Compound Detail
CHEMBL5741178
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Basic Information
| ChEMBL ID | CHEMBL5741178 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IJWYHMIMXOCAJF-AMJWBLJWSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
429.6
MW (Da)
3.45
ALogP
5
HBA
3
HBD
93.5
PSA (Ų)
0.63
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A CHEMBL6136 | IC50 | 7.57 | 7.57 | 27.0 | 1 |
| Amine oxidase [flavin-containing] A CHEMBL1951 | IC50 | 4.76 | 4.76 | 17480.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A | IC50 | = | 27.0 | nM | 7.57 | Biological Assays-Inhibition of LSD1: Briefly, a fixed amount of LSD1 was incuba... | - |
| Amine oxidase [flavin-containing] A | IC50 | = | 17480.0 | nM | 4.76 | Biological Assays-Inhibition of LSD1: Briefly, a fixed amount of LSD1 was incuba... | - |
Data from ChEMBL 36 via Core Engine