Compound Detail
CHEMBL3109638
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Basic Information
| ChEMBL ID | CHEMBL3109638 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BDKDIFMYLGMBDI-ZDUSSCGKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
347.4
MW (Da)
2.93
ALogP
5
HBA
1
HBD
60.1
PSA (Ų)
0.80
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone-lysine N-methyltransferase EHMT2 CHEMBL6032 | IC50 | 7.75 | 7.75 | 18.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone-lysine N-methyltransferase EHMT2 | IC50 | = | 18.0 | nM | 7.75 | Inhibition of G9a (unknown origin) using biotinylated-histone H3(1-21) peptide a... | 24900801 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24900801 | 10.1021/ml400496h | Histone-lysine N-methyltransferase EHMT2 | 1 |
Data from ChEMBL 36 via Core Engine