Compound Detail
CHEMBL1412067
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Basic Information
| ChEMBL ID | CHEMBL1412067 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HDGAYMVNWSXKLI-UHFFFAOYSA-N |
5
Targets
5
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
226.2
MW (Da)
1.65
ALogP
3
HBA
1
HBD
63.4
PSA (Ų)
0.55
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.25
EC50 2 meas. best 6.94
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 6.94 | 6.94 | 116.0 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 6.44 | 6.44 | 363.0 | 1 |
| Beta-lactamase CHEMBL1293260 | IC50 | 5.25 | 5.25 | 5561.0 | 1 |
| Beta Lactamase CHEMBL1293246 | IC50 | 5.14 | 5.14 | 7167.0 | 1 |
| Beta-lactamase CHEMBL1293244 | IC50 | 4.98 | 4.98 | 10454.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Zinc finger protein mex-5 | EC50 | = | 116.0 | nM | 6.94 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| RNA-binding protein pos-1 | EC50 | = | 363.0 | nM | 6.44 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| Beta-lactamase | IC50 | = | 5561.0 | nM | 5.25 | PubChem BioAssay. Epi-absorbance-based dose response assay for common IMP-1 and ... | - |
| Beta Lactamase | IC50 | = | 7167.0 | nM | 5.14 | PubChem BioAssay. Epi-absorbance-based dose response assay for common IMP-1 and ... | - |
| Beta-lactamase | IC50 | = | 10454.0 | nM | 4.98 | PubChem BioAssay. Epi-absorbance-based dose response assay for common IMP-1 and ... | - |
Data from ChEMBL 36 via Core Engine