Compound Detail
CHEMBL5761827
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
CCN(c1cc2occc2c(C(=O)NCc2c(OC)cc(C)[nH]c2=O)c1C)C1CCN(S(C)(=O)=O)CC1
Basic Information
| ChEMBL ID | CHEMBL5761827 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SJEZMVZOMDBBNK-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
530.6
MW (Da)
2.93
ALogP
7
HBA
2
HBD
125.0
PSA (Ų)
0.46
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 9.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone-lysine N-methyltransferase EZH2 CHEMBL2189110 | IC50 | 9.05 | 8.77 | 0.9 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone-lysine N-methyltransferase EZH2 | IC50 | = | 0.9 | nM | 9.05 | Biological Assay: The activity of EZH2 enzyme (with A677G mutant or Y641F mutant... | - |
| Histone-lysine N-methyltransferase EZH2 | IC50 | = | 0.9 | nM | 9.05 | Assay for Determining the Activity of the Example Compounds of the Present Inven... | - |
| Histone-lysine N-methyltransferase EZH2 | IC50 | = | 3.2 | nM | 8.49 | Biological Assay: The activity of EZH2 enzyme (with A677G mutant or Y641F mutant... | - |
| Histone-lysine N-methyltransferase EZH2 | IC50 | = | 3.2 | nM | 8.49 | Assay for Determining the Activity of the Example Compounds of the Present Inven... | - |
Data from ChEMBL 36 via Core Engine