Compound Detail
CHEMBL1457774
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Basic Information
| ChEMBL ID | CHEMBL1457774 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AGHAXTODSIUYPP-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
288.4
MW (Da)
4.06
ALogP
4
HBA
0
HBD
43.6
PSA (Ų)
0.57
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.28
IC50 1 meas. best 4.99
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 2/Corticotropin-releasing factor-binding protein CHEMBL3885546 | EC50 | 5.28 | 5.28 | 5230.0 | 1 |
| Ephrin type-A receptor 4 CHEMBL1293259 | IC50 | 4.99 | 4.99 | 10300.0 | 1 |
| Endoribonuclease toxin MazF CHEMBL1795096 | EC50 | 4.21 | 4.21 | 61700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Corticotropin-releasing factor receptor 2/Corticotropin-releasing factor-binding protein | EC50 | = | 5230.0 | nM | 5.28 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS hits for small molecule ago... | - |
| Ephrin type-A receptor 4 | IC50 | = | 10300.0 | nM | 4.99 | PUBCHEM_BIOASSAY: Colorimetric assay for HTS discovery of chemical inhibitors of... | - |
| Endoribonuclease toxin MazF | EC50 | = | 61700.0 | nM | 4.21 | PUBCHEM_BIOASSAY: Dose response confirmation uHTS hits for MazEF TA System activ... | - |
Data from ChEMBL 36 via Core Engine