Compound Detail
CHEMBL1370456
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Basic Information
| ChEMBL ID | CHEMBL1370456 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UWHUTZOCTZJUKC-UHFFFAOYSA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
286.3
MW (Da)
1.61
ALogP
5
HBA
4
HBD
90.2
PSA (Ų)
0.55
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.4
IC50 1 meas. best 4.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Endoribonuclease toxin MazF CHEMBL1795096 | EC50 | 5.4 | 5.4 | 3960.0 | 1 |
| HEK293 CHEMBL614818 | EC50 | 4.27 | 4.27 | 53645.0 | 1 |
| HEK293 CHEMBL614818 | IC50 | 4.07 | 4.07 | 85140.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Endoribonuclease toxin MazF | EC50 | = | 3960.0 | nM | 5.4 | PUBCHEM_BIOASSAY: Dose response confirmation uHTS hits for MazEF TA System activ... | - |
| HEK293 | EC50 | = | 53645.0 | nM | 4.27 | PUBCHEM_BIOASSAY: Counterscreen for IDE activators: Fluorescence polarization-ba... | - |
| HEK293 | IC50 | = | 85140.0 | nM | 4.07 | PUBCHEM_BIOASSAY: Counterscreen for activators of insulin-degrading enzyme (IDE)... | - |
Data from ChEMBL 36 via Core Engine