Compound Detail
CHEMBL4063655
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Basic Information
| ChEMBL ID | CHEMBL4063655 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HNQBUBGQBZCBSB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
239.2
MW (Da)
1.81
ALogP
6
HBA
1
HBD
79.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Polycomb protein EED CHEMBL2189117 | IC50 | 6.0 | 6.0 | 1000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Polycomb protein EED | IC50 | = | 1000.0 | nM | 6.0 | Inhibition of recombinant N-terminal GST-tagged EED (76 to 441 residues) (unknow... | 28092155 |
| Polycomb protein EED | IC50 | = | 1000.0 | nM | 6.0 | Inhibition of EED (unknown origin) | 35093670 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28092155 | 10.1021/acs.jmedchem.6b01576 | Polycomb protein EED | 1 |
| 35093670 | 10.1016/j.ejmech.2022.114144 | Polycomb protein EED | 1 |
Data from ChEMBL 36 via Core Engine