Compound Detail
CHEMBL4854838
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Basic Information
| ChEMBL ID | CHEMBL4854838 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HPFPDEHXABTLQP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
416.5
MW (Da)
3.84
ALogP
8
HBA
0
HBD
71.9
PSA (Ų)
0.34
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A CHEMBL6136 | IC50 | 4.7 | 4.7 | 20150.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A | IC50 | = | 20150.0 | nM | 4.7 | Inhibition of recombinant full length LSD1 (unknown origin) transfected in Esche... | 34416665 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34416665 | 10.1016/j.ejmech.2021.113778 | Lysine-specific histone demethylase 1A | 1 |
Data from ChEMBL 36 via Core Engine