BDBM50098072 1-(3-Cyano-4-octyloxy-phenyl)-1H-pyrazole-4-carboxylic acid::CHEMBL171584
SMILES: CCCCCCCCOc1ccc(cc1C#N)-n1cc(cn1)C(O)=O
InChI Key: InChIKey=QXVJNIIXJZUFFM-UHFFFAOYSA-N
Data: 2 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Xanthine dehydrogenase (Bos taurus (Bovine)) | BDBM50098072 (1-(3-Cyano-4-octyloxy-phenyl)-1H-pyrazole-4-carbox...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Department of Chemistry, Faculty of Medicine, University of Ni?, Bulevar Dr Zorana?in?i?a 81, 18000 Ni?, Serbia. Curated by ChEMBL | Assay Description Inhibition of bovine milk xanthine-oxygen reductase using xanthine as substrate by spectrophotometric assay | Eur J Med Chem 135: 491-516 (2017) Article DOI: 10.1016/j.ejmech.2017.04.031 BindingDB Entry DOI: 10.7270/Q2VD71XP | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Xanthine dehydrogenase (Bos taurus (Bovine)) | BDBM50098072 (1-(3-Cyano-4-octyloxy-phenyl)-1H-pyrazole-4-carbox...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Welfide Corporation Curated by ChEMBL | Assay Description In vitro inhibitory concentration against Xanthine oxidase | Bioorg Med Chem Lett 11: 879-82 (2001) BindingDB Entry DOI: 10.7270/Q2251HFC | |||||||||||
More data for this Ligand-Target Pair |