Compound Detail
CHEMBL3735310
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Basic Information
| ChEMBL ID | CHEMBL3735310 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IWGQQHBQVFOXBP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
289.4
MW (Da)
0.61
ALogP
4
HBA
2
HBD
55.8
PSA (Ų)
0.85
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A CHEMBL6136 | IC50 | 5.62 | 5.62 | 2400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysine-specific histone demethylase 1A | IC50 | = | 2400.0 | nM | 5.62 | Inhibition of full length human fusion His6 tagged LSD1 expressed in Escherichia... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C4MD00330F | Lysine-specific histone demethylase 1A | 1 |
| - | 10.1039/C4MD00330F | HeLa | 1 |
| - | 10.1039/C4MD00330F | SH-SY5Y | 1 |
Data from ChEMBL 36 via Core Engine