Compound Detail
CHEMBL3769963
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Basic Information
| ChEMBL ID | CHEMBL3769963 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OUFNQFHOEHMLCV-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
355.5
MW (Da)
3.85
ALogP
3
HBA
2
HBD
66.9
PSA (Ų)
0.87
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.47
IC50 1 meas. best 5.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone-lysine N-methyltransferase EZH2 CHEMBL2189110 | EC50 | 5.47 | 5.47 | 3400.0 | 1 |
| Histone-lysine N-methyltransferase EZH2 CHEMBL2189110 | IC50 | 5.47 | 5.47 | 3400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone-lysine N-methyltransferase EZH2 | EC50 | = | 3400.0 | nM | 5.47 | Inhibition of EZH2 (unknown origin) | 34042449 |
| Histone-lysine N-methyltransferase EZH2 | IC50 | = | 3400.0 | nM | 5.47 | Inhibition of methyltransferase activity of human EZH2 using chicken oligonucleo... | 26769278 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26769278 | 10.1021/acs.jmedchem.5b01501 | Histone-lysine N-methyltransferase EZH2 | 1 |
| 26769278 | 10.1021/acs.jmedchem.5b01501 | No relevant target | 1 |
| 34042449 | 10.1021/acs.jmedchem.1c00592 | Histone-lysine N-methyltransferase EZH2 | 1 |
Data from ChEMBL 36 via Core Engine