Compound Detail
CHEMBL1442125
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Basic Information
| ChEMBL ID | CHEMBL1442125 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DWQOTEPNRWVUDA-UHFFFAOYSA-N |
4
Targets
5
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
242.2
MW (Da)
3.51
ALogP
4
HBA
2
HBD
82.2
PSA (Ų)
0.81
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 4.65
IC50 2 meas. best 5.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Female germline-specific tumor suppressor gld-1 CHEMBL1293302 | IC50 | 5.08 | 5.08 | 8401.0 | 1 |
| Protein Rev CHEMBL1293282 | IC50 | 4.66 | 4.66 | 22020.0 | 1 |
| Insulin-degrading enzyme CHEMBL1293287 | EC50 | 4.65 | 4.61 | 22311.0 | 2 |
| HEK293 CHEMBL614818 | EC50 | 4.3 | 4.3 | 50253.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Female germline-specific tumor suppressor gld-1 | IC50 | = | 8401.0 | nM | 5.08 | PUBCHEM_BIOASSAY: Fluorescence polarization-based biochemical high throughput do... | - |
| Protein Rev | IC50 | = | 22020.0 | nM | 4.66 | PUBCHEM_BIOASSAY: Counterscreen for inhibitors of gld-1: Fluorescence polarizati... | - |
| Insulin-degrading enzyme | EC50 | = | 22311.0 | nM | 4.65 | PUBCHEM_BIOASSAY: Fluorescence polarization-based cell-based high throughput dos... | - |
| Insulin-degrading enzyme | EC50 | = | 26856.0 | nM | 4.57 | PUBCHEM_BIOASSAY: Counterscreen for IDE activators: Fluorescence polarization-ba... | - |
| HEK293 | EC50 | = | 50253.0 | nM | 4.3 | PUBCHEM_BIOASSAY: Counterscreen for IDE activators: Fluorescence polarization-ba... | - |
Data from ChEMBL 36 via Core Engine