Compound Detail
CHEMBL1598223
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Basic Information
| ChEMBL ID | CHEMBL1598223 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FEGNGDZLEHJWID-UHFFFAOYSA-N |
4
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
273.3
MW (Da)
2.30
ALogP
5
HBA
1
HBD
107.2
PSA (Ų)
0.84
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.61
IC50 2 meas. best 5.5
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 5.61 | 5.61 | 2456.0 | 1 |
| 14-3-3 protein gamma CHEMBL1293296 | IC50 | 5.5 | 5.5 | 3147.3 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 5.5 | 5.5 | 3144.0 | 1 |
| Heat shock protein HSP90 CHEMBL2095165 | IC50 | 5.13 | 5.13 | 7382.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Zinc finger protein mex-5 | EC50 | = | 2456.0 | nM | 5.61 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| RNA-binding protein pos-1 | EC50 | = | 3144.0 | nM | 5.5 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| 14-3-3 protein gamma | IC50 | = | 3147.3 | nM | 5.5 | PUBCHEM_BIOASSAY: 14-3-3 protein interaction modulators Dose Response Confirmati... | - |
| Heat shock protein HSP90 | IC50 | = | 7382.3 | nM | 5.13 | PUBCHEM_BIOASSAY: Tumor Hsp90 Inhibitors Dose Response Confirmation. (Class of a... | - |
Data from ChEMBL 36 via Core Engine