Compound Detail
CHEMBL4097339
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Basic Information
| ChEMBL ID | CHEMBL4097339 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QXGRUIJGDRIRCR-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
289.3
MW (Da)
4.21
ALogP
4
HBA
1
HBD
42.5
PSA (Ų)
0.61
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Polycomb protein EED CHEMBL2189117 | IC50 | 4.85 | 4.85 | 14080.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Polycomb protein EED | IC50 | = | 14080.0 | nM | 4.85 | Inhibition of recombinant N-terminal GST-tagged EED (76 to 441 residues) (unknow... | 28092155 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28092155 | 10.1021/acs.jmedchem.6b01576 | Polycomb protein EED | 1 |
Data from ChEMBL 36 via Core Engine