Found 57 hits of ki data for polymerid = 50004657,5030 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
(Homo sapiens (Human)) | BDBM85771
(6-(N-benzoylamino)purine, 2)Show InChI InChI=1S/C12H9N5O/c18-12(8-4-2-1-3-5-8)17-11-9-10(14-6-13-9)15-7-16-11/h1-7H,(H2,13,14,15,16,17,18) | PDB MMDB
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| Article PubMed
| 0.0475 | n/a | 450 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Pharmaceutical Education and Research
| Assay Description Inhibition assay of the xanthine oxidase reaction by various purine based inhibitors was measured in terms of the decrease in uric acid formation at ... |
J Enzyme Inhib Med Chem 20: 317-24 (2005)
Article DOI: 10.1080/14756360500112326 BindingDB Entry DOI: 10.7270/Q2F76B3T |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50320491
(2-(3-CYANO-4-ISOBUTOXY-PHENYL)-4-METHYL-5-THIAZOLE...)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
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| MMDB PDB Article PubMed
| 0.100 | n/a | n/a | 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 Non-competitive inhibition of human xanthine oxidase |
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 | 3D Structure (crystal) |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50320491
(2-(3-CYANO-4-ISOBUTOXY-PHENYL)-4-METHYL-5-THIAZOLE...)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
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| 0.100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114086 BindingDB Entry DOI: 10.7270/Q27085HM |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50320491
(2-(3-CYANO-4-ISOBUTOXY-PHENYL)-4-METHYL-5-THIAZOLE...)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
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| 0.600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
West China Hospital of Sichuan University
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
Eur J Med Chem 166: 186-196 (2019)
Article DOI: 10.1016/j.ejmech.2019.01.043 BindingDB Entry DOI: 10.7270/Q20C50BS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50320491
(2-(3-CYANO-4-ISOBUTOXY-PHENYL)-4-METHYL-5-THIAZOLE...)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
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| 3.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
West China Hospital of Sichuan University
Curated by ChEMBL
| Assay Description Inhibition of xanthine dehydrogenase (unknown origin) |
Eur J Med Chem 166: 186-196 (2019)
Article DOI: 10.1016/j.ejmech.2019.01.043 BindingDB Entry DOI: 10.7270/Q20C50BS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50603070
(CHEMBL5197177)Show SMILES CC(C)Oc1ccc(cc1C#N)-c1ncc2c(n1)[nH][nH]c2=O | PDB MMDB
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| 3.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114086 BindingDB Entry DOI: 10.7270/Q27085HM |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | 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
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| PC cid PC sid UniChem
| Article PubMed
| 4.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114086 BindingDB Entry DOI: 10.7270/Q27085HM |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50267750
(CHEMBL1078685)Show InChI InChI=1S/C13H8N6/c14-8-11-7-10(3-6-16-11)13-17-12(18-19-13)9-1-4-15-5-2-9/h1-7H,(H,17,18,19) | PDB MMDB
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| 5.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
West China Hospital of Sichuan University
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
Eur J Med Chem 166: 186-196 (2019)
Article DOI: 10.1016/j.ejmech.2019.01.043 BindingDB Entry DOI: 10.7270/Q20C50BS |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051737
(2-Hexylsulfanyl-1,9-dihydro-purin-6-one | CHEMBL86...)Show InChI InChI=1S/C11H16N4OS/c1-2-3-4-5-6-17-11-14-9-8(10(16)15-11)12-7-13-9/h7H,2-6H2,1H3,(H2,12,13,14,15,16) | PDB MMDB
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| Article PubMed
| 9.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50603060
(CHEMBL5186383) | PDB MMDB
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| PC cid PC sid UniChem
| Article PubMed
| 24 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114086 BindingDB Entry DOI: 10.7270/Q27085HM |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50603046
(CHEMBL5189353) | PDB MMDB
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| PC cid PC sid UniChem
| Article PubMed
| 33 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114086 BindingDB Entry DOI: 10.7270/Q27085HM |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50423777
(OXYPURINOL | Oxipurinol)Show InChI InChI=1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11) | PDB MMDB
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| 35 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California
Curated by ChEMBL
| Assay Description Inhibition of human xanthine oxidase |
J Nat Prod 77: 1693-9 (2014)
Article DOI: 10.1021/np500320g BindingDB Entry DOI: 10.7270/Q2QJ7M9S |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50135279
(CHEMBL3747521)Show SMILES Nc1nc2c(c[nH]c2c(=O)[nH]1)C(=O)c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C13H9N5O4/c14-13-16-9-8(5-15-10(9)12(20)17-13)11(19)6-2-1-3-7(4-6)18(21)22/h1-5,15H,(H3,14,16,17,20) | PDB MMDB
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| 55 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Estadual de Campinas
Curated by ChEMBL
| Assay Description Non-competitive inhibition of xanthine oxidase (unknown origin) by Lineweaver-Burk plot analysis |
Bioorg Med Chem 24: 226-31 (2016)
Article DOI: 10.1016/j.bmc.2015.12.006 BindingDB Entry DOI: 10.7270/Q2HX1FGM |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50140241
(Allopurinol | Aloral | Aluline 100 | Aluline 300 |...)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
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| Article PubMed
| 100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California
Curated by ChEMBL
| Assay Description Inhibition of human xanthine oxidase |
J Nat Prod 77: 1693-9 (2014)
Article DOI: 10.1021/np500320g BindingDB Entry DOI: 10.7270/Q2QJ7M9S |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051727
(2-Pentylsulfanyl-1,9-dihydro-purin-6-one | CHEMBL8...)Show InChI InChI=1S/C10H14N4OS/c1-2-3-4-5-16-10-13-8-7(9(15)14-10)11-6-12-8/h6H,2-5H2,1H3,(H2,11,12,13,14,15) | PDB MMDB
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| Article PubMed
| 155 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051734
(2-Hexylsulfanyl-8-hydroxy-1,9-dihydro-purin-6-one ...)Show InChI InChI=1S/C11H16N4O2S/c1-2-3-4-5-6-18-11-14-8-7(9(16)15-11)12-10(17)13-8/h2-6H2,1H3,(H3,12,13,14,15,16,17) | PDB MMDB
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| Article PubMed
| 160 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051711
(2-Butylsulfanyl-1,9-dihydro-purin-6-one | CHEMBL84...)Show InChI InChI=1S/C9H12N4OS/c1-2-3-4-15-9-12-7-6(8(14)13-9)10-5-11-7/h5H,2-4H2,1H3,(H2,10,11,12,13,14) | PDB MMDB
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| Article PubMed
| 176 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051714
(CHEMBL85737 | N-(5-Carbamoyl-3H-imidazol-4-yl)-oxa...)Show InChI InChI=1S/C12H18N4O4/c1-2-3-4-5-6-20-12(19)11(18)16-10-8(9(13)17)14-7-15-10/h7H,2-6H2,1H3,(H2,13,17)(H,14,15)(H,16,18) | PDB MMDB
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| Article PubMed
| 260 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM7460
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H | PDB MMDB
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| PDB Article PubMed
| 280 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) at 37 degC at ph 7..8 |
J Nat Prod 77: 1693-9 (2014)
Article DOI: 10.1021/np500320g BindingDB Entry DOI: 10.7270/Q2QJ7M9S |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051732
(2-Hydroxy-7,8-dihydro-3H,6H-9-thia-1,3,4,5a-tetraa...)Show InChI InChI=1S/C8H8N4O2S/c13-7-9-4-5(10-7)11-8(14)12-2-1-3-15-6(4)12/h1-3H2,(H2,9,10,11,13,14) | PDB MMDB
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| Article PubMed
| 330 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051739
(2-Hexylsulfanyl-8-phenyl-1,9-dihydro-purin-6-one |...)Show InChI InChI=1S/C17H20N4OS/c1-2-3-4-8-11-23-17-20-15-13(16(22)21-17)18-14(19-15)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3,(H2,18,19,20,21,22) | PDB MMDB
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| Article PubMed
| 490 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM7458
(5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one...)Show InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H | PDB MMDB
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| Article PubMed
| 520 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Punjabi University
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
Eur J Med Chem 84: 206-39 (2014)
Article DOI: 10.1016/j.ejmech.2014.07.013 BindingDB Entry DOI: 10.7270/Q2GH9KMN |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50140241
(Allopurinol | Aloral | Aluline 100 | Aluline 300 |...)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
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| Article PubMed
| 700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.ejmech.2021.114086 BindingDB Entry DOI: 10.7270/Q27085HM |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50140241
(Allopurinol | Aloral | Aluline 100 | Aluline 300 |...)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
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| Article PubMed
| 700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
West China Hospital of Sichuan University
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
Eur J Med Chem 166: 186-196 (2019)
Article DOI: 10.1016/j.ejmech.2019.01.043 BindingDB Entry DOI: 10.7270/Q20C50BS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051722
(2-Mercapto-7,8-dihydro-3H,6H-9-thia-1,3,4,5a-tetra...)Show InChI InChI=1S/C8H8N4OS2/c13-8-11-5-4(9-7(14)10-5)6-12(8)2-1-3-15-6/h1-3H2,(H2,9,10,11,13,14) | PDB MMDB
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Similars
| Article PubMed
| 890 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50423777
(OXYPURINOL | Oxipurinol)Show InChI InChI=1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11) | PDB MMDB
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| 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of California
Curated by ChEMBL
| Assay Description Inhibition of oxidized form of human xanthine oxidase |
J Nat Prod 77: 1693-9 (2014)
Article DOI: 10.1021/np500320g BindingDB Entry DOI: 10.7270/Q2QJ7M9S |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051710
(CHEMBL83530 | N-(5-Carbamoyl-3H-imidazol-4-yl)-oxa...)Show InChI InChI=1S/C11H16N4O4/c1-2-3-4-5-19-11(18)10(17)15-9-7(8(12)16)13-6-14-9/h6H,2-5H2,1H3,(H2,12,16)(H,13,14)(H,15,17) | PDB MMDB
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| Article PubMed
| 1.04E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051716
(CHEMBL84643 | N-(5-Carbamoyl-3H-imidazol-4-yl)-oxa...)Show InChI InChI=1S/C10H14N4O4/c1-2-3-4-18-10(17)9(16)14-8-6(7(11)15)12-5-13-8/h5H,2-4H2,1H3,(H2,11,15)(H,12,13)(H,14,16) | PDB MMDB
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| Article PubMed
| 1.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051725
(2-Hydroxy-7,8-dihydro-3H-thiazolo[2,3-i]purin-5-on...)Show InChI InChI=1S/C7H6N4O2S/c12-6-8-3-4(9-6)10-7(13)11-1-2-14-5(3)11/h1-2H2,(H2,8,9,10,12,13) | PDB MMDB
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| Article PubMed
| 1.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50016784
(ALLOPURINOL | BW-56-158 | BW-56158 | CHEBI:40279 |...)Show InChI InChI=1S/C5H2N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H | PDB MMDB
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| 1.55E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universidade Estadual de Campinas
Curated by ChEMBL
| Assay Description Non-competitive inhibition of xanthine oxidase (unknown origin) by Lineweaver-Burk plot analysis |
Bioorg Med Chem 24: 226-31 (2016)
Article DOI: 10.1016/j.bmc.2015.12.006 BindingDB Entry DOI: 10.7270/Q2HX1FGM |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051740
(2-Mercapto-7,8-dihydro-3H-thiazolo[2,3-i]purin-5-o...)Show InChI InChI=1S/C7H6N4OS2/c12-7-10-4-3(8-6(13)9-4)5-11(7)1-2-14-5/h1-2H2,(H2,8,9,10,12,13) | PDB MMDB
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| Article PubMed
| 1.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051712
(2-Mercapto-8-phenyl-1,9-dihydro-purin-6-one | CHEM...)Show InChI InChI=1S/C11H8N4OS/c16-10-7-9(14-11(17)15-10)13-8(12-7)6-4-2-1-3-5-6/h1-5H,(H3,12,13,14,15,16,17) | PDB MMDB
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| Article PubMed
| 2.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051738
(5-Hexanoylamino-1H-imidazole-4-carboxylic acid ami...)Show InChI InChI=1S/C10H16N4O2/c1-2-3-4-5-7(15)14-10-8(9(11)16)12-6-13-10/h6H,2-5H2,1H3,(H2,11,16)(H,12,13)(H,14,15) | PDB MMDB
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| Article PubMed
| 2.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50460206
(CHEMBL4228510)Show InChI InChI=1S/C17H16N2O4/c1-21-12-5-3-11(4-6-12)9-15(19-20)17-18-14-8-7-13(22-2)10-16(14)23-17/h3-8,10,20H,9H2,1-2H3/b19-15+ | PDB MMDB
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| 2.89E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Soochow University
Curated by ChEMBL
| Assay Description Competitive inhibition of Xanthine oxidase (unknown origin) using xanthine as substrate preincubated for 1 to 5 mins followed by substrate addition b... |
Bioorg Med Chem 26: 1653-1664 (2018)
Article DOI: 10.1016/j.bmc.2018.02.013 BindingDB Entry DOI: 10.7270/Q2QZ2DK4 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM7459
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4...)Show InChI InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H | PDB MMDB
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| 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Punjabi University
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
Eur J Med Chem 84: 206-39 (2014)
Article DOI: 10.1016/j.ejmech.2014.07.013 BindingDB Entry DOI: 10.7270/Q2GH9KMN |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50233808
(CHEMBL4086701 | US11021454, Compound 6e)Show SMILES OC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)\C=C\c1ccc(O)c2oc(cc12)-c1ccc(O)c(O)c1 |r| Show InChI InChI=1S/C26H21NO8/c28-17-6-1-14(2-7-17)11-19(26(33)34)27-24(32)10-5-15-3-9-21(30)25-18(15)13-23(35-25)16-4-8-20(29)22(31)12-16/h1-10,12-13,19,28-31H,11H2,(H,27,32)(H,33,34)/b10-5+/t19-/m0/s1 | PDB MMDB
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| Article PubMed
| 3.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
China Pharmaceutical University
Curated by ChEMBL
| Assay Description Mixed-type competitive inhibition of Xanthine oxidase (unknown origin) assessed as enzyme-inhibitor complex preincubated for 3 mins followed by xanth... |
Eur J Med Chem 124: 637-648 (2016)
Article DOI: 10.1016/j.ejmech.2016.08.019 BindingDB Entry DOI: 10.7270/Q2SJ1NVQ |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051713
(2-Benzylsulfanyl-8-hydroxy-1,9-dihydro-purin-6-one...)Show InChI InChI=1S/C12H10N4O2S/c17-10-8-9(14-11(18)13-8)15-12(16-10)19-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,13,14,15,16,17,18) | PDB MMDB
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| Article PubMed
| 4.49E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051731
(2-Methylsulfanyl-8-phenyl-1,9-dihydro-purin-6-one ...)Show InChI InChI=1S/C12H10N4OS/c1-18-12-15-10-8(11(17)16-12)13-9(14-10)7-5-3-2-4-6-7/h2-6H,1H3,(H2,13,14,15,16,17) | PDB MMDB
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| Article PubMed
| 5.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM35440
(ALLOPURINOL | MLS000069453 | SMR000059083 | cid_20...)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
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| 7.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50016784
(ALLOPURINOL | BW-56-158 | BW-56158 | CHEBI:40279 |...)Show InChI InChI=1S/C5H2N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H | PDB MMDB
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| 7.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Punjabi University
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
Eur J Med Chem 84: 206-39 (2014)
Article DOI: 10.1016/j.ejmech.2014.07.013 BindingDB Entry DOI: 10.7270/Q2GH9KMN |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50269378
(CHEMBL447311 | apigenin-4'-O-(2''-O-p-coumaroyl)-b...)Show SMILES OC[C@@H]1O[C@H](Oc2ccc(cc2)-c2cc(O)c3c(cc(O)cc3=O)o2)[C@@H](OC(=O)C=Cc2ccc(O)cc2)[C@H](O)[C@H]1O |r,w:29.31| Show InChI InChI=1S/C30H26O12/c31-14-24-27(37)28(38)29(42-25(36)10-3-15-1-6-17(32)7-2-15)30(41-24)39-19-8-4-16(5-9-19)22-13-21(35)26-20(34)11-18(33)12-23(26)40-22/h1-13,24,27-33,35,37-38H,14H2/t24-,27-,28+,29-,30-/m0/s1 | PDB MMDB
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| Article PubMed
| 1.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) by competitive Lineweaver-burk plot |
J Nat Prod 69: 1089-91 (2006)
Article DOI: 10.1021/np060038a BindingDB Entry DOI: 10.7270/Q2RV0NG6 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50013097
(2-Butylamino-1,9-dihydro-purin-6-one | 2-Butylamin...)Show InChI InChI=1S/C9H13N5O/c1-2-3-4-10-9-13-7-6(8(15)14-9)11-5-12-7/h5H,2-4H2,1H3,(H3,10,11,12,13,14,15) | PDB MMDB
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| Article PubMed
| 1.77E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051726
(2-Mercapto-6,7-dihydro-3H-thiazolo[3,2-a]purin-9-o...)Show InChI InChI=1S/C7H6N4OS2/c12-5-3-4(9-6(13)8-3)10-7-11(5)1-2-14-7/h1-2H2,(H2,8,9,13) | PDB MMDB
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| Article PubMed
| 2.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051743
(2-Pentylamino-1,9-dihydro-purin-6-one | CHEMBL8431...)Show InChI InChI=1S/C10H15N5O/c1-2-3-4-5-11-10-14-8-7(9(16)15-10)12-6-13-8/h6H,2-5H2,1H3,(H3,11,12,13,14,15,16) | PDB MMDB
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| Article PubMed
| 2.57E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50330722
(2-(2-chlorophenyl)-4-methyl-5-(pyridin-2-ylmethyl)...)Show SMILES Cc1n(Cc2ccccn2)c(=O)cc2[nH]n(-c3ccccc3Cl)c(=O)c12 Show InChI InChI=1S/C19H15ClN4O2/c1-12-18-15(10-17(25)23(12)11-13-6-4-5-9-21-13)22-24(19(18)26)16-8-3-2-7-14(16)20/h2-10,22H,11H2,1H3 | PDB MMDB
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| Article PubMed
| >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genkyotex, S.A.
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase by invitro enzymatic assay in presence of xanthine |
J Med Chem 53: 7715-30 (2010)
Article DOI: 10.1021/jm100773e BindingDB Entry DOI: 10.7270/Q2KH0NKJ |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50359523
(CHEMBL1927147)Show SMILES Clc1ccccc1-n1[nH]c2cc(=O)n3CCCN(Cc4ccccc4)Cc3c2c1=O Show InChI InChI=1S/C23H21ClN4O2/c24-17-9-4-5-10-19(17)28-23(30)22-18(25-28)13-21(29)27-12-6-11-26(15-20(22)27)14-16-7-2-1-3-8-16/h1-5,7-10,13,25H,6,11-12,14-15H2 | PDB MMDB
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Similars
| Article PubMed
| >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genkyotex S.A.
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase assessed as inhibition of ROS production after 20 mins by cell-free amplex red assay |
Bioorg Med Chem 19: 6989-99 (2011)
Article DOI: 10.1016/j.bmc.2011.10.016 BindingDB Entry DOI: 10.7270/Q2ZP46JC |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50330688
(4-methyl-2-phenyl-5-(pyridin-3-ylmethyl)-1H-pyrazo...)Show SMILES Cc1n(Cc2cccnc2)c(=O)cc2[nH]n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C19H16N4O2/c1-13-18-16(21-23(19(18)25)15-7-3-2-4-8-15)10-17(24)22(13)12-14-6-5-9-20-11-14/h2-11,21H,12H2,1H3 | PDB MMDB
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| Article PubMed
| >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Genkyotex, S.A.
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase by invitro enzymatic assay in presence of xanthine |
J Med Chem 53: 7715-30 (2010)
Article DOI: 10.1021/jm100773e BindingDB Entry DOI: 10.7270/Q2KH0NKJ |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50013077
(2-Hexylamino-1,9-dihydro-purin-6-one | 2-Hexylamin...)Show InChI InChI=1S/C11H17N5O/c1-2-3-4-5-6-12-11-15-9-8(10(17)16-11)13-7-14-9/h7H,2-6H2,1H3,(H3,12,13,14,15,16,17) | PDB MMDB
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| Article PubMed
| 3.21E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051719
(2-Hydroxy-6,7-dihydro-3H-thiazolo[3,2-a]purin-9-on...)Show InChI InChI=1S/C7H6N4O2S/c12-5-3-4(9-6(13)8-3)10-7-11(5)1-2-14-7/h1-2H2,(H2,8,9,13) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 4.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50051715
(2-Hydroxy-7,8-dihydro-3H,6H-5-thia-1,3,4,8a-tetraa...)Show InChI InChI=1S/C8H8N4O2S/c13-6-4-5(10-7(14)9-4)11-8-12(6)2-1-3-15-8/h1-3H2,(H2,9,10,14) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 6.68E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Modena
Curated by ChEMBL
| Assay Description Inhibitory activity against Xanthine Oxidase |
J Med Chem 39: 2529-35 (1996)
Article DOI: 10.1021/jm950876u BindingDB Entry DOI: 10.7270/Q23R0RZS |
More data for this Ligand-Target Pair | |