Compound Detail
CHEMBL3775110
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Basic Information
| ChEMBL ID | CHEMBL3775110 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DBUOVCYDSFDLKB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
242.3
MW (Da)
2.95
ALogP
3
HBA
2
HBD
62.2
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysine-specific demethylase 4C CHEMBL6175 | IC50 | 6.2 | 5.2 | 631.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysine-specific demethylase 4C | IC50 | = | 630.96 | nM | 6.2 | Inhibition of KDM4C (unknown origin) using H3K9Me3 peptide as substrate assessed... | 26771107 |
| Lysine-specific demethylase 4C | IC50 | = | 63095.73 | nM | 4.2 | Inhibition of full length human HALO-tagged KDM4C expressed in human U2OS cells ... | 26771107 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26771107 | 10.1021/acs.jmedchem.5b01537 | Lysine-specific demethylase 4C | 2 |
Data from ChEMBL 36 via Core Engine