic subunit CHEMBL2164 | IC50 | 5.18 | 5.18 | 6656.0 | 1 |
| SUMO-activating enzyme CHEMBL2095174 | IC50 | 5.06 | 5.06 | 8730.0 | 1 |
| Eukaryotic translation initiation factor 4H CHEMBL1293274 | IC50 | 4.97 | 4.97 | 10675.0 | 1 |
| Polyadenylate-binding protein 1 CHEMBL1293286 | IC50 | 4.4 | 4.4 | 39680.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serine/threonine-protein phosphatase PP1-alpha catalytic subunit | IC50 | = | 6656.0 | nM | 5.18 | PUBCHEM_BIOASSAY: Fluorescence-based biochemical high throughput dose response a... | - |
| SUMO-activating enzyme | IC50 | = | 8730.0 | nM | 5.06 | PUBCHEM_BIOASSAY: AlphaScreen confirmatory assay for validation of inhibitors of... | - |
| Eukaryotic translation initiation factor 4H | IC50 | = | 10675.0 | nM | 4.97 | PUBCHEM_BIOASSAY: uHTS fluorescence polarization assay for the identification of... | - |
| Polyadenylate-binding protein 1 | IC50 | = | 39680.0 | nM | 4.4 | PUBCHEM_BIOASSAY: uHTS fluorescence polarization assay for the identification of... | - |
Data from ChEMBL 36 via Core Engine