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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50254554   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50254554
PNG
(4-(3-(4-isobutoxy-3-nitrophenyl)-1H-1,2,4-triazol-...)
Show SMILES CC(C)COc1ccc(cc1[N+]([O-])=O)-c1nnc([nH]1)-c1ccnc(C)c1
Show InChI InChI=1S/C18H19N5O3/c1-11(2)10-26-16-5-4-13(9-15(16)23(24)25)17-20-18(22-21-17)14-6-7-19-12(3)8-14/h4-9,11H,10H2,1-3H3,(H,20,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



Fuji Yakuhin Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of bovine milk XOR-mediated uric acid formation after 15 mins by spectrophotometer


Bioorg Med Chem Lett 19: 6225-9 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.091
BindingDB Entry DOI: 10.7270/Q2XS5VHW
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50254554
PNG
(4-(3-(4-isobutoxy-3-nitrophenyl)-1H-1,2,4-triazol-...)
Show SMILES CC(C)COc1ccc(cc1[N+]([O-])=O)-c1nnc([nH]1)-c1ccnc(C)c1
Show InChI InChI=1S/C18H19N5O3/c1-11(2)10-26-16-5-4-13(9-15(16)23(24)25)17-20-18(22-21-17)14-6-7-19-12(3)8-14/h4-9,11H,10H2,1-3H3,(H,20,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Fuji Yakuhin Co, Ltd

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidoreductase


Bioorg Med Chem Lett 19: 184-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH
More data for this
Ligand-Target Pair