Compound Detail
CHEMBL391877
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Basic Information
| ChEMBL ID | CHEMBL391877 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OCUOPGYEWAAIOL-UHFFFAOYSA-N |
3
Targets
4
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
399.4
MW (Da)
3.39
ALogP
8
HBA
1
HBD
92.6
PSA (Ų)
0.66
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 7.0
IC50 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 7.0 | 7.0 | 100.0 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 6.26 | 6.26 | 549.0 | 1 |
| ATP-dependent molecular chaperone HSP82 CHEMBL1293251 | EC50 | 4.82 | 4.82 | 15219.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Zinc finger protein mex-5 | EC50 | = | 100.0 | nM | 7.0 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| RNA-binding protein pos-1 | EC50 | = | 549.0 | nM | 6.26 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| ATP-dependent molecular chaperone HSP82 | EC50 | = | 15219.0 | nM | 4.82 | PUBCHEM_BIOASSAY: Fluorescence Cell-Based Secondary Assay to Identify Inhibitors... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17761421 | 10.1016/j.bmc.2007.07.016 | Ubiquitin carboxyl-terminal hydrolase isozyme L3 | 2 |
Data from ChEMBL 36 via Core Engine