Compound Detail
CHEMBL5281818
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Basic Information
| ChEMBL ID | CHEMBL5281818 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ULWYKBXMZDRYQX-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
276.3
MW (Da)
1.30
ALogP
7
HBA
2
HBD
81.4
PSA (Ų)
0.74
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysine-specific demethylase 5A CHEMBL2424504 | IC50 | 5.58 | 5.58 | 2660.0 | 1 |
| Lysine-specific demethylase 5C CHEMBL2163176 | IC50 | 5.15 | 5.15 | 7120.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysine-specific demethylase 5A | IC50 | = | 2660.0 | nM | 5.58 | Inhibition of KDM5A (unknown origin ) by Alphascreen assay | 34555614 |
| Lysine-specific demethylase 5C | IC50 | = | 7120.0 | nM | 5.15 | Inhibition of KDM5C (unknown origin ) by Alphascreen assay | 34555614 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34555614 | 10.1016/j.ejmech.2021.113855 | Lysine-specific demethylase 5A | 1 |
| 34555614 | 10.1016/j.ejmech.2021.113855 | Lysine-specific demethylase 5C | 1 |
| 34555614 | 10.1016/j.ejmech.2021.113855 | HeLa | 1 |
Data from ChEMBL 36 via Core Engine