Compound Detail
CHEMBL4237334
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL4237334 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UUYOCHUHVNWETF-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
293.4
MW (Da)
3.44
ALogP
4
HBA
1
HBD
50.7
PSA (Ų)
0.62
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysyl oxidase homolog 3 CHEMBL4105989 | IC50 | 5.3 | 5.3 | 5000.0 | 1 |
| Lysyl oxidase homolog 2 CHEMBL3714029 | IC50 | 5.11 | 5.11 | 7800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysyl oxidase homolog 3 | IC50 | = | 5000.0 | nM | 5.3 | Inhibition of recombinant human LOXL3 expressed in CHO cells using diaminopentan... | 30098867 |
| Lysyl oxidase homolog 2 | IC50 | = | 7800.0 | nM | 5.11 | Inhibition of recombinant LOXL2 (unknown origin) expressed in NS0 cells using di... | 30098867 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30098867 | 10.1016/j.bmcl.2018.07.001 | Protein-lysine 6-oxidase | 2 |
| 30098867 | 10.1016/j.bmcl.2018.07.001 | Lysyl oxidase homolog 2 | 2 |
| 30098867 | 10.1016/j.bmcl.2018.07.001 | Lysyl oxidase homolog 3 | 2 |
| 30098867 | 10.1016/j.bmcl.2018.07.001 | Lysyl oxidase homolog 4 | 2 |
Data from ChEMBL 36 via Core Engine