Compile Data Set for Download or QSAR

Found 30 hits of ec50 for UniProtKB: P80457   

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/oxidase (Bos taurus (Bovine))	BDBM50254555 (2-chloro-4-(5-(4-isobutoxy-3-nitrophenyl)-1H-1,2,4...) Show SMILES CC(C)COc1ccc(cc1[N+]([O-])=O)-c1nnc([nH]1)-c1ccnc(Cl)c1 Show InChI InChI=1S/C17H16ClN5O3/c1-10(2)9-26-14-4-3-11(7-13(14)23(24)25)16-20-17(22-21-16)12-5-6-19-15(18)8-12/h3-8,10H,9H2,1-2H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254554 (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/a	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254499 (2-isobutoxy-5-(5-(2-methylpyridin-4-yl)-1H-1,2,4-t...) Show SMILES CC(C)COc1ccc(cc1C#N)-c1nnc([nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C19H19N5O/c1-12(2)11-25-17-5-4-14(9-16(17)10-20)18-22-19(24-23-18)15-6-7-21-13(3)8-15/h4-9,12H,11H2,1-3H3,(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	17	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254500 (CHEMBL459952 | ethyl 2-isobutoxy-5-(5-(2-methylpyr...) Show SMILES CCOC(=O)c1cc(ccc1OCC(C)C)-c1nnc([nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C21H24N4O3/c1-5-27-21(26)17-11-15(6-7-18(17)28-12-13(2)3)19-23-20(25-24-19)16-8-9-22-14(4)10-16/h6-11,13H,5,12H2,1-4H3,(H,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254505 (2-(2-(2-(2-chloroethoxy)ethoxy)ethoxy)-5-(5-(2-met...) Show SMILES Cc1cc(ccn1)-c1nnc([nH]1)-c1ccc(OCCOCCOCCCl)c(c1)C#N Show InChI InChI=1S/C21H22ClN5O3/c1-15-12-17(4-6-24-15)21-25-20(26-27-21)16-2-3-19(18(13-16)14-23)30-11-10-29-9-8-28-7-5-22/h2-4,6,12-13H,5,7-11H2,1H3,(H,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	21	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254562 (2-((2-methoxyethoxy)methoxy)-5-(5-(2-methylpyridin...) Show SMILES COCCOCOc1ccc(cc1C#N)-c1nnc([nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C19H19N5O3/c1-13-9-15(5-6-21-13)19-22-18(23-24-19)14-3-4-17(16(10-14)11-20)27-12-26-8-7-25-2/h3-6,9-10H,7-8,12H2,1-2H3,(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	24	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254561 (2-(methoxymethoxy)-5-(5-(2-methylpyridin-4-yl)-2H-...) Show SMILES COCOc1ccc(cc1C#N)-c1nnc([nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C17H15N5O2/c1-11-7-13(5-6-19-11)17-20-16(21-22-17)12-3-4-15(24-10-23-2)14(8-12)9-18/h3-8H,10H2,1-2H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	24	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254504 (2-(2-(2-butoxyethoxy)ethoxy)-5-(5-(2-methylpyridin...) Show SMILES CCCCOCCOCCOc1ccc(cc1C#N)-c1nnc([nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C23H27N5O3/c1-3-4-9-29-10-11-30-12-13-31-21-6-5-18(15-20(21)16-24)22-26-23(28-27-22)19-7-8-25-17(2)14-19/h5-8,14-15H,3-4,9-13H2,1-2H3,(H,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	26	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254503 (2-(2-(2-methoxyethoxy)ethoxy)-5-(3-(2-methylpyridi...) Show SMILES COCCOCCOc1ccc(cc1C#N)-c1nnc([nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C20H21N5O3/c1-14-11-16(5-6-22-14)20-23-19(24-25-20)15-3-4-18(17(12-15)13-21)28-10-9-27-8-7-26-2/h3-6,11-12H,7-10H2,1-2H3,(H,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	31	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254559 (2-(2-hydroxyethoxy)-5-(5-(2-methylpyridin-4-yl)-2H...) Show SMILES Cc1cc(ccn1)-c1nnc([nH]1)-c1ccc(OCCO)c(c1)C#N Show InChI InChI=1S/C17H15N5O2/c1-11-8-13(4-5-19-11)17-20-16(21-22-17)12-2-3-15(24-7-6-23)14(9-12)10-18/h2-5,8-9,23H,6-7H2,1H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254502 (2-hydroxy-5-(5-(2-methylpyridin-4-yl)-2H-1,2,4-tri...) Show SMILES Cc1cc(ccn1)-c1nnc([nH]1)-c1ccc(O)c(c1)C#N Show InChI InChI=1S/C15H11N5O/c1-9-6-11(4-5-17-9)15-18-14(19-20-15)10-2-3-13(21)12(7-10)8-16/h2-7,21H,1H3,(H,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	43	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254506 (2-((2,2-dimethyl-1,3-dioxolan-4-yl)methoxy)-5-(5-(...) Show SMILES Cc1cc(ccn1)-c1nnc([nH]1)-c1ccc(OCC2COC(C)(C)O2)c(c1)C#N Show InChI InChI=1S/C21H21N5O3/c1-13-8-15(6-7-23-13)20-24-19(25-26-20)14-4-5-18(16(9-14)10-22)27-11-17-12-28-21(2,3)29-17/h4-9,17H,11-12H2,1-3H3,(H,24,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	60	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254560 (2-(2-methoxyethoxy)-5-(5-(2-methylpyridin-4-yl)-2H...) Show SMILES COCCOc1ccc(cc1C#N)-c1nnc([nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C18H17N5O2/c1-12-9-14(5-6-20-12)18-21-17(22-23-18)13-3-4-16(15(10-13)11-19)25-8-7-24-2/h3-6,9-10H,7-8H2,1-2H3,(H,21,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	65	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254558 (2-(2-cyano-4-(5-(2-methylpyridin-4-yl)-2H-1,2,4-tr...) Show SMILES Cc1cc(ccn1)-c1nnc([nH]1)-c1ccc(OCC(O)=O)c(c1)C#N Show InChI InChI=1S/C17H13N5O3/c1-10-6-12(4-5-19-10)17-20-16(21-22-17)11-2-3-14(13(7-11)8-18)25-9-15(23)24/h2-7H,9H2,1H3,(H,23,24)(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	110	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462195 (CHEMBL4240082) Show SMILES CC(C)CCOc1ccc(cc1C#N)-c1nc(cn1O)-c1ccncc1 Show InChI InChI=1S/C20H20N4O2/c1-14(2)7-10-26-19-4-3-16(11-17(19)12-21)20-23-18(13-24(20)25)15-5-8-22-9-6-15/h3-6,8-9,11,13-14,25H,7,10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	646	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462200 (CHEMBL4248090) Show SMILES CCC(C)Oc1ccc(cc1C#N)-c1nc(cn1O)-c1ccncc1 Show InChI InChI=1S/C19H18N4O2/c1-3-13(2)25-18-5-4-15(10-16(18)11-20)19-22-17(12-23(19)24)14-6-8-21-9-7-14/h4-10,12-13,24H,3H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.37E+3	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462201 (CHEMBL4251121) Show SMILES CC(C)Oc1ccc(cc1C#N)-c1nc(cn1O)-c1ccncc1 Show InChI InChI=1S/C18H16N4O2/c1-12(2)24-17-4-3-14(9-15(17)10-19)18-21-16(11-22(18)23)13-5-7-20-8-6-13/h3-9,11-12,23H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.79E+3	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50254497 (3-(5-(4-isobutoxy-3-nitrophenyl)-1H-1,2,4-triazol-...) Show SMILES CC(C)COc1ccc(cc1[N+]([O-])=O)-c1nnc([nH]1)-c1cccnc1 Show InChI InChI=1S/C17H17N5O3/c1-11(2)10-25-15-6-5-12(8-14(15)22(23)24)16-19-17(21-20-16)13-4-3-7-18-9-13/h3-9,11H,10H2,1-2H3,(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.89E+3	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462197 (CHEMBL4237723) Show SMILES N#Cc1cc(ccc1OC1CCCC1)-n1cc(nn1)-c1ccncc1 Show InChI InChI=1S/C19H17N5O/c20-12-15-11-16(5-6-19(15)25-17-3-1-2-4-17)24-13-18(22-23-24)14-7-9-21-10-8-14/h5-11,13,17H,1-4H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	6.76E+3	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462194 (CHEMBL4243871) Show SMILES CC(C)CCOc1ccc(cc1C#N)-c1nc(cn1O)-c1cccnc1 Show InChI InChI=1S/C20H20N4O2/c1-14(2)7-9-26-19-6-5-15(10-17(19)11-21)20-23-18(13-24(20)25)16-4-3-8-22-12-16/h3-6,8,10,12-14,25H,7,9H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	6.76E+3	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462191 (CHEMBL4249720) Show SMILES CC(C)CCOc1ccc(cc1C#N)-n1cc(nn1)-c1ccncc1 Show InChI InChI=1S/C19H19N5O/c1-14(2)7-10-25-19-4-3-17(11-16(19)12-20)24-13-18(22-23-24)15-5-8-21-9-6-15/h3-6,8-9,11,13-14H,7,10H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	8.13E+3	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462196 (CHEMBL4238313) Show SMILES On1cc(nc1-c1ccc(OCC=C)c(c1)C#N)-c1cccnc1 Show InChI InChI=1S/C18H14N4O2/c1-2-8-24-17-6-5-13(9-15(17)10-19)18-21-16(12-22(18)23)14-4-3-7-20-11-14/h2-7,9,11-12,23H,1,8H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	9.55E+3	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462190 (CHEMBL4240097) Show SMILES CC(C)COc1ccc(cc1C#N)-c1nc(cn1O)-c1cccnc1 Show InChI InChI=1S/C19H18N4O2/c1-13(2)12-25-18-6-5-14(8-16(18)9-20)19-22-17(11-23(19)24)15-4-3-7-21-10-15/h3-8,10-11,13,24H,12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.02E+4	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462193 (CHEMBL4240552) Show SMILES COc1ccc(cc1C#N)-c1nc(cn1O)-c1ccncc1 Show InChI InChI=1S/C16H12N4O2/c1-22-15-3-2-12(8-13(15)9-17)16-19-14(10-20(16)21)11-4-6-18-7-5-11/h2-8,10,21H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.55E+4	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462199 (CHEMBL4251498) Show SMILES CCCCCOc1ccc(cc1C#N)-n1cc(nn1)-c1ccncc1 Show InChI InChI=1S/C19H19N5O/c1-2-3-4-11-25-19-6-5-17(12-16(19)13-20)24-14-18(22-23-24)15-7-9-21-10-8-15/h5-10,12,14H,2-4,11H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.62E+4	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462203 (CHEMBL4239301) Show SMILES CCC(C)Oc1ccc(cc1C#N)-n1cc(nn1)-c1ccncc1 Show InChI InChI=1S/C18H17N5O/c1-3-13(2)24-18-5-4-16(10-15(18)11-19)23-12-17(21-22-23)14-6-8-20-9-7-14/h4-10,12-13H,3H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.82E+4	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462192 (CHEMBL4248086) Show SMILES CCCCOc1ccc(cc1C#N)-n1cc(nn1)-c1ccncc1 Show InChI InChI=1S/C18H17N5O/c1-2-3-10-24-18-5-4-16(11-15(18)12-19)23-13-17(21-22-23)14-6-8-20-9-7-14/h4-9,11,13H,2-3,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.09E+4	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462202 (CHEMBL4243408) Show SMILES COc1ccc(COc2ccc(cc2C#N)-n2cc(nn2)-c2ccncc2)cc1 Show InChI InChI=1S/C22H17N5O2/c1-28-20-5-2-16(3-6-20)15-29-22-7-4-19(12-18(22)13-23)27-14-21(25-26-27)17-8-10-24-11-9-17/h2-12,14H,15H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.34E+4	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462198 (CHEMBL4243524) Show SMILES CC(C)Oc1ccc(cc1C#N)-n1cc(nn1)-c1ccncc1 Show InChI InChI=1S/C17H15N5O/c1-12(2)23-17-4-3-15(9-14(17)10-18)22-11-16(20-21-22)13-5-7-19-8-6-13/h3-9,11-12H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.51E+4	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50462204 (CHEMBL4239183) Show SMILES N#Cc1cc(ccc1OCc1ccccc1)-n1cc(nn1)-c1ccncc1 Show InChI InChI=1S/C21H15N5O/c22-13-18-12-19(6-7-21(18)27-15-16-4-2-1-3-5-16)26-14-20(24-25-26)17-8-10-23-11-9-17/h1-12,14H,15H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.47E+4	n/a	n/a	n/a	n/a
Shenyang Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of bovine xanthine oxidase assessed as reduction in uric acid formation using xanthine as substrate preincubated for 15 mins followed by s...				Eur J Med Chem 146: 668-677 (2018) Article DOI: 10.1016/j.ejmech.2018.01.060 BindingDB Entry DOI: 10.7270/Q2ZW1PKJ
					More data for this Ligand-Target Pair