Compound Detail
CHEMBL5909807
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CC1C=C(c2cnc(NCc3c(F)ccc4c3CCO4)n3cnnc23)CC(C)N1C(=O)OC(C)(C)C
Basic Information
| ChEMBL ID | CHEMBL5909807 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FWIROIUOYQYPCE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
494.6
MW (Da)
4.61
ALogP
8
HBA
1
HBD
93.9
PSA (Ų)
0.57
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone-binding protein RBBP4/Histone-lysine N-methyltransferase EZH2/Polycomb protein EED/Polycomb protein SUZ12 CHEMBL6066587 | IC50 | 7.32 | 7.32 | 47.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone-binding protein RBBP4/Histone-lysine N-methyltransferase EZH2/Polycomb protein EED/Polycomb protein SUZ12 | IC50 | = | 47.6 | nM | 7.32 | TR-FRET Assay: The TR-FRET method was used to measure the PRC2 enzyme activity. ... | - |
Data from ChEMBL 36 via Core Engine