Compound Detail
CHEMBL568964
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Basic Information
| ChEMBL ID | CHEMBL568964 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZNRVIVOOPQPLMS-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
357.5
MW (Da)
2.36
ALogP
7
HBA
1
HBD
62.8
PSA (Ų)
0.88
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone-lysine N-methyltransferase EHMT2 CHEMBL6032 | IC50 | 5.29 | 5.29 | 5100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone-lysine N-methyltransferase EHMT2 | IC50 | = | 5100.0 | nM | 5.29 | Inhibition of G9a by Alpha screen assay | 19891491 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19891491 | 10.1021/jm901543m | Histone-lysine N-methyltransferase EHMT2 | 2 |
| 20614940 | 10.1021/jm100478y | Histone-lysine N-methyltransferase EHMT2 | 2 |
Data from ChEMBL 36 via Core Engine