Compound Detail
CHEMBL1550366
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Basic Information
| ChEMBL ID | CHEMBL1550366 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GWTHLYJSIHTVPG-UHFFFAOYSA-N |
4
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
195.2
MW (Da)
2.34
ALogP
2
HBA
1
HBD
43.1
PSA (Ų)
0.70
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.7
IC50 2 meas. best 4.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Zinc finger protein mex-5 CHEMBL1293319 | EC50 | 5.7 | 5.7 | 1976.0 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 5.13 | 5.13 | 7463.0 | 1 |
| Voltage-gated N-type calcium channel alpha-1B subunit/Amyloid beta A4 precursor protein-binding family A member 1 CHEMBL2097170 | IC50 | 4.9 | 4.9 | 12700.0 | 1 |
| Mannose-6-phosphate isomerase CHEMBL2758 | IC50 | 4.78 | 4.78 | 16694.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Zinc finger protein mex-5 | EC50 | = | 1976.0 | nM | 5.7 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| RNA-binding protein pos-1 | EC50 | = | 7463.0 | nM | 5.13 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
| Voltage-gated N-type calcium channel alpha-1B subunit/Amyloid beta A4 precursor protein-binding family A member 1 | IC50 | = | 12700.0 | nM | 4.9 | PUBCHEM_BIOASSAY: Homogeneous Time-Resolved Fluorescence Resonance Energy Transf... | - |
| Mannose-6-phosphate isomerase | IC50 | = | 16694.0 | nM | 4.78 | PUBCHEM_BIOASSAY: HTS identification of compounds inhibiting phosphomannose isom... | - |
Data from ChEMBL 36 via Core Engine