Compound Detail
CHEMBL3331617
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Basic Information
| ChEMBL ID | CHEMBL3331617 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VJOGHLHRLFZUCO-UHFFFAOYSA-N |
1
Targets
3
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
347.2
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.05
IC50 1 meas. best 8.26
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Xanthine dehydrogenase/oxidase CHEMBL3649 | Ki | 9.05 | 8.845 | 0.9 | 2 |
| Xanthine dehydrogenase/oxidase CHEMBL3649 | IC50 | 8.26 | 8.26 | 5.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Xanthine dehydrogenase/oxidase | Ki | = | 0.9 | nM | 9.05 | Mixed-type inhibition of bovine xanthine oxidase assessed as inhibition of uric ... | 25113879 |
| Xanthine dehydrogenase/oxidase | Ki | = | 2.3 | nM | 8.64 | Mixed-type inhibition of bovine xanthine oxidase assessed as inhibition of uric ... | 25113879 |
| Xanthine dehydrogenase/oxidase | IC50 | = | 5.5 | nM | 8.26 | Inhibition of bovine xanthine oxidase assessed as inhibition of uric acid format... | 25113879 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25113879 | 10.1016/j.ejmech.2014.08.014 | Xanthine dehydrogenase/oxidase | 5 |
Data from ChEMBL 36 via Core Engine