Compile Data Set for Download or QSAR

Found 22 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50008239   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517031 (CHEMBL4469027) Show SMILES CC(=C)COc1ccc(cc1C#N)-c1ncc(C(O)=O)c(=N)[nH]1 Show InChI InChI=1S/C16H14N4O3/c1-9(2)8-23-13-4-3-10(5-11(13)6-17)15-19-7-12(16(21)22)14(18)20-15/h3-5,7H,1,8H2,2H3,(H,21,22)(H2,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517021 (CHEMBL4445985) Show SMILES CC(C)CCOc1ccc(cc1C#N)-c1ncc(C(O)=O)c(=N)[nH]1 Show InChI InChI=1S/C17H18N4O3/c1-10(2)5-6-24-14-4-3-11(7-12(14)8-18)16-20-9-13(17(22)23)15(19)21-16/h3-4,7,9-10H,5-6H2,1-2H3,(H,22,23)(H2,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	24	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50320491 (2-(3-CYANO-4-ISOBUTOXY-PHENYL)-4-METHYL-5-THIAZOLE...) Show SMILES CC(C)COc1ccc(cc1C#N)-c1nc(C)c(s1)C(O)=O Show InChI InChI=1S/C16H16N2O3S/c1-9(2)8-21-13-5-4-11(6-12(13)7-17)15-18-10(3)14(22-15)16(19)20/h4-6,9H,8H2,1-3H3,(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents	MMDB PDB Article PubMed	n/a	n/a	24	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair				3D Structure (crystal)
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517028 (CHEMBL4449922) Show SMILES CC(C)CCOc1ccc(cc1C#N)-c1ncc(C(O)=O)c(=O)[nH]1 Show InChI InChI=1S/C17H17N3O4/c1-10(2)5-6-24-14-4-3-11(7-12(14)8-18)15-19-9-13(17(22)23)16(21)20-15/h3-4,7,9-10H,5-6H2,1-2H3,(H,22,23)(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517022 (CHEMBL4552356) Show SMILES OC(=O)c1cnc([nH]c1=N)-c1ccc(OCc2ccc(Br)cc2)c(c1)C#N Show InChI InChI=1S/C19H13BrN4O3/c20-14-4-1-11(2-5-14)10-27-16-6-3-12(7-13(16)8-21)18-23-9-15(19(25)26)17(22)24-18/h1-7,9H,10H2,(H,25,26)(H2,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	27	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517018 (CHEMBL4580079) Show SMILES OC(=O)c1cnc([nH]c1=O)-c1ccc(OCc2ccc(Br)cc2)c(c1)C#N Show InChI InChI=1S/C19H12BrN3O4/c20-14-4-1-11(2-5-14)10-27-16-6-3-12(7-13(16)8-21)17-22-9-15(19(25)26)18(24)23-17/h1-7,9H,10H2,(H,25,26)(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517015 (CHEMBL4557837) Show SMILES CC(=C)COc1ccc(cc1C#N)-c1ncc(C(O)=O)c(=O)[nH]1 Show InChI InChI=1S/C16H13N3O4/c1-9(2)8-23-13-4-3-10(5-11(13)6-17)14-18-7-12(16(21)22)15(20)19-14/h3-5,7H,1,8H2,2H3,(H,21,22)(H,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	34	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517023 (CHEMBL4459977) Show SMILES Cc1ccc(COc2ccc(cc2C#N)-c2ncc(C(O)=O)c(=N)[nH]2)cc1 Show InChI InChI=1S/C20H16N4O3/c1-12-2-4-13(5-3-12)11-27-17-7-6-14(8-15(17)9-21)19-23-10-16(20(25)26)18(22)24-19/h2-8,10H,11H2,1H3,(H,25,26)(H2,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	34	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517030 (CHEMBL4568441) Show SMILES Cc1ccc(COc2ccc(cc2C#N)-c2ncc(C(O)=O)c(=O)[nH]2)cc1 Show InChI InChI=1S/C20H15N3O4/c1-12-2-4-13(5-3-12)11-27-17-7-6-14(8-15(17)9-21)18-22-10-16(20(25)26)19(24)23-18/h2-8,10H,11H2,1H3,(H,25,26)(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	35	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517029 (CHEMBL4580263) Show SMILES OC(=O)c1cnc([nH]c1=O)-c1ccc(OCc2ccc(F)cc2)c(c1)C#N Show InChI InChI=1S/C19H12FN3O4/c20-14-4-1-11(2-5-14)10-27-16-6-3-12(7-13(16)8-21)17-22-9-15(19(25)26)18(24)23-17/h1-7,9H,10H2,(H,25,26)(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	38	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517016 (CHEMBL4466452) Show SMILES CC(C)=CCOc1ccc(cc1C#N)-c1ncc(C(O)=O)c(=O)[nH]1 |(24.09,-24.17,;25.43,-23.4,;25.43,-21.86,;26.76,-24.17,;28.1,-23.4,;29.43,-24.18,;30.76,-23.41,;30.76,-21.86,;32.09,-21.09,;33.43,-21.86,;33.43,-23.41,;32.1,-24.18,;32.1,-25.71,;32.1,-27.25,;34.75,-21.08,;36.09,-21.85,;37.42,-21.08,;37.42,-19.54,;38.75,-18.76,;40.08,-19.52,;38.74,-17.22,;36.07,-18.77,;36.06,-17.23,;34.75,-19.55,)| Show InChI InChI=1S/C17H15N3O4/c1-10(2)5-6-24-14-4-3-11(7-12(14)8-18)15-19-9-13(17(22)23)16(21)20-15/h3-5,7,9H,6H2,1-2H3,(H,22,23)(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	39	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517025 (CHEMBL4462774) Show SMILES OC(=O)c1cnc([nH]c1=O)-c1ccc(OCc2ccccc2)c(c1)C#N Show InChI InChI=1S/C19H13N3O4/c20-9-14-8-13(17-21-10-15(19(24)25)18(23)22-17)6-7-16(14)26-11-12-4-2-1-3-5-12/h1-8,10H,11H2,(H,24,25)(H,21,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	39	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517017 (CHEMBL4547403) Show SMILES OC(=O)c1cnc([nH]c1=O)-c1ccc(OCc2ccc(Cl)cc2)c(c1)C#N Show InChI InChI=1S/C19H12ClN3O4/c20-14-4-1-11(2-5-14)10-27-16-6-3-12(7-13(16)8-21)17-22-9-15(19(25)26)18(24)23-17/h1-7,9H,10H2,(H,25,26)(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517024 (CHEMBL4441743) Show SMILES CC(C)COc1ccc(cc1C#N)-c1ncc(C(O)=O)c(=O)[nH]1 Show InChI InChI=1S/C16H15N3O4/c1-9(2)8-23-13-4-3-10(5-11(13)6-17)14-18-7-12(16(21)22)15(20)19-14/h3-5,7,9H,8H2,1-2H3,(H,21,22)(H,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	61	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517027 (CHEMBL4583966) Show SMILES OC(=O)c1cnc([nH]c1=O)-c1ccc(OCC=C)c(c1)C#N Show InChI InChI=1S/C15H11N3O4/c1-2-5-22-12-4-3-9(6-10(12)7-16)13-17-8-11(15(20)21)14(19)18-13/h2-4,6,8H,1,5H2,(H,20,21)(H,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	81	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517014 (CHEMBL4473001) Show SMILES CC(C)Oc1ccc(cc1C#N)-c1ncc(C(O)=O)c(=O)[nH]1 Show InChI InChI=1S/C15H13N3O4/c1-8(2)22-12-4-3-9(5-10(12)6-16)13-17-7-11(15(20)21)14(19)18-13/h3-5,7-8H,1-2H3,(H,20,21)(H,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	92	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517013 (CHEMBL4536160) Show SMILES Cc1ccc(COc2ccc(cc2C#N)-c2nc(C)c(C(O)=O)c(=O)[nH]2)cc1 Show InChI InChI=1S/C21H17N3O4/c1-12-3-5-14(6-4-12)11-28-17-8-7-15(9-16(17)10-22)19-23-13(2)18(21(26)27)20(25)24-19/h3-9H,11H2,1-2H3,(H,26,27)(H,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	159	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517032 (CHEMBL4452160) Show SMILES Cc1nc([nH]c(=O)c1C(O)=O)-c1ccc(OCc2ccc(Br)cc2)c(c1)C#N Show InChI InChI=1S/C20H14BrN3O4/c1-11-17(20(26)27)19(25)24-18(23-11)13-4-7-16(14(8-13)9-22)28-10-12-2-5-15(21)6-3-12/h2-8H,10H2,1H3,(H,26,27)(H,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	185	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517019 (CHEMBL4442230) Show SMILES CC(C)(C)c1ccc(COc2ccc(cc2C#N)-c2ncc(C(O)=O)c(=O)[nH]2)cc1 Show InChI InChI=1S/C23H21N3O4/c1-23(2,3)17-7-4-14(5-8-17)13-30-19-9-6-15(10-16(19)11-24)20-25-12-18(22(28)29)21(27)26-20/h4-10,12H,13H2,1-3H3,(H,28,29)(H,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	197	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517020 (CHEMBL4458786) Show SMILES CC(C)CCOc1ccc(cc1C#N)-c1nc(C)c(C(O)=O)c(=O)[nH]1 Show InChI InChI=1S/C18H19N3O4/c1-10(2)6-7-25-14-5-4-12(8-13(14)9-19)16-20-11(3)15(18(23)24)17(22)21-16/h4-5,8,10H,6-7H2,1-3H3,(H,23,24)(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	540	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50517026 (CHEMBL4441574) Show SMILES CC(=C)COc1ccc(cc1C#N)-c1nc(C)c(C(O)=O)c(=O)[nH]1 Show InChI InChI=1S/C17H15N3O4/c1-9(2)8-24-13-5-4-11(6-12(13)7-18)15-19-10(3)14(17(22)23)16(21)20-15/h4-6H,1,8H2,2-3H3,(H,22,23)(H,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	568	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair
Xanthine dehydrogenase/oxidase (Bos taurus (Bovine))	BDBM50140241 (Allopurinol | Aloral | Aluline 100 | Aluline 300 |...) Show SMILES O=c1[nH]cnc2[nH]ncc12 Show InChI InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.59E+3	n/a	n/a	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 with enzyme for 15 mins f...				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.07.061 BindingDB Entry DOI: 10.7270/Q2ST7T69
					More data for this Ligand-Target Pair