Compound Detail
CHEMBL1521361
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Basic Information
| ChEMBL ID | CHEMBL1521361 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AYQCZQKMGKDZPS-UHFFFAOYSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
358.9
MW (Da)
2.26
ALogP
4
HBA
1
HBD
58.6
PSA (Ų)
0.90
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 6.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mucolipin-3 CHEMBL1293243 | EC50 | 6.35 | 6.215 | 450.0 | 2 |
| Corticotropin-releasing factor receptor 2/Corticotropin-releasing factor-binding protein CHEMBL3885546 | EC50 | 4.86 | 4.86 | 13700.0 | 1 |
| Ion channel NompC CHEMBL1293245 | EC50 | 4.85 | 4.85 | 14000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mucolipin-3 | EC50 | = | 450.0 | nM | 6.35 | PUBCHEM_BIOASSAY: Late stage results from the probe development efforts to ident... | - |
| Mucolipin-3 | EC50 | = | 823.0 | nM | 6.08 | PUBCHEM_BIOASSAY: Dose response cell-based high-throughput screening assay for a... | - |
| Corticotropin-releasing factor receptor 2/Corticotropin-releasing factor-binding protein | EC50 | = | 13700.0 | nM | 4.86 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS hits for small molecule ago... | - |
| Ion channel NompC | EC50 | = | 14000.0 | nM | 4.85 | PUBCHEM_BIOASSAY: Late stage results from the probe development efforts to ident... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine