Compound Detail
CHEMBL1460750
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Basic Information
| ChEMBL ID | CHEMBL1460750 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | POPMMLJGRKTSRD-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
386.3
MW (Da)
5.85
ALogP
2
HBA
0
HBD
29.5
PSA (Ų)
0.55
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.8
IC50 1 meas. best 5.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| E3 ubiquitin-protein ligase Mdm2 CHEMBL5023 | EC50 | 6.8 | 6.8 | 160.0 | 1 |
| G-protein coupled receptor 55 CHEMBL1075322 | IC50 | 5.66 | 5.66 | 2201.8 | 1 |
| Protein RecA CHEMBL1741171 | EC50 | 5.12 | 5.12 | 7590.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| E3 ubiquitin-protein ligase Mdm2 | EC50 | = | 160.0 | nM | 6.8 | PUBCHEM_BIOASSAY: E3 Ligase dose-response_384. (Class of assay: confirmatory) [R... | - |
| G-protein coupled receptor 55 | IC50 | = | 2201.83 | nM | 5.66 | PUBCHEM_BIOASSAY: Image-Based HTS for Selective Antagonists for GPR55. (Class of... | - |
| Protein RecA | EC50 | = | 7590.0 | nM | 5.12 | PUBCHEM_BIOASSAY: Fluorescence Cell-Free Homogeneous Dose Retest to Identify Inh... | - |
Data from ChEMBL 36 via Core Engine