Compound Detail
CHEMBL1328733
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Basic Information
| ChEMBL ID | CHEMBL1328733 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FRHKAWLBQUZJAR-FMIVXFBMSA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
298.3
MW (Da)
2.11
ALogP
4
HBA
1
HBD
62.5
PSA (Ų)
0.52
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 4.49
IC50 1 meas. best 6.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| DNA (cytosine-5)-methyltransferase 1 CHEMBL1993 | IC50 | 6.09 | 6.09 | 811.0 | 1 |
| RNA-binding protein pos-1 CHEMBL1293304 | EC50 | 4.49 | 4.49 | 32699.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| DNA (cytosine-5)-methyltransferase 1 | IC50 | = | 811.0 | nM | 6.09 | PUBCHEM_BIOASSAY: Dose response confirmation of DNMT1 inhibitors in a Fluorescen... | - |
| RNA-binding protein pos-1 | EC50 | = | 32699.0 | nM | 4.49 | PUBCHEM_BIOASSAY: Fluorescent Polarization Homogeneous Dose Response HTS to Iden... | - |
Data from ChEMBL 36 via Core Engine