Compound Detail
CHEMBL6020239
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Cc1cc(C(=O)N2CC=C(c3cnc(NCc4c(F)ccc5c4CCO5)n4cnnc34)CC2)n(C)n1
Basic Information
| ChEMBL ID | CHEMBL6020239 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PMNFISMZZAVMSE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
488.5
MW (Da)
2.78
ALogP
9
HBA
1
HBD
102.5
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.32
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 | 8.32 | 8.32 | 4.8 | 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 | = | 4.8 | nM | 8.32 | TR-FRET Assay: The TR-FRET method was used to measure the PRC2 enzyme activity. ... | - |
Data from ChEMBL 36 via Core Engine