Compound Detail
CHEMBL1978925
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Basic Information
| ChEMBL ID | CHEMBL1978925 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DYRFIERMQMNKAB-FSJBWODESA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
410.8
MW (Da)
3.73
ALogP
6
HBA
3
HBD
108.2
PSA (Ų)
0.26
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.86
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 CHEMBL1795098 | IC50 | 5.86 | 5.86 | 1396.0 | 1 |
| DNA (cytosine-5)-methyltransferase 1 CHEMBL1993 | IC50 | 5.27 | 5.27 | 5400.0 | 1 |
| RNA-editing ligase 1, mitochondrial CHEMBL4105928 | IC50 | 4.39 | 4.39 | 41003.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 | IC50 | = | 1396.0 | nM | 5.86 | PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS hits for Scp-1 phosphatase ... | - |
| DNA (cytosine-5)-methyltransferase 1 | IC50 | = | 5400.0 | nM | 5.27 | PUBCHEM_BIOASSAY: Dose response confirmation of DNMT1 inhibitors in a Fluorescen... | - |
| RNA-editing ligase 1, mitochondrial | IC50 | = | 41003.0 | nM | 4.39 | PubChem BioAssay. Fluorescence-based biochemical high throughput dose response a... | - |
Data from ChEMBL 36 via Core Engine