Compound Detail
CHEMBL1312519
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Basic Information
| ChEMBL ID | CHEMBL1312519 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IZQAMGLIUKULPK-UHFFFAOYSA-N |
4
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
389.5
MW (Da)
2.06
ALogP
4
HBA
1
HBD
69.7
PSA (Ų)
0.85
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 5.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| DNA dC->dU-editing enzyme APOBEC-3A CHEMBL1741179 | IC50 | 5.47 | 5.47 | 3380.0 | 1 |
| DNA dC->dU-editing enzyme APOBEC-3G CHEMBL1741217 | IC50 | 5.43 | 5.43 | 3720.0 | 1 |
| Polyadenylate-binding protein 1 CHEMBL1293286 | IC50 | 5.23 | 4.96 | 5920.0 | 2 |
| Eukaryotic translation initiation factor 4H CHEMBL1293274 | IC50 | 4.56 | 4.305 | 27550.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| DNA dC->dU-editing enzyme APOBEC-3A | IC50 | = | 3380.0 | nM | 5.47 | PUBCHEM_BIOASSAY: Dose Response confirmation of small molecule APOBEC3A DNA Deam... | - |
| DNA dC->dU-editing enzyme APOBEC-3G | IC50 | = | 3720.0 | nM | 5.43 | PUBCHEM_BIOASSAY: Dose Response confirmation of APOBEC3A DNA Deaminase Inhibitor... | - |
| Polyadenylate-binding protein 1 | IC50 | = | 5920.0 | nM | 5.23 | PUBCHEM_BIOASSAY: uHTS fluorescence polarization assay for the identification of... | - |
| Polyadenylate-binding protein 1 | IC50 | = | 20500.0 | nM | 4.69 | PUBCHEM_BIOASSAY: SAR analysis for the identification of translation initiation ... | - |
| Eukaryotic translation initiation factor 4H | IC50 | = | 27550.0 | nM | 4.56 | PUBCHEM_BIOASSAY: SAR analysis for the identification of translation initiation ... | - |
| Eukaryotic translation initiation factor 4H | IC50 | = | 88900.0 | nM | 4.05 | PUBCHEM_BIOASSAY: uHTS fluorescence polarization assay for the identification of... | - |
Data from ChEMBL 36 via Core Engine